data_26060 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 26060 _Entry.PDB_ID 2NDG 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 26060 _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 4 4 MET C C 4 175.800 175.800 175.084 0.716 26060 2 1 1 . 1 1 4 4 MET CA C 4 55.350 55.350 55.383 -0.033 26060 3 1 1 . 1 1 4 4 MET CB C 4 32.880 32.880 33.134 -0.254 26060 4 1 1 . 1 1 5 5 ALA N N 5 125.230 125.230 127.128 -1.898 26060 5 1 1 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.427 -0.077 26060 6 1 1 . 1 1 5 5 ALA CA C 5 52.430 52.430 52.067 0.363 26060 7 1 1 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.436 -0.066 26060 8 1 1 . 1 1 5 5 ALA H H 5 8.320 8.320 8.852 -0.532 26060 9 1 1 . 1 1 6 6 SER HA H 6 4.490 4.490 4.566 -0.076 26060 10 1 1 . 1 1 6 6 SER CA C 6 58.200 58.200 57.386 0.814 26060 11 1 1 . 1 1 6 6 SER CB C 6 63.700 63.700 63.909 -0.209 26060 12 1 1 . 1 1 7 7 SER HA H 7 4.530 4.530 4.721 -0.191 26060 13 1 1 . 1 1 7 7 SER CA C 7 58.200 58.200 58.409 -0.209 26060 14 1 1 . 1 1 7 7 SER CB C 7 63.700 63.700 63.229 0.471 26060 15 1 1 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.726 -0.116 26060 16 1 1 . 1 1 8 8 CYS C C 8 173.500 173.500 173.345 0.155 26060 17 1 1 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.293 2.047 26060 18 1 1 . 1 1 8 8 CYS CB C 8 28.490 28.490 28.983 -0.493 26060 19 1 1 . 1 1 9 9 ALA N N 9 124.700 124.700 128.915 -4.215 26060 20 1 1 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.105 -0.315 26060 21 1 1 . 1 1 9 9 ALA C C 9 177.400 177.400 176.545 0.855 26060 22 1 1 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.393 1.677 26060 23 1 1 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.370 0.259 26060 24 1 1 . 1 1 9 9 ALA H H 9 7.960 7.960 8.536 -0.576 26060 25 1 1 . 1 1 10 10 VAL N N 10 120.124 120.124 124.678 -4.554 26060 26 1 1 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.151 0.139 26060 27 1 1 . 1 1 10 10 VAL C C 10 173.900 173.900 175.083 -1.183 26060 28 1 1 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.553 -0.003 26060 29 1 1 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.735 2.165 26060 30 1 1 . 1 1 10 10 VAL H H 10 8.424 8.424 8.609 -0.185 26060 31 1 1 . 1 1 11 11 GLN N N 11 125.818 125.818 127.225 -1.407 26060 32 1 1 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.243 0.317 26060 33 1 1 . 1 1 11 11 GLN C C 11 175.400 175.400 175.616 -0.216 26060 34 1 1 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.517 -0.394 26060 35 1 1 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.392 1.637 26060 36 1 1 . 1 1 11 11 GLN H H 11 8.636 8.636 8.517 0.119 26060 37 1 1 . 1 1 12 12 VAL N N 12 119.106 119.106 118.803 0.303 26060 38 1 1 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.342 0.288 26060 39 1 1 . 1 1 12 12 VAL C C 12 173.800 173.800 174.195 -0.395 26060 40 1 1 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.595 0.205 26060 41 1 1 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.528 2.183 26060 42 1 1 . 1 1 12 12 VAL H H 12 8.827 8.827 8.687 0.140 26060 43 1 1 . 1 1 13 13 LYS N N 13 121.700 121.700 126.290 -4.590 26060 44 1 1 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.274 -0.074 26060 45 1 1 . 1 1 13 13 LYS C C 13 175.030 175.030 175.220 -0.190 26060 46 1 1 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.979 0.451 26060 47 1 1 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.558 1.362 26060 48 1 1 . 1 1 13 13 LYS H H 13 8.234 8.234 8.605 -0.371 26060 49 1 1 . 1 1 14 14 LEU N N 14 119.100 119.100 126.346 -7.246 26060 50 1 1 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.422 -0.472 26060 51 1 1 . 1 1 14 14 LEU C C 14 175.110 175.110 175.312 -0.202 26060 52 1 1 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.494 -0.137 26060 53 1 1 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.567 1.354 26060 54 1 1 . 1 1 14 14 LEU H H 14 8.840 8.840 8.420 0.420 26060 55 1 1 . 1 1 15 15 GLU N N 15 120.978 120.978 122.469 -1.491 26060 56 1 1 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.177 -0.187 26060 57 1 1 . 1 1 15 15 GLU C C 15 173.800 173.800 174.891 -1.091 26060 58 1 1 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.572 0.856 26060 59 1 1 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.078 -1.252 26060 60 1 1 . 1 1 15 15 GLU H H 15 9.181 9.181 9.270 -0.089 26060 61 1 1 . 1 1 16 16 LEU N N 16 124.438 124.438 126.798 -2.360 26060 62 1 1 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.329 -0.219 26060 63 1 1 . 1 1 16 16 LEU C C 16 174.700 174.700 176.097 -1.397 26060 64 1 1 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.705 0.371 26060 65 1 1 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.161 2.731 26060 66 1 1 . 1 1 16 16 LEU H H 16 8.891 8.891 8.808 0.083 26060 67 1 1 . 1 1 17 17 GLY N N 17 108.067 108.067 109.253 -1.186 26060 68 1 1 . 1 1 17 17 GLY C C 17 170.350 170.350 172.340 -1.990 26060 69 1 1 . 1 1 17 17 GLY CA C 17 46.984 46.984 44.965 2.019 26060 70 1 1 . 1 1 17 17 GLY H H 17 7.227 7.227 8.569 -1.342 26060 71 1 1 . 1 1 18 18 HIS N N 18 111.200 111.200 118.498 -7.298 26060 72 1 1 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.882 -0.262 26060 73 1 1 . 1 1 18 18 HIS C C 18 172.400 172.400 172.762 -0.362 26060 74 1 1 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.741 -0.801 26060 75 1 1 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.502 1.658 26060 76 1 1 . 1 1 18 18 HIS H H 18 8.150 8.150 9.201 -1.051 26060 77 1 1 . 1 1 19 19 ARG N N 19 117.800 117.800 122.078 -4.278 26060 78 1 1 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.848 0.252 26060 79 1 1 . 1 1 19 19 ARG C C 19 175.800 175.800 174.259 1.541 26060 80 1 1 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.063 -0.563 26060 81 1 1 . 1 1 19 19 ARG CB C 19 34.650 34.650 34.881 -0.231 26060 82 1 1 . 1 1 19 19 ARG H H 19 9.010 9.010 8.899 0.111 26060 83 1 1 . 1 1 20 20 ALA N N 20 120.390 120.390 122.010 -1.620 26060 84 1 1 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.590 -0.060 26060 85 1 1 . 1 1 20 20 ALA C C 20 175.800 175.800 175.084 0.716 26060 86 1 1 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.933 1.257 26060 87 1 1 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.191 0.559 26060 88 1 1 . 1 1 20 20 ALA H H 20 8.070 8.070 8.559 -0.489 26060 89 1 1 . 1 1 21 21 GLN N N 21 121.790 121.790 121.398 0.392 26060 90 1 1 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.845 0.385 26060 91 1 1 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.849 -0.519 26060 92 1 1 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.572 0.328 26060 93 1 1 . 1 1 21 21 GLN H H 21 9.240 9.240 8.981 0.259 26060 94 1 1 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.579 -0.949 26060 95 1 1 . 1 1 22 22 VAL C C 22 176.500 176.500 176.129 0.371 26060 96 1 1 . 1 1 22 22 VAL CA C 22 63.030 63.030 61.072 1.958 26060 97 1 1 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.015 -1.415 26060 98 1 1 . 1 1 23 23 ARG N N 23 127.840 127.840 125.649 2.191 26060 99 1 1 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.587 -0.457 26060 100 1 1 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.031 1.569 26060 101 1 1 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.858 1.292 26060 102 1 1 . 1 1 23 23 ARG H H 23 8.720 8.720 8.362 0.358 26060 103 1 1 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.103 -0.063 26060 104 1 1 . 1 1 24 24 LYS C C 24 176.960 176.960 176.217 0.743 26060 105 1 1 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.934 0.867 26060 106 1 1 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.598 -0.538 26060 107 1 1 . 1 1 25 25 LYS N N 25 115.870 115.870 119.752 -3.882 26060 108 1 1 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.681 0.149 26060 109 1 1 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.211 -0.251 26060 110 1 1 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.020 2.059 26060 111 1 1 . 1 1 25 25 LYS H H 25 7.720 7.720 7.713 0.007 26060 112 1 1 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.613 0.217 26060 113 1 1 . 1 1 26 26 PRO C C 26 177.400 177.400 177.064 0.336 26060 114 1 1 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.878 -0.228 26060 115 1 1 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.454 -0.064 26060 116 1 1 . 1 1 27 27 THR N N 27 111.270 111.270 114.047 -2.777 26060 117 1 1 . 1 1 27 27 THR HA H 27 4.530 4.530 4.236 0.294 26060 118 1 1 . 1 1 27 27 THR C C 27 177.300 177.300 176.908 0.392 26060 119 1 1 . 1 1 27 27 THR CA C 27 61.300 61.300 61.030 0.270 26060 120 1 1 . 1 1 27 27 THR CB C 27 71.460 71.460 69.933 1.526 26060 121 1 1 . 1 1 27 27 THR H H 27 8.380 8.380 8.142 0.238 26060 122 1 1 . 1 1 28 28 VAL N N 28 121.170 121.170 122.609 -1.439 26060 123 1 1 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.806 0.077 26060 124 1 1 . 1 1 28 28 VAL C C 28 177.030 177.030 176.148 0.882 26060 125 1 1 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.115 0.085 26060 126 1 1 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.642 -0.242 26060 127 1 1 . 1 1 28 28 VAL H H 28 8.910 8.910 8.520 0.390 26060 128 1 1 . 1 1 29 29 GLU N N 29 116.800 116.800 116.844 -0.044 26060 129 1 1 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.171 -0.251 26060 130 1 1 . 1 1 29 29 GLU C C 29 176.200 176.200 175.958 0.242 26060 131 1 1 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.447 1.803 26060 132 1 1 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.418 -1.248 26060 133 1 1 . 1 1 29 29 GLU H H 29 7.990 7.990 8.048 -0.058 26060 134 1 1 . 1 1 30 30 GLY N N 30 105.500 105.500 107.765 -2.265 26060 135 1 1 . 1 1 30 30 GLY C C 30 174.900 174.900 173.932 0.968 26060 136 1 1 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.192 -0.732 26060 137 1 1 . 1 1 30 30 GLY H H 30 7.950 7.950 7.779 0.171 26060 138 1 1 . 1 1 31 31 PHE N N 31 119.300 119.300 119.039 0.261 26060 139 1 1 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.924 -0.164 26060 140 1 1 . 1 1 31 31 PHE C C 31 176.400 176.400 175.983 0.417 26060 141 1 1 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.590 1.310 26060 142 1 1 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.139 -3.639 26060 143 1 1 . 1 1 31 31 PHE H H 31 7.520 7.520 7.389 0.131 26060 144 1 1 . 1 1 32 32 THR N N 32 112.300 112.300 116.063 -3.763 26060 145 1 1 . 1 1 32 32 THR HA H 32 4.330 4.330 4.486 -0.156 26060 146 1 1 . 1 1 32 32 THR C C 32 175.200 175.200 174.407 0.793 26060 147 1 1 . 1 1 32 32 THR CA C 32 62.780 62.780 62.719 0.061 26060 148 1 1 . 1 1 32 32 THR CB C 32 70.350 70.350 70.180 0.170 26060 149 1 1 . 1 1 32 32 THR H H 32 7.770 7.770 9.139 -1.369 26060 150 1 1 . 1 1 33 33 HIS N N 33 121.900 121.900 122.141 -0.241 26060 151 1 1 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.037 0.463 26060 152 1 1 . 1 1 33 33 HIS C C 33 173.880 173.880 173.593 0.287 26060 153 1 1 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.715 0.065 26060 154 1 1 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.417 4.223 26060 155 1 1 . 1 1 33 33 HIS H H 33 9.110 9.110 8.859 0.251 26060 156 1 1 . 1 1 34 34 ASP N N 34 120.300 120.300 125.407 -5.107 26060 157 1 1 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.454 -0.054 26060 158 1 1 . 1 1 34 34 ASP C C 34 175.100 175.100 175.079 0.021 26060 159 1 1 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.146 -0.836 26060 160 1 1 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.437 -0.337 26060 161 1 1 . 1 1 34 34 ASP H H 34 8.810 8.810 8.658 0.152 26060 162 1 1 . 1 1 35 35 TRP N N 35 119.800 119.800 121.037 -1.237 26060 163 1 1 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.610 0.120 26060 164 1 1 . 1 1 35 35 TRP C C 35 174.900 174.900 173.392 1.508 26060 165 1 1 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.963 -0.063 26060 166 1 1 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.217 1.853 26060 167 1 1 . 1 1 35 35 TRP H H 35 9.250 9.250 8.959 0.291 26060 168 1 1 . 1 1 36 36 MET N N 36 120.980 120.980 121.647 -0.667 26060 169 1 1 . 1 1 36 36 MET HA H 36 5.750 5.750 5.905 -0.155 26060 170 1 1 . 1 1 36 36 MET C C 36 173.700 173.700 174.281 -0.581 26060 171 1 1 . 1 1 36 36 MET CA C 36 54.830 54.830 54.608 0.222 26060 172 1 1 . 1 1 36 36 MET CB C 36 35.220 35.220 36.608 -1.388 26060 173 1 1 . 1 1 36 36 MET H H 36 9.080 9.080 8.842 0.238 26060 174 1 1 . 1 1 37 37 VAL N N 37 126.220 126.220 121.037 5.183 26060 175 1 1 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.241 0.069 26060 176 1 1 . 1 1 37 37 VAL C C 37 172.300 172.300 174.506 -2.206 26060 177 1 1 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.711 -1.171 26060 178 1 1 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.667 1.403 26060 179 1 1 . 1 1 37 37 VAL H H 37 9.080 9.080 8.889 0.191 26060 180 1 1 . 1 1 38 38 PHE N N 38 120.640 120.640 121.651 -1.011 26060 181 1 1 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.258 0.712 26060 182 1 1 . 1 1 38 38 PHE C C 38 172.960 172.960 174.915 -1.955 26060 183 1 1 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.945 -0.815 26060 184 1 1 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.772 -0.772 26060 185 1 1 . 1 1 38 38 PHE H H 38 8.320 8.320 8.940 -0.620 26060 186 1 1 . 1 1 39 39 VAL N N 39 116.500 116.500 120.546 -4.046 26060 187 1 1 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.731 -0.721 26060 188 1 1 . 1 1 39 39 VAL C C 39 174.700 174.700 174.350 0.350 26060 189 1 1 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.973 1.667 26060 190 1 1 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.959 1.441 26060 191 1 1 . 1 1 39 39 VAL H H 39 8.580 8.580 9.471 -0.891 26060 192 1 1 . 1 1 40 40 ARG N N 40 124.100 124.100 123.804 0.296 26060 193 1 1 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.965 0.115 26060 194 1 1 . 1 1 40 40 ARG C C 40 173.800 173.800 174.351 -0.551 26060 195 1 1 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.700 -0.770 26060 196 1 1 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.622 0.958 26060 197 1 1 . 1 1 40 40 ARG H H 40 9.880 9.880 8.501 1.379 26060 198 1 1 . 1 1 41 41 GLY N N 41 107.640 107.640 106.552 1.088 26060 199 1 1 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.709 1.261 26060 200 1 1 . 1 1 41 41 GLY H H 41 8.910 8.910 8.598 0.312 26060 201 1 1 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.402 0.088 26060 202 1 1 . 1 1 42 42 PRO C C 42 177.300 177.300 176.822 0.478 26060 203 1 1 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.896 -0.456 26060 204 1 1 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.357 -0.247 26060 205 1 1 . 1 1 43 43 GLU N N 43 121.050 121.050 124.901 -3.851 26060 206 1 1 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.060 -0.270 26060 207 1 1 . 1 1 43 43 GLU C C 43 176.110 176.110 176.190 -0.080 26060 208 1 1 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.490 -0.640 26060 209 1 1 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.847 -0.997 26060 210 1 1 . 1 1 43 43 GLU H H 43 9.060 9.060 8.808 0.252 26060 211 1 1 . 1 1 44 44 HIS N N 44 114.100 114.100 114.661 -0.561 26060 212 1 1 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.298 0.053 26060 213 1 1 . 1 1 44 44 HIS C C 44 175.170 175.170 174.460 0.710 26060 214 1 1 . 1 1 44 44 HIS CA C 44 57.650 57.650 58.047 -0.397 26060 215 1 1 . 1 1 44 44 HIS CB C 44 28.370 28.370 29.044 -0.674 26060 216 1 1 . 1 1 44 44 HIS H H 44 8.420 8.420 8.628 -0.208 26060 217 1 1 . 1 1 45 45 SER N N 45 115.540 115.540 118.270 -2.730 26060 218 1 1 . 1 1 45 45 SER HA H 45 4.560 4.560 4.710 -0.150 26060 219 1 1 . 1 1 45 45 SER C C 45 173.700 173.700 173.462 0.238 26060 220 1 1 . 1 1 45 45 SER CA C 45 58.710 58.710 57.801 0.909 26060 221 1 1 . 1 1 45 45 SER CB C 45 65.040 65.040 63.902 1.138 26060 222 1 1 . 1 1 45 45 SER H H 45 7.870 7.870 8.107 -0.237 26060 223 1 1 . 1 1 46 46 ASN N N 46 123.900 123.900 124.190 -0.290 26060 224 1 1 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.966 0.154 26060 225 1 1 . 1 1 46 46 ASN C C 46 176.300 176.300 175.784 0.516 26060 226 1 1 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.729 -0.039 26060 227 1 1 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.672 -1.942 26060 228 1 1 . 1 1 46 46 ASN H H 46 9.480 9.480 8.686 0.794 26060 229 1 1 . 1 1 47 47 ILE N N 47 115.240 115.240 121.973 -6.733 26060 230 1 1 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.091 0.849 26060 231 1 1 . 1 1 47 47 ILE C C 47 176.000 176.000 176.872 -0.872 26060 232 1 1 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.374 -0.174 26060 233 1 1 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.097 -1.397 26060 234 1 1 . 1 1 47 47 ILE H H 47 8.170 8.170 8.635 -0.465 26060 235 1 1 . 1 1 48 48 GLN N N 48 123.200 123.200 119.755 3.445 26060 236 1 1 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.118 0.162 26060 237 1 1 . 1 1 48 48 GLN C C 48 175.670 175.670 176.767 -1.097 26060 238 1 1 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.092 -0.192 26060 239 1 1 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.326 -0.336 26060 240 1 1 . 1 1 48 48 GLN H H 48 8.850 8.850 8.698 0.152 26060 241 1 1 . 1 1 49 49 HIS N N 49 115.400 115.400 116.814 -1.414 26060 242 1 1 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.405 0.165 26060 243 1 1 . 1 1 49 49 HIS C C 49 176.380 176.380 177.071 -0.691 26060 244 1 1 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.728 0.022 26060 245 1 1 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.694 0.926 26060 246 1 1 . 1 1 49 49 HIS H H 49 7.400 7.400 7.446 -0.046 26060 247 1 1 . 1 1 50 50 PHE N N 50 109.800 109.800 113.199 -3.399 26060 248 1 1 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.901 0.329 26060 249 1 1 . 1 1 50 50 PHE C C 50 173.800 173.800 174.280 -0.480 26060 250 1 1 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.857 -0.197 26060 251 1 1 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.537 1.463 26060 252 1 1 . 1 1 50 50 PHE H H 50 7.570 7.570 7.418 0.152 26060 253 1 1 . 1 1 51 51 VAL N N 51 127.810 127.810 120.481 7.329 26060 254 1 1 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.786 -0.416 26060 255 1 1 . 1 1 51 51 VAL C C 51 174.500 174.500 174.686 -0.186 26060 256 1 1 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.395 1.605 26060 257 1 1 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.752 -1.472 26060 258 1 1 . 1 1 51 51 VAL H H 51 7.810 7.810 8.154 -0.344 26060 259 1 1 . 1 1 52 52 GLU N N 52 130.700 130.700 127.298 3.402 26060 260 1 1 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.551 -0.571 26060 261 1 1 . 1 1 52 52 GLU C C 52 175.400 175.400 175.701 -0.301 26060 262 1 1 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.299 0.801 26060 263 1 1 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.590 -1.010 26060 264 1 1 . 1 1 52 52 GLU H H 52 9.380 9.380 9.102 0.278 26060 265 1 1 . 1 1 53 53 LYS N N 53 109.200 109.200 114.403 -5.203 26060 266 1 1 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.174 -0.374 26060 267 1 1 . 1 1 53 53 LYS C C 53 172.300 172.300 174.419 -2.119 26060 268 1 1 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.557 0.283 26060 269 1 1 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.156 -1.906 26060 270 1 1 . 1 1 53 53 LYS H H 53 7.190 7.190 7.393 -0.203 26060 271 1 1 . 1 1 54 54 VAL N N 54 120.380 120.380 117.609 2.771 26060 272 1 1 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.663 0.107 26060 273 1 1 . 1 1 54 54 VAL C C 54 173.600 173.600 173.957 -0.357 26060 274 1 1 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.395 -0.355 26060 275 1 1 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.730 -2.030 26060 276 1 1 . 1 1 54 54 VAL H H 54 8.450 8.450 8.266 0.184 26060 277 1 1 . 1 1 55 55 VAL N N 55 126.920 126.920 122.583 4.337 26060 278 1 1 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.123 -0.423 26060 279 1 1 . 1 1 55 55 VAL C C 55 173.800 173.800 173.891 -0.091 26060 280 1 1 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.812 0.058 26060 281 1 1 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.934 -2.834 26060 282 1 1 . 1 1 55 55 VAL H H 55 9.260 9.260 9.057 0.203 26060 283 1 1 . 1 1 56 56 PHE N N 56 126.130 126.130 124.280 1.850 26060 284 1 1 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.001 -0.311 26060 285 1 1 . 1 1 56 56 PHE C C 56 174.000 174.000 174.224 -0.224 26060 286 1 1 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.695 -0.115 26060 287 1 1 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.654 -1.764 26060 288 1 1 . 1 1 56 56 PHE H H 56 9.290 9.290 9.146 0.144 26060 289 1 1 . 1 1 57 57 HIS N N 57 124.180 124.180 124.077 0.103 26060 290 1 1 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.984 -0.184 26060 291 1 1 . 1 1 57 57 HIS C C 57 174.700 174.700 174.808 -0.108 26060 292 1 1 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.188 0.132 26060 293 1 1 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.897 1.203 26060 294 1 1 . 1 1 57 57 HIS H H 57 8.690 8.690 8.475 0.215 26060 295 1 1 . 1 1 58 58 LEU N N 58 122.050 122.050 122.877 -0.827 26060 296 1 1 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.371 -0.131 26060 297 1 1 . 1 1 58 58 LEU C C 58 174.400 174.400 176.947 -2.547 26060 298 1 1 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.732 0.678 26060 299 1 1 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.395 -1.235 26060 300 1 1 . 1 1 58 58 LEU H H 58 9.050 9.050 8.420 0.630 26060 301 1 1 . 1 1 59 59 HIS N N 59 118.510 118.510 117.877 0.633 26060 302 1 1 . 1 1 59 59 HIS C C 59 175.300 175.300 176.929 -1.629 26060 303 1 1 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.712 3.398 26060 304 1 1 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.847 0.083 26060 305 1 1 . 1 1 59 59 HIS H H 59 5.160 5.160 7.859 -2.699 26060 306 1 1 . 1 1 60 60 GLU N N 60 122.190 122.190 123.621 -1.431 26060 307 1 1 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.197 -0.237 26060 308 1 1 . 1 1 60 60 GLU C C 60 175.130 175.130 177.424 -2.294 26060 309 1 1 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.419 -0.409 26060 310 1 1 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.016 -0.196 26060 311 1 1 . 1 1 60 60 GLU H H 60 7.960 7.960 9.006 -1.046 26060 312 1 1 . 1 1 61 61 SER N N 61 116.940 116.940 113.905 3.035 26060 313 1 1 . 1 1 61 61 SER HA H 61 4.200 4.200 4.299 -0.099 26060 314 1 1 . 1 1 61 61 SER CA C 61 60.010 60.010 59.558 0.452 26060 315 1 1 . 1 1 61 61 SER CB C 61 63.140 63.140 63.199 -0.059 26060 316 1 1 . 1 1 61 61 SER H H 61 8.540 8.540 8.404 0.136 26060 317 1 1 . 1 1 62 62 PHE N N 62 123.700 123.700 121.621 2.079 26060 318 1 1 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.518 0.032 26060 319 1 1 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.509 2.431 26060 320 1 1 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.856 -0.456 26060 321 1 1 . 1 1 62 62 PHE H H 62 8.640 8.640 8.029 0.611 26060 322 1 1 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.505 -0.095 26060 323 1 1 . 1 1 63 63 PRO C C 63 176.400 176.400 176.470 -0.070 26060 324 1 1 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.111 -0.511 26060 325 1 1 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.056 -0.196 26060 326 1 1 . 1 1 64 64 ARG N N 64 116.840 116.840 120.977 -4.137 26060 327 1 1 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.078 0.022 26060 328 1 1 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.118 -0.508 26060 329 1 1 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.806 0.024 26060 330 1 1 . 1 1 64 64 ARG H H 64 8.890 8.890 8.807 0.083 26060 331 1 1 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.365 -0.375 26060 332 1 1 . 1 1 65 65 PRO C C 65 175.800 175.800 177.007 -1.207 26060 333 1 1 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.202 1.608 26060 334 1 1 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.983 -0.103 26060 335 1 1 . 1 1 66 66 LYS N N 66 119.035 119.035 119.715 -0.680 26060 336 1 1 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.172 -0.562 26060 337 1 1 . 1 1 66 66 LYS C C 66 175.400 175.400 175.835 -0.435 26060 338 1 1 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.025 0.428 26060 339 1 1 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.325 -0.596 26060 340 1 1 . 1 1 66 66 LYS H H 66 7.630 7.630 7.829 -0.199 26060 341 1 1 . 1 1 67 67 ARG N N 67 127.394 127.394 127.421 -0.027 26060 342 1 1 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.626 0.114 26060 343 1 1 . 1 1 67 67 ARG C C 67 174.500 174.500 174.957 -0.457 26060 344 1 1 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.929 -0.130 26060 345 1 1 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.292 -1.578 26060 346 1 1 . 1 1 67 67 ARG H H 67 8.855 8.855 8.665 0.190 26060 347 1 1 . 1 1 68 68 VAL N N 68 124.388 124.388 120.141 4.247 26060 348 1 1 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.073 -0.493 26060 349 1 1 . 1 1 68 68 VAL C C 68 176.850 176.850 175.537 1.313 26060 350 1 1 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.810 2.263 26060 351 1 1 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.519 0.085 26060 352 1 1 . 1 1 68 68 VAL H H 68 8.681 8.681 8.445 0.236 26060 353 1 1 . 1 1 69 69 CYS N N 69 127.080 127.080 126.086 0.994 26060 354 1 1 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.748 0.322 26060 355 1 1 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.711 0.635 26060 356 1 1 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.163 1.607 26060 357 1 1 . 1 1 69 69 CYS H H 69 9.455 9.455 9.032 0.423 26060 358 1 1 . 1 1 70 70 LYS N N 70 125.480 125.480 123.349 2.131 26060 359 1 1 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.532 -0.042 26060 360 1 1 . 1 1 70 70 LYS C C 70 174.300 174.300 175.551 -1.251 26060 361 1 1 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.152 1.608 26060 362 1 1 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.279 -0.109 26060 363 1 1 . 1 1 70 70 LYS H H 70 9.050 9.050 8.581 0.469 26060 364 1 1 . 1 1 71 71 ASP N N 71 116.940 116.940 119.832 -2.892 26060 365 1 1 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.910 0.190 26060 366 1 1 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.068 -0.988 26060 367 1 1 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.077 2.303 26060 368 1 1 . 1 1 71 71 ASP H H 71 7.620 7.620 7.529 0.091 26060 369 1 1 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.140 -0.880 26060 370 1 1 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.797 -2.147 26060 371 1 1 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.884 -0.844 26060 372 1 1 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.107 -0.007 26060 373 1 1 . 1 1 73 73 PRO C C 73 174.700 174.700 175.856 -1.156 26060 374 1 1 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.298 -2.608 26060 375 1 1 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.243 2.797 26060 376 1 1 . 1 1 74 74 TYR N N 74 125.400 125.400 124.866 0.534 26060 377 1 1 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.485 0.365 26060 378 1 1 . 1 1 74 74 TYR C C 74 172.900 172.900 175.341 -2.441 26060 379 1 1 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.028 -2.358 26060 380 1 1 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.787 -3.387 26060 381 1 1 . 1 1 74 74 TYR H H 74 8.960 8.960 8.270 0.691 26060 382 1 1 . 1 1 75 75 LYS N N 75 121.400 121.400 119.902 1.498 26060 383 1 1 . 1 1 75 75 LYS HA H 75 5.590 5.590 4.875 0.715 26060 384 1 1 . 1 1 75 75 LYS C C 75 173.800 173.800 174.266 -0.466 26060 385 1 1 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.586 0.064 26060 386 1 1 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.603 -0.713 26060 387 1 1 . 1 1 75 75 LYS H H 75 7.670 7.670 7.902 -0.232 26060 388 1 1 . 1 1 76 76 VAL N N 76 119.800 119.800 120.299 -0.499 26060 389 1 1 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.152 -0.262 26060 390 1 1 . 1 1 76 76 VAL C C 76 173.900 173.900 174.104 -0.204 26060 391 1 1 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.653 1.077 26060 392 1 1 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.839 -0.299 26060 393 1 1 . 1 1 76 76 VAL H H 76 8.180 8.180 7.821 0.359 26060 394 1 1 . 1 1 77 77 GLU N N 77 126.190 126.190 127.064 -0.874 26060 395 1 1 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.991 -0.041 26060 396 1 1 . 1 1 77 77 GLU C C 77 174.700 174.700 175.153 -0.453 26060 397 1 1 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.174 -0.234 26060 398 1 1 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.904 -0.354 26060 399 1 1 . 1 1 77 77 GLU H H 77 8.270 8.270 8.581 -0.311 26060 400 1 1 . 1 1 78 78 GLU N N 78 126.180 126.180 123.144 3.036 26060 401 1 1 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.629 -0.179 26060 402 1 1 . 1 1 78 78 GLU C C 78 175.400 175.400 173.764 1.636 26060 403 1 1 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.287 -0.245 26060 404 1 1 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.283 2.817 26060 405 1 1 . 1 1 78 78 GLU H H 78 7.870 7.870 8.442 -0.572 26060 406 1 1 . 1 1 79 79 SER N N 79 112.109 112.109 113.375 -1.266 26060 407 1 1 . 1 1 79 79 SER HA H 79 5.560 5.560 5.372 0.188 26060 408 1 1 . 1 1 79 79 SER C C 79 172.490 172.490 173.139 -0.649 26060 409 1 1 . 1 1 79 79 SER CA C 79 57.754 57.754 56.522 1.232 26060 410 1 1 . 1 1 79 79 SER CB C 79 65.861 65.861 65.303 0.558 26060 411 1 1 . 1 1 79 79 SER H H 79 7.714 7.714 8.366 -0.652 26060 412 1 1 . 1 1 80 80 GLY N N 80 106.048 106.048 110.755 -4.707 26060 413 1 1 . 1 1 80 80 GLY C C 80 172.630 172.630 171.820 0.810 26060 414 1 1 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.608 0.963 26060 415 1 1 . 1 1 80 80 GLY H H 80 8.828 8.828 8.963 -0.135 26060 416 1 1 . 1 1 81 81 TYR N N 81 115.280 115.280 114.133 1.147 26060 417 1 1 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.259 0.421 26060 418 1 1 . 1 1 81 81 TYR C C 81 174.100 174.100 173.962 0.138 26060 419 1 1 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.907 -1.407 26060 420 1 1 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.238 2.102 26060 421 1 1 . 1 1 81 81 TYR H H 81 8.770 8.770 8.084 0.686 26060 422 1 1 . 1 1 82 82 ALA N N 82 122.350 122.350 122.755 -0.405 26060 423 1 1 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.565 -0.165 26060 424 1 1 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.715 0.325 26060 425 1 1 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.300 1.100 26060 426 1 1 . 1 1 82 82 ALA H H 82 7.160 7.160 7.427 -0.267 26060 427 1 1 . 1 1 83 83 GLY N N 83 107.100 107.100 106.789 0.311 26060 428 1 1 . 1 1 83 83 GLY C C 83 172.500 172.500 173.686 -1.186 26060 429 1 1 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.144 0.466 26060 430 1 1 . 1 1 83 83 GLY H H 83 8.220 8.220 8.291 -0.071 26060 431 1 1 . 1 1 84 84 PHE N N 84 111.660 111.660 115.615 -3.955 26060 432 1 1 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.704 -0.014 26060 433 1 1 . 1 1 84 84 PHE C C 84 172.460 172.460 173.446 -0.986 26060 434 1 1 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.611 -0.111 26060 435 1 1 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.925 -1.345 26060 436 1 1 . 1 1 84 84 PHE H H 84 7.700 7.700 8.088 -0.388 26060 437 1 1 . 1 1 85 85 ILE N N 85 117.810 117.810 121.847 -4.037 26060 438 1 1 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.121 0.189 26060 439 1 1 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.525 -1.185 26060 440 1 1 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.177 -1.917 26060 441 1 1 . 1 1 85 85 ILE H H 85 8.340 8.340 8.435 -0.095 26060 442 1 1 . 1 1 86 86 LEU N N 86 108.130 108.130 129.252 -21.122 26060 443 1 1 . 1 1 86 86 LEU HA H 86 4.980 4.980 4.926 0.054 26060 444 1 1 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.959 2.240 26060 445 1 1 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.109 0.191 26060 446 1 1 . 1 1 86 86 LEU H H 86 9.900 9.900 8.693 1.207 26060 447 1 1 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.485 0.615 26060 448 1 1 . 1 1 87 87 PRO C C 87 175.340 175.340 175.850 -0.510 26060 449 1 1 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.769 0.341 26060 450 1 1 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.607 0.953 26060 451 1 1 . 1 1 88 88 ILE N N 88 126.000 126.000 126.283 -0.283 26060 452 1 1 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.333 0.457 26060 453 1 1 . 1 1 88 88 ILE C C 88 176.100 176.100 175.084 1.016 26060 454 1 1 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.348 0.212 26060 455 1 1 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.113 1.887 26060 456 1 1 . 1 1 88 88 ILE H H 88 9.380 9.380 8.860 0.520 26060 457 1 1 . 1 1 89 89 GLU N N 89 123.900 123.900 125.114 -1.214 26060 458 1 1 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.296 -0.096 26060 459 1 1 . 1 1 89 89 GLU C C 89 173.800 173.800 175.609 -1.809 26060 460 1 1 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.358 -0.388 26060 461 1 1 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.471 0.909 26060 462 1 1 . 1 1 89 89 GLU H H 89 9.320 9.320 8.992 0.328 26060 463 1 1 . 1 1 90 90 VAL N N 90 123.980 123.980 123.230 0.750 26060 464 1 1 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.176 -0.016 26060 465 1 1 . 1 1 90 90 VAL C C 90 174.800 174.800 174.487 0.313 26060 466 1 1 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.129 0.862 26060 467 1 1 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.228 -0.738 26060 468 1 1 . 1 1 90 90 VAL H H 90 8.630 8.630 8.631 -0.001 26060 469 1 1 . 1 1 91 91 TYR N N 91 124.230 124.230 126.341 -2.111 26060 470 1 1 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.676 -0.016 26060 471 1 1 . 1 1 91 91 TYR C C 91 176.800 176.800 175.646 1.154 26060 472 1 1 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.023 -0.323 26060 473 1 1 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.999 1.241 26060 474 1 1 . 1 1 91 91 TYR H H 91 8.640 8.640 9.131 -0.491 26060 475 1 1 . 1 1 92 92 PHE N N 92 121.200 121.200 122.573 -1.373 26060 476 1 1 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.162 0.498 26060 477 1 1 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.111 1.399 26060 478 1 1 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.711 0.989 26060 479 1 1 . 1 1 92 92 PHE H H 92 8.750 8.750 9.053 -0.303 26060 480 1 1 . 1 1 93 93 LYS N N 93 123.450 123.450 122.971 0.479 26060 481 1 1 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.597 0.003 26060 482 1 1 . 1 1 93 93 LYS C C 93 174.200 174.200 175.129 -0.929 26060 483 1 1 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.889 -0.709 26060 484 1 1 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.136 -0.456 26060 485 1 1 . 1 1 93 93 LYS H H 93 8.560 8.560 8.904 -0.344 26060 486 1 1 . 1 1 94 94 ASN N N 94 118.800 118.800 119.991 -1.191 26060 487 1 1 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.791 -0.351 26060 488 1 1 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.326 -1.116 26060 489 1 1 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.398 -0.598 26060 490 1 1 . 1 1 94 94 ASN H H 94 7.820 7.820 7.914 -0.094 26060 491 1 1 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.356 -0.026 26060 492 1 1 . 1 1 95 95 LYS C C 95 175.800 175.800 176.209 -0.409 26060 493 1 1 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.217 -0.007 26060 494 1 1 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.131 -0.121 26060 495 1 1 . 1 1 96 96 GLU N N 96 118.330 118.330 120.282 -1.952 26060 496 1 1 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.335 0.175 26060 497 1 1 . 1 1 96 96 GLU C C 96 173.200 173.200 176.005 -2.805 26060 498 1 1 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.423 -1.323 26060 499 1 1 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.332 2.138 26060 500 1 1 . 1 1 96 96 GLU H H 96 7.120 7.120 7.584 -0.464 26060 501 1 1 . 1 1 97 97 GLU N N 97 115.630 115.630 119.919 -4.289 26060 502 1 1 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.187 0.243 26060 503 1 1 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.188 -1.328 26060 504 1 1 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.793 0.477 26060 505 1 1 . 1 1 97 97 GLU H H 97 8.060 8.060 8.413 -0.353 26060 506 1 1 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.233 0.767 26060 507 1 1 . 1 1 98 98 PRO C C 98 175.900 175.900 176.242 -0.342 26060 508 1 1 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.027 -1.867 26060 509 1 1 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.034 1.966 26060 510 1 1 . 1 1 99 99 ARG N N 99 122.800 122.800 119.035 3.765 26060 511 1 1 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.454 0.176 26060 512 1 1 . 1 1 99 99 ARG C C 99 175.800 175.800 176.190 -0.390 26060 513 1 1 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.613 -0.123 26060 514 1 1 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.602 -0.192 26060 515 1 1 . 1 1 99 99 ARG H H 99 8.602 8.602 8.669 -0.067 26060 516 1 1 . 1 1 100 100 LYS N N 100 113.220 113.220 116.795 -3.575 26060 517 1 1 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.837 0.103 26060 518 1 1 . 1 1 100 100 LYS C C 100 174.100 174.100 174.320 -0.220 26060 519 1 1 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.188 -0.278 26060 520 1 1 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.834 -1.113 26060 521 1 1 . 1 1 100 100 LYS H H 100 7.650 7.650 7.333 0.317 26060 522 1 1 . 1 1 101 101 VAL N N 101 116.230 116.230 120.155 -3.925 26060 523 1 1 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.218 0.052 26060 524 1 1 . 1 1 101 101 VAL C C 101 171.600 171.600 173.399 -1.799 26060 525 1 1 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.619 0.641 26060 526 1 1 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.216 -0.036 26060 527 1 1 . 1 1 101 101 VAL H H 101 8.120 8.120 8.315 -0.195 26060 528 1 1 . 1 1 102 102 ARG N N 102 124.980 124.980 127.845 -2.865 26060 529 1 1 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.977 0.183 26060 530 1 1 . 1 1 102 102 ARG C C 102 174.340 174.340 175.073 -0.733 26060 531 1 1 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.374 -0.625 26060 532 1 1 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.517 1.833 26060 533 1 1 . 1 1 102 102 ARG H H 102 7.930 7.930 8.348 -0.418 26060 534 1 1 . 1 1 103 103 PHE N N 103 124.590 124.590 125.819 -1.229 26060 535 1 1 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.694 0.098 26060 536 1 1 . 1 1 103 103 PHE C C 103 174.280 174.280 174.564 -0.284 26060 537 1 1 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.987 0.993 26060 538 1 1 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.370 1.880 26060 539 1 1 . 1 1 103 103 PHE H H 103 9.390 9.390 9.166 0.224 26060 540 1 1 . 1 1 104 104 ASP N N 104 124.700 124.700 126.928 -2.228 26060 541 1 1 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.736 0.063 26060 542 1 1 . 1 1 104 104 ASP C C 104 174.500 174.500 175.005 -0.505 26060 543 1 1 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.576 -0.186 26060 544 1 1 . 1 1 104 104 ASP CB C 104 40.230 40.230 40.078 0.152 26060 545 1 1 . 1 1 104 104 ASP H H 104 9.010 9.010 9.055 -0.045 26060 546 1 1 . 1 1 105 105 TYR N N 105 129.840 129.840 124.853 4.987 26060 547 1 1 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.463 -0.363 26060 548 1 1 . 1 1 105 105 TYR C C 105 173.100 173.100 173.664 -0.564 26060 549 1 1 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.535 1.145 26060 550 1 1 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.522 1.328 26060 551 1 1 . 1 1 105 105 TYR H H 105 8.140 8.140 8.161 -0.021 26060 552 1 1 . 1 1 106 106 ASP N N 106 126.800 126.800 128.283 -1.483 26060 553 1 1 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.342 -0.122 26060 554 1 1 . 1 1 106 106 ASP C C 106 172.900 172.900 174.356 -1.456 26060 555 1 1 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.874 -0.364 26060 556 1 1 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.474 -1.974 26060 557 1 1 . 1 1 106 106 ASP H H 106 7.730 7.730 8.380 -0.650 26060 558 1 1 . 1 1 107 107 LEU N N 107 132.150 132.150 128.439 3.711 26060 559 1 1 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.347 -0.507 26060 560 1 1 . 1 1 107 107 LEU C C 107 172.100 172.100 174.668 -2.568 26060 561 1 1 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.596 0.104 26060 562 1 1 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.425 -1.185 26060 563 1 1 . 1 1 107 107 LEU H H 107 7.770 7.770 7.873 -0.103 26060 564 1 1 . 1 1 108 108 PHE N N 108 118.960 118.960 121.963 -3.003 26060 565 1 1 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.939 -0.249 26060 566 1 1 . 1 1 108 108 PHE C C 108 174.300 174.300 173.809 0.491 26060 567 1 1 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.503 -0.813 26060 568 1 1 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.526 -0.236 26060 569 1 1 . 1 1 108 108 PHE H H 108 6.060 6.060 7.137 -1.077 26060 570 1 1 . 1 1 109 109 LEU N N 109 118.900 118.900 121.946 -3.046 26060 571 1 1 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.883 -0.483 26060 572 1 1 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.150 -0.990 26060 573 1 1 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.806 -1.726 26060 574 1 1 . 1 1 109 109 LEU H H 109 8.388 8.388 8.322 0.066 26060 575 1 1 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.378 0.062 26060 576 1 1 . 1 1 111 111 LEU C C 111 177.300 177.300 177.388 -0.088 26060 577 1 1 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.051 -0.831 26060 578 1 1 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.714 1.156 26060 579 1 1 . 1 1 112 112 GLU N N 112 120.660 120.660 123.033 -2.373 26060 580 1 1 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.083 0.087 26060 581 1 1 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.484 -0.025 26060 582 1 1 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.024 -0.334 26060 583 1 1 . 1 1 112 112 GLU H H 112 8.780 8.780 8.764 0.016 26060 584 1 1 . 1 1 113 113 GLY C C 113 173.900 173.900 174.348 -0.448 26060 585 1 1 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.954 -0.004 26060 586 1 1 . 1 1 114 114 HIS N N 114 120.890 120.890 120.065 0.825 26060 587 1 1 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.008 -0.102 26060 588 1 1 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.121 0.649 26060 589 1 1 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.812 -1.222 26060 590 1 1 . 1 1 114 114 HIS H H 114 7.934 7.934 7.998 -0.064 26060 591 1 1 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.187 -0.387 26060 592 1 1 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.743 1.347 26060 593 1 1 . 1 1 115 115 PRO CB C 115 30.680 30.680 32.019 -1.339 26060 594 1 1 . 1 1 116 116 PRO C C 116 176.600 176.600 175.582 1.018 26060 595 1 1 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.327 -0.027 26060 596 1 1 . 1 1 117 117 VAL N N 117 127.480 127.480 125.592 1.888 26060 597 1 1 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.419 -0.629 26060 598 1 1 . 1 1 117 117 VAL CA C 117 62.700 62.700 62.078 0.622 26060 599 1 1 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.950 -0.750 26060 600 1 1 . 1 1 117 117 VAL H H 117 8.890 8.890 7.984 0.906 26060 601 1 1 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.003 -0.013 26060 602 1 1 . 1 1 118 118 ASN C C 118 172.700 172.700 173.617 -0.917 26060 603 1 1 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.561 -0.201 26060 604 1 1 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.939 -0.739 26060 605 1 1 . 1 1 119 119 HIS N N 119 124.930 124.930 125.911 -0.981 26060 606 1 1 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.085 -0.265 26060 607 1 1 . 1 1 119 119 HIS C C 119 173.500 173.500 172.806 0.694 26060 608 1 1 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.923 2.047 26060 609 1 1 . 1 1 119 119 HIS CB C 119 34.670 34.670 33.995 0.675 26060 610 1 1 . 1 1 119 119 HIS H H 119 8.790 8.790 9.078 -0.288 26060 611 1 1 . 1 1 120 120 LEU N N 120 128.280 128.280 125.750 2.530 26060 612 1 1 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.067 -0.117 26060 613 1 1 . 1 1 120 120 LEU C C 120 174.030 174.030 175.217 -1.187 26060 614 1 1 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.557 0.883 26060 615 1 1 . 1 1 120 120 LEU CB C 120 46.600 46.600 45.772 0.828 26060 616 1 1 . 1 1 120 120 LEU H H 120 7.460 7.460 8.552 -1.092 26060 617 1 1 . 1 1 121 121 ARG N N 121 128.060 128.060 122.873 5.187 26060 618 1 1 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.662 -0.022 26060 619 1 1 . 1 1 121 121 ARG C C 121 173.400 173.400 173.576 -0.176 26060 620 1 1 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.111 0.249 26060 621 1 1 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.444 1.817 26060 622 1 1 . 1 1 121 121 ARG H H 121 9.860 9.860 9.054 0.806 26060 623 1 1 . 1 1 122 122 CYS N N 122 125.290 125.290 120.828 4.462 26060 624 1 1 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.218 -0.198 26060 625 1 1 . 1 1 122 122 CYS C C 122 174.600 174.600 174.392 0.208 26060 626 1 1 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.474 0.817 26060 627 1 1 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.032 -2.002 26060 628 1 1 . 1 1 122 122 CYS H H 122 8.835 8.835 8.643 0.192 26060 629 1 1 . 1 1 123 123 GLU N N 123 125.920 125.920 124.147 1.773 26060 630 1 1 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.458 0.222 26060 631 1 1 . 1 1 123 123 GLU C C 123 174.500 174.500 175.116 -0.616 26060 632 1 1 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.081 0.339 26060 633 1 1 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.913 0.670 26060 634 1 1 . 1 1 123 123 GLU H H 123 8.970 8.970 9.159 -0.189 26060 635 1 1 . 1 1 124 124 LYS N N 124 121.837 121.837 122.106 -0.269 26060 636 1 1 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.933 0.027 26060 637 1 1 . 1 1 124 124 LYS C C 124 175.700 175.700 175.772 -0.072 26060 638 1 1 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.005 0.352 26060 639 1 1 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.565 -0.376 26060 640 1 1 . 1 1 124 124 LYS H H 124 8.652 8.652 8.321 0.331 26060 641 1 1 . 1 1 125 125 LEU N N 125 127.000 127.000 129.784 -2.784 26060 642 1 1 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.593 0.057 26060 643 1 1 . 1 1 125 125 LEU C C 125 175.110 175.110 175.404 -0.294 26060 644 1 1 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.829 0.025 26060 645 1 1 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.332 0.935 26060 646 1 1 . 1 1 125 125 LEU H H 125 9.175 9.175 9.131 0.044 26060 647 1 1 . 1 1 126 126 THR N N 126 117.779 117.779 120.217 -2.438 26060 648 1 1 . 1 1 126 126 THR HA H 126 4.650 4.650 4.571 0.079 26060 649 1 1 . 1 1 126 126 THR C C 126 173.200 173.200 173.695 -0.495 26060 650 1 1 . 1 1 126 126 THR CA C 126 62.036 62.036 61.813 0.223 26060 651 1 1 . 1 1 126 126 THR CB C 126 70.284 70.284 68.992 1.292 26060 652 1 1 . 1 1 126 126 THR H H 126 8.331 8.331 8.453 -0.122 26060 653 1 1 . 1 1 127 127 PHE N N 127 126.576 126.576 126.802 -0.226 26060 654 1 1 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.626 -0.036 26060 655 1 1 . 1 1 127 127 PHE C C 127 174.860 174.860 174.707 0.153 26060 656 1 1 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.602 0.262 26060 657 1 1 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.635 -0.635 26060 658 1 1 . 1 1 127 127 PHE H H 127 9.051 9.051 9.105 -0.054 26060 659 1 1 . 1 1 128 128 ASN N N 128 123.040 123.040 124.233 -1.193 26060 660 1 1 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.640 -0.020 26060 661 1 1 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.022 0.458 26060 662 1 1 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.878 0.582 26060 663 1 1 . 1 1 128 128 ASN H H 128 8.880 8.880 8.825 0.055 26060 664 1 1 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.483 0.277 26060 665 1 1 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.543 -0.643 26060 666 1 1 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.283 1.447 26060 667 1 1 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.662 0.128 26060 668 1 1 . 1 1 130 130 PRO C C 130 177.470 177.470 176.872 0.598 26060 669 1 1 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.427 0.147 26060 670 1 1 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.530 -0.220 26060 671 1 1 . 1 1 131 131 THR N N 131 113.400 113.400 115.379 -1.979 26060 672 1 1 . 1 1 131 131 THR HA H 131 4.300 4.300 4.254 0.046 26060 673 1 1 . 1 1 131 131 THR C C 131 175.200 175.200 175.890 -0.690 26060 674 1 1 . 1 1 131 131 THR CA C 131 62.200 62.200 61.789 0.411 26060 675 1 1 . 1 1 131 131 THR CB C 131 70.600 70.600 70.354 0.246 26060 676 1 1 . 1 1 131 131 THR H H 131 8.950 8.950 8.279 0.671 26060 677 1 1 . 1 1 132 132 GLU N N 132 122.199 122.199 126.111 -3.912 26060 678 1 1 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.975 0.035 26060 679 1 1 . 1 1 132 132 GLU C C 132 178.700 178.700 178.158 0.542 26060 680 1 1 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.635 -0.341 26060 681 1 1 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.727 -0.566 26060 682 1 1 . 1 1 132 132 GLU H H 132 8.932 8.932 9.076 -0.144 26060 683 1 1 . 1 1 133 133 ASP N N 133 116.324 116.324 119.905 -3.581 26060 684 1 1 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.368 -0.038 26060 685 1 1 . 1 1 133 133 ASP C C 133 177.800 177.800 178.988 -1.188 26060 686 1 1 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.766 -0.219 26060 687 1 1 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.670 1.153 26060 688 1 1 . 1 1 133 133 ASP H H 133 8.490 8.490 8.142 0.348 26060 689 1 1 . 1 1 134 134 PHE N N 134 119.914 119.914 120.566 -0.652 26060 690 1 1 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.189 0.421 26060 691 1 1 . 1 1 134 134 PHE C C 134 177.300 177.300 176.826 0.474 26060 692 1 1 . 1 1 134 134 PHE CA C 134 59.538 59.538 60.102 -0.564 26060 693 1 1 . 1 1 134 134 PHE CB C 134 39.200 39.200 39.005 0.195 26060 694 1 1 . 1 1 134 134 PHE H H 134 7.787 7.787 7.620 0.167 26060 695 1 1 . 1 1 135 135 ARG N N 135 119.794 119.794 120.728 -0.934 26060 696 1 1 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.582 -0.232 26060 697 1 1 . 1 1 135 135 ARG C C 135 177.370 177.370 178.268 -0.898 26060 698 1 1 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.918 0.458 26060 699 1 1 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.927 0.469 26060 700 1 1 . 1 1 135 135 ARG H H 135 9.087 9.087 8.657 0.430 26060 701 1 1 . 1 1 136 136 ARG N N 136 114.554 114.554 118.365 -3.811 26060 702 1 1 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.919 -0.099 26060 703 1 1 . 1 1 136 136 ARG C C 136 178.950 178.950 178.593 0.357 26060 704 1 1 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.706 0.094 26060 705 1 1 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.120 0.097 26060 706 1 1 . 1 1 136 136 ARG H H 136 7.747 7.747 8.565 -0.818 26060 707 1 1 . 1 1 137 137 LYS N N 137 118.298 118.298 119.082 -0.784 26060 708 1 1 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.035 -0.135 26060 709 1 1 . 1 1 137 137 LYS C C 137 177.980 177.980 178.991 -1.011 26060 710 1 1 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.456 0.939 26060 711 1 1 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.504 -0.057 26060 712 1 1 . 1 1 137 137 LYS H H 137 7.154 7.154 7.411 -0.257 26060 713 1 1 . 1 1 138 138 LEU N N 138 117.159 117.159 119.018 -1.859 26060 714 1 1 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.698 -0.278 26060 715 1 1 . 1 1 138 138 LEU C C 138 179.100 179.100 178.516 0.584 26060 716 1 1 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.192 0.039 26060 717 1 1 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.371 0.957 26060 718 1 1 . 1 1 138 138 LEU H H 138 7.709 7.709 7.992 -0.283 26060 719 1 1 . 1 1 139 139 LEU N N 139 115.158 115.158 117.246 -2.088 26060 720 1 1 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.067 0.083 26060 721 1 1 . 1 1 139 139 LEU C C 139 177.600 177.600 178.663 -1.063 26060 722 1 1 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.758 -1.229 26060 723 1 1 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.810 -0.066 26060 724 1 1 . 1 1 139 139 LEU H H 139 7.507 7.507 7.997 -0.490 26060 725 1 1 . 1 1 140 140 LYS N N 140 120.256 120.256 118.166 2.090 26060 726 1 1 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.985 0.125 26060 727 1 1 . 1 1 140 140 LYS C C 140 175.800 175.800 177.147 -1.347 26060 728 1 1 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.409 -0.357 26060 729 1 1 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.336 0.310 26060 730 1 1 . 1 1 140 140 LYS H H 140 7.304 7.304 7.485 -0.181 26060 731 1 2 . 1 1 4 4 MET C C 4 175.800 175.800 174.957 0.843 26060 732 1 2 . 1 1 4 4 MET CA C 4 55.350 55.350 54.066 1.284 26060 733 1 2 . 1 1 4 4 MET CB C 4 32.880 32.880 31.822 1.058 26060 734 1 2 . 1 1 5 5 ALA N N 5 125.230 125.230 124.574 0.656 26060 735 1 2 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.433 -0.083 26060 736 1 2 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.599 0.831 26060 737 1 2 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.813 -0.443 26060 738 1 2 . 1 1 5 5 ALA H H 5 8.320 8.320 7.772 0.548 26060 739 1 2 . 1 1 6 6 SER HA H 6 4.490 4.490 4.502 -0.012 26060 740 1 2 . 1 1 6 6 SER CA C 6 58.200 58.200 58.099 0.101 26060 741 1 2 . 1 1 6 6 SER CB C 6 63.700 63.700 63.770 -0.070 26060 742 1 2 . 1 1 7 7 SER HA H 7 4.530 4.530 4.627 -0.097 26060 743 1 2 . 1 1 7 7 SER CA C 7 58.200 58.200 58.036 0.164 26060 744 1 2 . 1 1 7 7 SER CB C 7 63.700 63.700 63.236 0.465 26060 745 1 2 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.587 0.023 26060 746 1 2 . 1 1 8 8 CYS C C 8 173.500 173.500 173.529 -0.029 26060 747 1 2 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.247 1.093 26060 748 1 2 . 1 1 8 8 CYS CB C 8 28.490 28.490 28.760 -0.270 26060 749 1 2 . 1 1 9 9 ALA N N 9 124.700 124.700 128.829 -4.129 26060 750 1 2 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.813 -0.023 26060 751 1 2 . 1 1 9 9 ALA C C 9 177.400 177.400 176.927 0.473 26060 752 1 2 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.202 0.868 26060 753 1 2 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.572 1.057 26060 754 1 2 . 1 1 9 9 ALA H H 9 7.960 7.960 8.585 -0.625 26060 755 1 2 . 1 1 10 10 VAL N N 10 120.124 120.124 125.045 -4.921 26060 756 1 2 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.132 0.158 26060 757 1 2 . 1 1 10 10 VAL C C 10 173.900 173.900 175.063 -1.163 26060 758 1 2 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.679 -0.129 26060 759 1 2 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.576 2.324 26060 760 1 2 . 1 1 10 10 VAL H H 10 8.424 8.424 8.672 -0.248 26060 761 1 2 . 1 1 11 11 GLN N N 11 125.818 125.818 126.665 -0.847 26060 762 1 2 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.402 0.158 26060 763 1 2 . 1 1 11 11 GLN C C 11 175.400 175.400 175.217 0.183 26060 764 1 2 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.422 -0.299 26060 765 1 2 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.642 1.387 26060 766 1 2 . 1 1 11 11 GLN H H 11 8.636 8.636 8.587 0.049 26060 767 1 2 . 1 1 12 12 VAL N N 12 119.106 119.106 120.442 -1.336 26060 768 1 2 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.324 0.306 26060 769 1 2 . 1 1 12 12 VAL C C 12 173.800 173.800 175.190 -1.390 26060 770 1 2 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.870 -0.070 26060 771 1 2 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.092 2.619 26060 772 1 2 . 1 1 12 12 VAL H H 12 8.827 8.827 8.692 0.135 26060 773 1 2 . 1 1 13 13 LYS N N 13 121.700 121.700 125.437 -3.737 26060 774 1 2 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.274 -0.074 26060 775 1 2 . 1 1 13 13 LYS C C 13 175.030 175.030 175.960 -0.930 26060 776 1 2 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.105 0.325 26060 777 1 2 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.032 1.888 26060 778 1 2 . 1 1 13 13 LYS H H 13 8.234 8.234 8.494 -0.260 26060 779 1 2 . 1 1 14 14 LEU N N 14 119.100 119.100 124.845 -5.745 26060 780 1 2 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.195 -0.245 26060 781 1 2 . 1 1 14 14 LEU C C 14 175.110 175.110 175.404 -0.294 26060 782 1 2 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.458 -0.101 26060 783 1 2 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.656 1.265 26060 784 1 2 . 1 1 14 14 LEU H H 14 8.840 8.840 8.349 0.491 26060 785 1 2 . 1 1 15 15 GLU N N 15 120.978 120.978 122.874 -1.896 26060 786 1 2 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.375 -0.385 26060 787 1 2 . 1 1 15 15 GLU C C 15 173.800 173.800 175.097 -1.297 26060 788 1 2 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.420 1.008 26060 789 1 2 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.838 -1.012 26060 790 1 2 . 1 1 15 15 GLU H H 15 9.181 9.181 9.340 -0.159 26060 791 1 2 . 1 1 16 16 LEU N N 16 124.438 124.438 126.232 -1.794 26060 792 1 2 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.354 -0.244 26060 793 1 2 . 1 1 16 16 LEU C C 16 174.700 174.700 177.082 -2.382 26060 794 1 2 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.744 0.332 26060 795 1 2 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.435 2.457 26060 796 1 2 . 1 1 16 16 LEU H H 16 8.891 8.891 8.346 0.545 26060 797 1 2 . 1 1 17 17 GLY N N 17 108.067 108.067 109.605 -1.538 26060 798 1 2 . 1 1 17 17 GLY C C 17 170.350 170.350 172.334 -1.984 26060 799 1 2 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.422 1.562 26060 800 1 2 . 1 1 17 17 GLY H H 17 7.227 7.227 8.621 -1.394 26060 801 1 2 . 1 1 18 18 HIS N N 18 111.200 111.200 118.896 -7.696 26060 802 1 2 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.832 -0.212 26060 803 1 2 . 1 1 18 18 HIS C C 18 172.400 172.400 172.727 -0.327 26060 804 1 2 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.808 -0.868 26060 805 1 2 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.546 1.614 26060 806 1 2 . 1 1 18 18 HIS H H 18 8.150 8.150 9.038 -0.888 26060 807 1 2 . 1 1 19 19 ARG N N 19 117.800 117.800 122.565 -4.765 26060 808 1 2 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.679 0.421 26060 809 1 2 . 1 1 19 19 ARG C C 19 175.800 175.800 173.989 1.811 26060 810 1 2 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.072 -0.572 26060 811 1 2 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.078 -0.428 26060 812 1 2 . 1 1 19 19 ARG H H 19 9.010 9.010 8.923 0.087 26060 813 1 2 . 1 1 20 20 ALA N N 20 120.390 120.390 122.070 -1.680 26060 814 1 2 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.572 -0.042 26060 815 1 2 . 1 1 20 20 ALA C C 20 175.800 175.800 175.106 0.694 26060 816 1 2 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.890 1.300 26060 817 1 2 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.009 0.741 26060 818 1 2 . 1 1 20 20 ALA H H 20 8.070 8.070 8.284 -0.214 26060 819 1 2 . 1 1 21 21 GLN N N 21 121.790 121.790 121.292 0.498 26060 820 1 2 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.965 0.265 26060 821 1 2 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.048 0.282 26060 822 1 2 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.180 -0.280 26060 823 1 2 . 1 1 21 21 GLN H H 21 9.240 9.240 9.192 0.048 26060 824 1 2 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.551 -0.921 26060 825 1 2 . 1 1 22 22 VAL C C 22 176.500 176.500 175.242 1.258 26060 826 1 2 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.860 3.170 26060 827 1 2 . 1 1 22 22 VAL CB C 22 31.600 31.600 34.208 -2.607 26060 828 1 2 . 1 1 23 23 ARG N N 23 127.840 127.840 126.383 1.457 26060 829 1 2 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.616 -0.486 26060 830 1 2 . 1 1 23 23 ARG CA C 23 56.600 56.600 54.970 1.630 26060 831 1 2 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.687 1.463 26060 832 1 2 . 1 1 23 23 ARG H H 23 8.720 8.720 8.662 0.058 26060 833 1 2 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.014 0.026 26060 834 1 2 . 1 1 24 24 LYS C C 24 176.960 176.960 176.283 0.677 26060 835 1 2 . 1 1 24 24 LYS CA C 24 58.800 58.800 58.204 0.596 26060 836 1 2 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.538 -0.478 26060 837 1 2 . 1 1 25 25 LYS N N 25 115.870 115.870 119.064 -3.194 26060 838 1 2 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.664 0.166 26060 839 1 2 . 1 1 25 25 LYS CA C 25 52.960 52.960 52.851 0.109 26060 840 1 2 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.250 1.830 26060 841 1 2 . 1 1 25 25 LYS H H 25 7.720 7.720 7.663 0.057 26060 842 1 2 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.728 0.102 26060 843 1 2 . 1 1 26 26 PRO C C 26 177.400 177.400 176.846 0.554 26060 844 1 2 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.615 0.035 26060 845 1 2 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.605 -0.215 26060 846 1 2 . 1 1 27 27 THR N N 27 111.270 111.270 114.309 -3.039 26060 847 1 2 . 1 1 27 27 THR HA H 27 4.530 4.530 4.273 0.257 26060 848 1 2 . 1 1 27 27 THR C C 27 177.300 177.300 176.865 0.435 26060 849 1 2 . 1 1 27 27 THR CA C 27 61.300 61.300 60.668 0.632 26060 850 1 2 . 1 1 27 27 THR CB C 27 71.460 71.460 69.980 1.480 26060 851 1 2 . 1 1 27 27 THR H H 27 8.380 8.380 8.037 0.343 26060 852 1 2 . 1 1 28 28 VAL N N 28 121.170 121.170 122.553 -1.383 26060 853 1 2 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.801 0.082 26060 854 1 2 . 1 1 28 28 VAL C C 28 177.030 177.030 176.140 0.890 26060 855 1 2 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.101 0.099 26060 856 1 2 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.632 -0.232 26060 857 1 2 . 1 1 28 28 VAL H H 28 8.910 8.910 8.511 0.399 26060 858 1 2 . 1 1 29 29 GLU N N 29 116.800 116.800 118.786 -1.986 26060 859 1 2 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.093 -0.173 26060 860 1 2 . 1 1 29 29 GLU C C 29 176.200 176.200 175.921 0.279 26060 861 1 2 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.404 1.846 26060 862 1 2 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.183 -1.013 26060 863 1 2 . 1 1 29 29 GLU H H 29 7.990 7.990 8.064 -0.074 26060 864 1 2 . 1 1 30 30 GLY N N 30 105.500 105.500 107.055 -1.555 26060 865 1 2 . 1 1 30 30 GLY C C 30 174.900 174.900 173.705 1.195 26060 866 1 2 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.071 -0.611 26060 867 1 2 . 1 1 30 30 GLY H H 30 7.950 7.950 7.552 0.398 26060 868 1 2 . 1 1 31 31 PHE N N 31 119.300 119.300 118.927 0.373 26060 869 1 2 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.943 -0.183 26060 870 1 2 . 1 1 31 31 PHE C C 31 176.400 176.400 175.870 0.530 26060 871 1 2 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.537 1.363 26060 872 1 2 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.349 -3.849 26060 873 1 2 . 1 1 31 31 PHE H H 31 7.520 7.520 7.400 0.120 26060 874 1 2 . 1 1 32 32 THR N N 32 112.300 112.300 115.622 -3.322 26060 875 1 2 . 1 1 32 32 THR HA H 32 4.330 4.330 4.458 -0.128 26060 876 1 2 . 1 1 32 32 THR C C 32 175.200 175.200 174.373 0.827 26060 877 1 2 . 1 1 32 32 THR CA C 32 62.780 62.780 62.608 0.172 26060 878 1 2 . 1 1 32 32 THR CB C 32 70.350 70.350 70.166 0.184 26060 879 1 2 . 1 1 32 32 THR H H 32 7.770 7.770 9.147 -1.377 26060 880 1 2 . 1 1 33 33 HIS N N 33 121.900 121.900 121.686 0.214 26060 881 1 2 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.273 0.227 26060 882 1 2 . 1 1 33 33 HIS C C 33 173.880 173.880 173.422 0.458 26060 883 1 2 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.689 0.091 26060 884 1 2 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.810 2.830 26060 885 1 2 . 1 1 33 33 HIS H H 33 9.110 9.110 8.787 0.323 26060 886 1 2 . 1 1 34 34 ASP N N 34 120.300 120.300 123.509 -3.209 26060 887 1 2 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.504 -0.104 26060 888 1 2 . 1 1 34 34 ASP C C 34 175.100 175.100 174.914 0.186 26060 889 1 2 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.861 -0.551 26060 890 1 2 . 1 1 34 34 ASP CB C 34 43.100 43.100 44.153 -1.053 26060 891 1 2 . 1 1 34 34 ASP H H 34 8.810 8.810 9.129 -0.319 26060 892 1 2 . 1 1 35 35 TRP N N 35 119.800 119.800 120.484 -0.684 26060 893 1 2 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.590 0.140 26060 894 1 2 . 1 1 35 35 TRP C C 35 174.900 174.900 173.360 1.540 26060 895 1 2 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.060 -0.160 26060 896 1 2 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.162 1.908 26060 897 1 2 . 1 1 35 35 TRP H H 35 9.250 9.250 8.960 0.290 26060 898 1 2 . 1 1 36 36 MET N N 36 120.980 120.980 121.730 -0.750 26060 899 1 2 . 1 1 36 36 MET HA H 36 5.750 5.750 5.870 -0.120 26060 900 1 2 . 1 1 36 36 MET C C 36 173.700 173.700 174.284 -0.584 26060 901 1 2 . 1 1 36 36 MET CA C 36 54.830 54.830 54.619 0.211 26060 902 1 2 . 1 1 36 36 MET CB C 36 35.220 35.220 36.495 -1.275 26060 903 1 2 . 1 1 36 36 MET H H 36 9.080 9.080 8.912 0.168 26060 904 1 2 . 1 1 37 37 VAL N N 37 126.220 126.220 121.455 4.765 26060 905 1 2 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.179 0.131 26060 906 1 2 . 1 1 37 37 VAL C C 37 172.300 172.300 174.518 -2.218 26060 907 1 2 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.766 -1.226 26060 908 1 2 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.547 1.523 26060 909 1 2 . 1 1 37 37 VAL H H 37 9.080 9.080 8.837 0.243 26060 910 1 2 . 1 1 38 38 PHE N N 38 120.640 120.640 121.559 -0.919 26060 911 1 2 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.258 0.712 26060 912 1 2 . 1 1 38 38 PHE C C 38 172.960 172.960 174.972 -2.012 26060 913 1 2 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.958 -0.828 26060 914 1 2 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.764 -0.764 26060 915 1 2 . 1 1 38 38 PHE H H 38 8.320 8.320 8.970 -0.650 26060 916 1 2 . 1 1 39 39 VAL N N 39 116.500 116.500 120.778 -4.278 26060 917 1 2 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.615 -0.605 26060 918 1 2 . 1 1 39 39 VAL C C 39 174.700 174.700 174.328 0.372 26060 919 1 2 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.205 1.435 26060 920 1 2 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.550 1.850 26060 921 1 2 . 1 1 39 39 VAL H H 39 8.580 8.580 9.453 -0.873 26060 922 1 2 . 1 1 40 40 ARG N N 40 124.100 124.100 124.480 -0.380 26060 923 1 2 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.910 0.170 26060 924 1 2 . 1 1 40 40 ARG C C 40 173.800 173.800 174.285 -0.485 26060 925 1 2 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.220 -0.290 26060 926 1 2 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.917 0.663 26060 927 1 2 . 1 1 40 40 ARG H H 40 9.880 9.880 8.705 1.175 26060 928 1 2 . 1 1 41 41 GLY N N 41 107.640 107.640 106.405 1.235 26060 929 1 2 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.414 1.556 26060 930 1 2 . 1 1 41 41 GLY H H 41 8.910 8.910 8.477 0.433 26060 931 1 2 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.367 0.123 26060 932 1 2 . 1 1 42 42 PRO C C 42 177.300 177.300 176.763 0.537 26060 933 1 2 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.486 -0.046 26060 934 1 2 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.341 -0.231 26060 935 1 2 . 1 1 43 43 GLU N N 43 121.050 121.050 122.106 -1.056 26060 936 1 2 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.054 -0.264 26060 937 1 2 . 1 1 43 43 GLU C C 43 176.110 176.110 176.865 -0.755 26060 938 1 2 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.600 -0.750 26060 939 1 2 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.479 -0.629 26060 940 1 2 . 1 1 43 43 GLU H H 43 9.060 9.060 8.786 0.274 26060 941 1 2 . 1 1 44 44 HIS N N 44 114.100 114.100 117.033 -2.933 26060 942 1 2 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.318 0.033 26060 943 1 2 . 1 1 44 44 HIS C C 44 175.170 175.170 174.097 1.073 26060 944 1 2 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.747 0.903 26060 945 1 2 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.438 -0.068 26060 946 1 2 . 1 1 44 44 HIS H H 44 8.420 8.420 8.572 -0.152 26060 947 1 2 . 1 1 45 45 SER N N 45 115.540 115.540 117.528 -1.988 26060 948 1 2 . 1 1 45 45 SER HA H 45 4.560 4.560 4.434 0.126 26060 949 1 2 . 1 1 45 45 SER C C 45 173.700 173.700 173.619 0.081 26060 950 1 2 . 1 1 45 45 SER CA C 45 58.710 58.710 56.921 1.789 26060 951 1 2 . 1 1 45 45 SER CB C 45 65.040 65.040 63.804 1.236 26060 952 1 2 . 1 1 45 45 SER H H 45 7.870 7.870 7.734 0.136 26060 953 1 2 . 1 1 46 46 ASN N N 46 123.900 123.900 123.964 -0.064 26060 954 1 2 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.946 0.174 26060 955 1 2 . 1 1 46 46 ASN C C 46 176.300 176.300 175.712 0.588 26060 956 1 2 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.542 0.147 26060 957 1 2 . 1 1 46 46 ASN CB C 46 38.730 38.730 41.104 -2.374 26060 958 1 2 . 1 1 46 46 ASN H H 46 9.480 9.480 8.603 0.877 26060 959 1 2 . 1 1 47 47 ILE N N 47 115.240 115.240 120.066 -4.826 26060 960 1 2 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.135 0.805 26060 961 1 2 . 1 1 47 47 ILE C C 47 176.000 176.000 176.553 -0.553 26060 962 1 2 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.576 0.624 26060 963 1 2 . 1 1 47 47 ILE CB C 47 36.700 36.700 37.872 -1.172 26060 964 1 2 . 1 1 47 47 ILE H H 47 8.170 8.170 8.708 -0.538 26060 965 1 2 . 1 1 48 48 GLN N N 48 123.200 123.200 119.087 4.113 26060 966 1 2 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.061 0.219 26060 967 1 2 . 1 1 48 48 GLN C C 48 175.670 175.670 176.628 -0.958 26060 968 1 2 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.896 0.004 26060 969 1 2 . 1 1 48 48 GLN CB C 48 26.990 26.990 28.143 -1.153 26060 970 1 2 . 1 1 48 48 GLN H H 48 8.850 8.850 8.069 0.781 26060 971 1 2 . 1 1 49 49 HIS N N 49 115.400 115.400 116.853 -1.453 26060 972 1 2 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.391 0.179 26060 973 1 2 . 1 1 49 49 HIS C C 49 176.380 176.380 177.245 -0.865 26060 974 1 2 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.562 0.188 26060 975 1 2 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.727 0.893 26060 976 1 2 . 1 1 49 49 HIS H H 49 7.400 7.400 7.469 -0.069 26060 977 1 2 . 1 1 50 50 PHE N N 50 109.800 109.800 113.974 -4.174 26060 978 1 2 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.888 0.342 26060 979 1 2 . 1 1 50 50 PHE C C 50 173.800 173.800 174.207 -0.407 26060 980 1 2 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.816 -0.156 26060 981 1 2 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.426 1.574 26060 982 1 2 . 1 1 50 50 PHE H H 50 7.570 7.570 7.558 0.012 26060 983 1 2 . 1 1 51 51 VAL N N 51 127.810 127.810 120.414 7.396 26060 984 1 2 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.857 -0.487 26060 985 1 2 . 1 1 51 51 VAL C C 51 174.500 174.500 174.537 -0.037 26060 986 1 2 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.447 1.553 26060 987 1 2 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.888 -1.608 26060 988 1 2 . 1 1 51 51 VAL H H 51 7.810 7.810 7.974 -0.164 26060 989 1 2 . 1 1 52 52 GLU N N 52 130.700 130.700 127.358 3.342 26060 990 1 2 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.511 -0.531 26060 991 1 2 . 1 1 52 52 GLU C C 52 175.400 175.400 175.659 -0.259 26060 992 1 2 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.042 1.058 26060 993 1 2 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.276 -0.696 26060 994 1 2 . 1 1 52 52 GLU H H 52 9.380 9.380 8.871 0.509 26060 995 1 2 . 1 1 53 53 LYS N N 53 109.200 109.200 113.873 -4.673 26060 996 1 2 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.927 -0.127 26060 997 1 2 . 1 1 53 53 LYS C C 53 172.300 172.300 174.536 -2.236 26060 998 1 2 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.630 0.210 26060 999 1 2 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.990 -1.740 26060 1000 1 2 . 1 1 53 53 LYS H H 53 7.190 7.190 7.397 -0.207 26060 1001 1 2 . 1 1 54 54 VAL N N 54 120.380 120.380 117.646 2.734 26060 1002 1 2 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.656 0.114 26060 1003 1 2 . 1 1 54 54 VAL C C 54 173.600 173.600 173.896 -0.296 26060 1004 1 2 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.498 -0.458 26060 1005 1 2 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.669 -1.969 26060 1006 1 2 . 1 1 54 54 VAL H H 54 8.450 8.450 8.299 0.151 26060 1007 1 2 . 1 1 55 55 VAL N N 55 126.920 126.920 122.598 4.322 26060 1008 1 2 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.858 -0.158 26060 1009 1 2 . 1 1 55 55 VAL C C 55 173.800 173.800 173.787 0.013 26060 1010 1 2 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.840 0.030 26060 1011 1 2 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.987 -2.887 26060 1012 1 2 . 1 1 55 55 VAL H H 55 9.260 9.260 9.136 0.124 26060 1013 1 2 . 1 1 56 56 PHE N N 56 126.130 126.130 123.852 2.278 26060 1014 1 2 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.985 -0.295 26060 1015 1 2 . 1 1 56 56 PHE C C 56 174.000 174.000 174.264 -0.264 26060 1016 1 2 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.752 -0.172 26060 1017 1 2 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.555 -1.665 26060 1018 1 2 . 1 1 56 56 PHE H H 56 9.290 9.290 8.560 0.730 26060 1019 1 2 . 1 1 57 57 HIS N N 57 124.180 124.180 124.148 0.032 26060 1020 1 2 . 1 1 57 57 HIS HA H 57 4.800 4.800 5.003 -0.203 26060 1021 1 2 . 1 1 57 57 HIS C C 57 174.700 174.700 174.820 -0.120 26060 1022 1 2 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.104 0.216 26060 1023 1 2 . 1 1 57 57 HIS CB C 57 30.100 30.100 29.021 1.079 26060 1024 1 2 . 1 1 57 57 HIS H H 57 8.690 8.690 8.479 0.211 26060 1025 1 2 . 1 1 58 58 LEU N N 58 122.050 122.050 123.495 -1.445 26060 1026 1 2 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.399 -0.159 26060 1027 1 2 . 1 1 58 58 LEU C C 58 174.400 174.400 176.992 -2.592 26060 1028 1 2 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.769 0.641 26060 1029 1 2 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.442 -1.282 26060 1030 1 2 . 1 1 58 58 LEU H H 58 9.050 9.050 8.167 0.883 26060 1031 1 2 . 1 1 59 59 HIS N N 59 118.510 118.510 117.868 0.642 26060 1032 1 2 . 1 1 59 59 HIS C C 59 175.300 175.300 176.518 -1.218 26060 1033 1 2 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.305 2.805 26060 1034 1 2 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.036 -0.106 26060 1035 1 2 . 1 1 59 59 HIS H H 59 5.160 5.160 7.937 -2.777 26060 1036 1 2 . 1 1 60 60 GLU N N 60 122.190 122.190 125.173 -2.983 26060 1037 1 2 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.967 -0.007 26060 1038 1 2 . 1 1 60 60 GLU C C 60 175.130 175.130 177.150 -2.020 26060 1039 1 2 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.912 -0.902 26060 1040 1 2 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.708 0.112 26060 1041 1 2 . 1 1 60 60 GLU H H 60 7.960 7.960 8.469 -0.509 26060 1042 1 2 . 1 1 61 61 SER N N 61 116.940 116.940 113.325 3.615 26060 1043 1 2 . 1 1 61 61 SER HA H 61 4.200 4.200 4.355 -0.155 26060 1044 1 2 . 1 1 61 61 SER CA C 61 60.010 60.010 59.875 0.135 26060 1045 1 2 . 1 1 61 61 SER CB C 61 63.140 63.140 63.332 -0.192 26060 1046 1 2 . 1 1 61 61 SER H H 61 8.540 8.540 8.287 0.253 26060 1047 1 2 . 1 1 62 62 PHE N N 62 123.700 123.700 122.827 0.873 26060 1048 1 2 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.684 -0.134 26060 1049 1 2 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.847 2.093 26060 1050 1 2 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.257 -0.857 26060 1051 1 2 . 1 1 62 62 PHE H H 62 8.640 8.640 8.159 0.481 26060 1052 1 2 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.492 -0.082 26060 1053 1 2 . 1 1 63 63 PRO C C 63 176.400 176.400 176.064 0.336 26060 1054 1 2 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.269 -0.669 26060 1055 1 2 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.979 -0.119 26060 1056 1 2 . 1 1 64 64 ARG N N 64 116.840 116.840 120.293 -3.453 26060 1057 1 2 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.104 -0.004 26060 1058 1 2 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.130 -0.520 26060 1059 1 2 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.748 0.082 26060 1060 1 2 . 1 1 64 64 ARG H H 64 8.890 8.890 8.620 0.270 26060 1061 1 2 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.403 -0.413 26060 1062 1 2 . 1 1 65 65 PRO C C 65 175.800 175.800 177.119 -1.319 26060 1063 1 2 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.964 1.846 26060 1064 1 2 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.974 -0.095 26060 1065 1 2 . 1 1 66 66 LYS N N 66 119.035 119.035 120.261 -1.226 26060 1066 1 2 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.070 -0.460 26060 1067 1 2 . 1 1 66 66 LYS C C 66 175.400 175.400 175.830 -0.430 26060 1068 1 2 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.270 0.183 26060 1069 1 2 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.062 -0.332 26060 1070 1 2 . 1 1 66 66 LYS H H 66 7.630 7.630 7.894 -0.264 26060 1071 1 2 . 1 1 67 67 ARG N N 67 127.394 127.394 127.975 -0.581 26060 1072 1 2 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.601 0.139 26060 1073 1 2 . 1 1 67 67 ARG C C 67 174.500 174.500 175.020 -0.520 26060 1074 1 2 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.679 0.121 26060 1075 1 2 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.000 -0.286 26060 1076 1 2 . 1 1 67 67 ARG H H 67 8.855 8.855 8.727 0.128 26060 1077 1 2 . 1 1 68 68 VAL N N 68 124.388 124.388 120.933 3.455 26060 1078 1 2 . 1 1 68 68 VAL HA H 68 4.580 4.580 4.853 -0.273 26060 1079 1 2 . 1 1 68 68 VAL C C 68 176.850 176.850 175.534 1.316 26060 1080 1 2 . 1 1 68 68 VAL CA C 68 62.073 62.073 60.297 1.776 26060 1081 1 2 . 1 1 68 68 VAL CB C 68 33.604 33.604 32.869 0.735 26060 1082 1 2 . 1 1 68 68 VAL H H 68 8.681 8.681 8.353 0.328 26060 1083 1 2 . 1 1 69 69 CYS N N 69 127.080 127.080 126.491 0.589 26060 1084 1 2 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.725 0.345 26060 1085 1 2 . 1 1 69 69 CYS CA C 69 58.346 58.346 58.262 0.084 26060 1086 1 2 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.758 0.012 26060 1087 1 2 . 1 1 69 69 CYS H H 69 9.455 9.455 8.981 0.474 26060 1088 1 2 . 1 1 70 70 LYS N N 70 125.480 125.480 122.505 2.975 26060 1089 1 2 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.479 0.011 26060 1090 1 2 . 1 1 70 70 LYS C C 70 174.300 174.300 175.732 -1.432 26060 1091 1 2 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.678 1.082 26060 1092 1 2 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.472 -0.302 26060 1093 1 2 . 1 1 70 70 LYS H H 70 9.050 9.050 8.766 0.284 26060 1094 1 2 . 1 1 71 71 ASP N N 71 116.940 116.940 118.879 -1.939 26060 1095 1 2 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.719 0.381 26060 1096 1 2 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.352 -0.272 26060 1097 1 2 . 1 1 71 71 ASP CB C 71 43.380 43.380 39.756 3.624 26060 1098 1 2 . 1 1 71 71 ASP H H 71 7.620 7.620 7.477 0.143 26060 1099 1 2 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.179 -0.919 26060 1100 1 2 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.878 -2.228 26060 1101 1 2 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.934 -0.894 26060 1102 1 2 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.144 -0.044 26060 1103 1 2 . 1 1 73 73 PRO C C 73 174.700 174.700 175.893 -1.193 26060 1104 1 2 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.316 -2.626 26060 1105 1 2 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.295 2.745 26060 1106 1 2 . 1 1 74 74 TYR N N 74 125.400 125.400 124.896 0.504 26060 1107 1 2 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.473 0.377 26060 1108 1 2 . 1 1 74 74 TYR C C 74 172.900 172.900 175.357 -2.457 26060 1109 1 2 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.164 -2.494 26060 1110 1 2 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.617 -3.217 26060 1111 1 2 . 1 1 74 74 TYR H H 74 8.960 8.960 8.315 0.645 26060 1112 1 2 . 1 1 75 75 LYS N N 75 121.400 121.400 119.877 1.523 26060 1113 1 2 . 1 1 75 75 LYS HA H 75 5.590 5.590 4.849 0.741 26060 1114 1 2 . 1 1 75 75 LYS C C 75 173.800 173.800 174.247 -0.447 26060 1115 1 2 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.488 0.162 26060 1116 1 2 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.573 -0.683 26060 1117 1 2 . 1 1 75 75 LYS H H 75 7.670 7.670 7.877 -0.207 26060 1118 1 2 . 1 1 76 76 VAL N N 76 119.800 119.800 120.424 -0.624 26060 1119 1 2 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.140 -0.250 26060 1120 1 2 . 1 1 76 76 VAL C C 76 173.900 173.900 174.154 -0.254 26060 1121 1 2 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.592 1.138 26060 1122 1 2 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.679 -0.139 26060 1123 1 2 . 1 1 76 76 VAL H H 76 8.180 8.180 7.810 0.370 26060 1124 1 2 . 1 1 77 77 GLU N N 77 126.190 126.190 126.640 -0.450 26060 1125 1 2 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.927 0.023 26060 1126 1 2 . 1 1 77 77 GLU C C 77 174.700 174.700 174.964 -0.264 26060 1127 1 2 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.189 -0.249 26060 1128 1 2 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.832 -0.282 26060 1129 1 2 . 1 1 77 77 GLU H H 77 8.270 8.270 8.550 -0.280 26060 1130 1 2 . 1 1 78 78 GLU N N 78 126.180 126.180 123.560 2.620 26060 1131 1 2 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.589 -0.139 26060 1132 1 2 . 1 1 78 78 GLU C C 78 175.400 175.400 173.800 1.600 26060 1133 1 2 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.984 0.058 26060 1134 1 2 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.951 3.149 26060 1135 1 2 . 1 1 78 78 GLU H H 78 7.870 7.870 8.451 -0.581 26060 1136 1 2 . 1 1 79 79 SER N N 79 112.109 112.109 113.201 -1.092 26060 1137 1 2 . 1 1 79 79 SER HA H 79 5.560 5.560 5.393 0.167 26060 1138 1 2 . 1 1 79 79 SER C C 79 172.490 172.490 172.989 -0.499 26060 1139 1 2 . 1 1 79 79 SER CA C 79 57.754 57.754 56.431 1.323 26060 1140 1 2 . 1 1 79 79 SER CB C 79 65.861 65.861 65.430 0.431 26060 1141 1 2 . 1 1 79 79 SER H H 79 7.714 7.714 8.341 -0.627 26060 1142 1 2 . 1 1 80 80 GLY N N 80 106.048 106.048 110.357 -4.309 26060 1143 1 2 . 1 1 80 80 GLY C C 80 172.630 172.630 172.077 0.553 26060 1144 1 2 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.398 1.172 26060 1145 1 2 . 1 1 80 80 GLY H H 80 8.828 8.828 8.907 -0.079 26060 1146 1 2 . 1 1 81 81 TYR N N 81 115.280 115.280 116.988 -1.708 26060 1147 1 2 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.382 0.298 26060 1148 1 2 . 1 1 81 81 TYR C C 81 174.100 174.100 174.106 -0.006 26060 1149 1 2 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.395 -0.895 26060 1150 1 2 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.058 2.282 26060 1151 1 2 . 1 1 81 81 TYR H H 81 8.770 8.770 8.200 0.570 26060 1152 1 2 . 1 1 82 82 ALA N N 82 122.350 122.350 122.566 -0.216 26060 1153 1 2 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.544 -0.144 26060 1154 1 2 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.652 0.388 26060 1155 1 2 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.192 1.208 26060 1156 1 2 . 1 1 82 82 ALA H H 82 7.160 7.160 7.374 -0.214 26060 1157 1 2 . 1 1 83 83 GLY N N 83 107.100 107.100 106.650 0.450 26060 1158 1 2 . 1 1 83 83 GLY C C 83 172.500 172.500 173.604 -1.104 26060 1159 1 2 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.106 0.504 26060 1160 1 2 . 1 1 83 83 GLY H H 83 8.220 8.220 8.271 -0.051 26060 1161 1 2 . 1 1 84 84 PHE N N 84 111.660 111.660 115.592 -3.932 26060 1162 1 2 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.609 0.081 26060 1163 1 2 . 1 1 84 84 PHE C C 84 172.460 172.460 173.551 -1.091 26060 1164 1 2 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.577 -0.077 26060 1165 1 2 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.691 -1.111 26060 1166 1 2 . 1 1 84 84 PHE H H 84 7.700 7.700 7.905 -0.205 26060 1167 1 2 . 1 1 85 85 ILE N N 85 117.810 117.810 121.568 -3.758 26060 1168 1 2 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.124 0.186 26060 1169 1 2 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.972 -1.632 26060 1170 1 2 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.247 -1.987 26060 1171 1 2 . 1 1 85 85 ILE H H 85 8.340 8.340 8.580 -0.240 26060 1172 1 2 . 1 1 86 86 LEU N N 86 108.130 108.130 129.435 -21.305 26060 1173 1 2 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.049 -0.069 26060 1174 1 2 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.035 2.165 26060 1175 1 2 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.694 -0.394 26060 1176 1 2 . 1 1 86 86 LEU H H 86 9.900 9.900 8.859 1.041 26060 1177 1 2 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.488 0.612 26060 1178 1 2 . 1 1 87 87 PRO C C 87 175.340 175.340 175.811 -0.471 26060 1179 1 2 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.901 0.209 26060 1180 1 2 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.586 0.974 26060 1181 1 2 . 1 1 88 88 ILE N N 88 126.000 126.000 125.831 0.169 26060 1182 1 2 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.211 0.579 26060 1183 1 2 . 1 1 88 88 ILE C C 88 176.100 176.100 175.137 0.963 26060 1184 1 2 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.499 0.061 26060 1185 1 2 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.013 1.987 26060 1186 1 2 . 1 1 88 88 ILE H H 88 9.380 9.380 8.595 0.785 26060 1187 1 2 . 1 1 89 89 GLU N N 89 123.900 123.900 124.162 -0.262 26060 1188 1 2 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.284 -0.084 26060 1189 1 2 . 1 1 89 89 GLU C C 89 173.800 173.800 175.406 -1.606 26060 1190 1 2 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.523 -0.553 26060 1191 1 2 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.713 0.667 26060 1192 1 2 . 1 1 89 89 GLU H H 89 9.320 9.320 8.837 0.483 26060 1193 1 2 . 1 1 90 90 VAL N N 90 123.980 123.980 122.784 1.196 26060 1194 1 2 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.192 -0.032 26060 1195 1 2 . 1 1 90 90 VAL C C 90 174.800 174.800 174.425 0.375 26060 1196 1 2 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.111 0.879 26060 1197 1 2 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.587 -1.097 26060 1198 1 2 . 1 1 90 90 VAL H H 90 8.630 8.630 8.342 0.288 26060 1199 1 2 . 1 1 91 91 TYR N N 91 124.230 124.230 125.924 -1.694 26060 1200 1 2 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.629 0.031 26060 1201 1 2 . 1 1 91 91 TYR C C 91 176.800 176.800 175.519 1.281 26060 1202 1 2 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.036 -0.336 26060 1203 1 2 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.948 1.292 26060 1204 1 2 . 1 1 91 91 TYR H H 91 8.640 8.640 9.100 -0.460 26060 1205 1 2 . 1 1 92 92 PHE N N 92 121.200 121.200 122.683 -1.483 26060 1206 1 2 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.231 0.429 26060 1207 1 2 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.891 1.619 26060 1208 1 2 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.725 0.975 26060 1209 1 2 . 1 1 92 92 PHE H H 92 8.750 8.750 9.028 -0.278 26060 1210 1 2 . 1 1 93 93 LYS N N 93 123.450 123.450 122.491 0.959 26060 1211 1 2 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.539 0.061 26060 1212 1 2 . 1 1 93 93 LYS C C 93 174.200 174.200 175.205 -1.005 26060 1213 1 2 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.127 -0.947 26060 1214 1 2 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.133 -0.453 26060 1215 1 2 . 1 1 93 93 LYS H H 93 8.560 8.560 9.061 -0.501 26060 1216 1 2 . 1 1 94 94 ASN N N 94 118.800 118.800 120.645 -1.845 26060 1217 1 2 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.957 -0.517 26060 1218 1 2 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.406 -1.196 26060 1219 1 2 . 1 1 94 94 ASN CB C 94 39.800 39.800 42.084 -2.284 26060 1220 1 2 . 1 1 94 94 ASN H H 94 7.820 7.820 8.125 -0.305 26060 1221 1 2 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.358 -0.028 26060 1222 1 2 . 1 1 95 95 LYS C C 95 175.800 175.800 175.326 0.474 26060 1223 1 2 . 1 1 95 95 LYS CA C 95 56.210 56.210 57.392 -1.182 26060 1224 1 2 . 1 1 95 95 LYS CB C 95 33.010 33.010 32.986 0.024 26060 1225 1 2 . 1 1 96 96 GLU N N 96 118.330 118.330 118.868 -0.538 26060 1226 1 2 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.413 0.097 26060 1227 1 2 . 1 1 96 96 GLU C C 96 173.200 173.200 175.951 -2.751 26060 1228 1 2 . 1 1 96 96 GLU CA C 96 54.100 54.100 54.142 -0.042 26060 1229 1 2 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.809 1.661 26060 1230 1 2 . 1 1 96 96 GLU H H 96 7.120 7.120 7.593 -0.473 26060 1231 1 2 . 1 1 97 97 GLU N N 97 115.630 115.630 119.511 -3.881 26060 1232 1 2 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.183 0.247 26060 1233 1 2 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.160 -1.300 26060 1234 1 2 . 1 1 97 97 GLU CB C 97 29.270 29.270 29.134 0.136 26060 1235 1 2 . 1 1 97 97 GLU H H 97 8.060 8.060 8.375 -0.315 26060 1236 1 2 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.240 0.760 26060 1237 1 2 . 1 1 98 98 PRO C C 98 175.900 175.900 176.125 -0.225 26060 1238 1 2 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.272 -2.112 26060 1239 1 2 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.244 1.756 26060 1240 1 2 . 1 1 99 99 ARG N N 99 122.800 122.800 118.419 4.381 26060 1241 1 2 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.585 0.045 26060 1242 1 2 . 1 1 99 99 ARG C C 99 175.800 175.800 175.522 0.278 26060 1243 1 2 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.165 0.325 26060 1244 1 2 . 1 1 99 99 ARG CB C 99 30.410 30.410 31.082 -0.672 26060 1245 1 2 . 1 1 99 99 ARG H H 99 8.602 8.602 8.520 0.082 26060 1246 1 2 . 1 1 100 100 LYS N N 100 113.220 113.220 117.272 -4.052 26060 1247 1 2 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.705 0.235 26060 1248 1 2 . 1 1 100 100 LYS C C 100 174.100 174.100 174.349 -0.249 26060 1249 1 2 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.371 -0.461 26060 1250 1 2 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.667 -0.947 26060 1251 1 2 . 1 1 100 100 LYS H H 100 7.650 7.650 7.358 0.292 26060 1252 1 2 . 1 1 101 101 VAL N N 101 116.230 116.230 121.389 -5.159 26060 1253 1 2 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.161 0.109 26060 1254 1 2 . 1 1 101 101 VAL C C 101 171.600 171.600 173.610 -2.010 26060 1255 1 2 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.081 1.179 26060 1256 1 2 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.419 -0.239 26060 1257 1 2 . 1 1 101 101 VAL H H 101 8.120 8.120 8.181 -0.061 26060 1258 1 2 . 1 1 102 102 ARG N N 102 124.980 124.980 126.812 -1.832 26060 1259 1 2 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.834 0.326 26060 1260 1 2 . 1 1 102 102 ARG C C 102 174.340 174.340 175.195 -0.855 26060 1261 1 2 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.703 -0.953 26060 1262 1 2 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.870 1.480 26060 1263 1 2 . 1 1 102 102 ARG H H 102 7.930 7.930 8.223 -0.293 26060 1264 1 2 . 1 1 103 103 PHE N N 103 124.590 124.590 126.811 -2.221 26060 1265 1 2 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.811 -0.019 26060 1266 1 2 . 1 1 103 103 PHE C C 103 174.280 174.280 174.741 -0.461 26060 1267 1 2 . 1 1 103 103 PHE CA C 103 55.980 55.980 55.044 0.937 26060 1268 1 2 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.105 2.146 26060 1269 1 2 . 1 1 103 103 PHE H H 103 9.390 9.390 9.146 0.244 26060 1270 1 2 . 1 1 104 104 ASP N N 104 124.700 124.700 126.551 -1.851 26060 1271 1 2 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.709 0.090 26060 1272 1 2 . 1 1 104 104 ASP C C 104 174.500 174.500 174.942 -0.442 26060 1273 1 2 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.831 -0.442 26060 1274 1 2 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.822 0.408 26060 1275 1 2 . 1 1 104 104 ASP H H 104 9.010 9.010 8.913 0.097 26060 1276 1 2 . 1 1 105 105 TYR N N 105 129.840 129.840 125.190 4.650 26060 1277 1 2 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.519 -0.419 26060 1278 1 2 . 1 1 105 105 TYR C C 105 173.100 173.100 174.018 -0.918 26060 1279 1 2 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.712 0.968 26060 1280 1 2 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.950 0.900 26060 1281 1 2 . 1 1 105 105 TYR H H 105 8.140 8.140 8.252 -0.112 26060 1282 1 2 . 1 1 106 106 ASP N N 106 126.800 126.800 127.855 -1.055 26060 1283 1 2 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.377 -0.157 26060 1284 1 2 . 1 1 106 106 ASP C C 106 172.900 172.900 174.597 -1.697 26060 1285 1 2 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.641 -0.131 26060 1286 1 2 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.171 -1.671 26060 1287 1 2 . 1 1 106 106 ASP H H 106 7.730 7.730 8.276 -0.546 26060 1288 1 2 . 1 1 107 107 LEU N N 107 132.150 132.150 128.483 3.667 26060 1289 1 2 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.464 -0.624 26060 1290 1 2 . 1 1 107 107 LEU C C 107 172.100 172.100 175.013 -2.913 26060 1291 1 2 . 1 1 107 107 LEU CA C 107 53.700 53.700 54.058 -0.358 26060 1292 1 2 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.317 -2.077 26060 1293 1 2 . 1 1 107 107 LEU H H 107 7.770 7.770 7.729 0.041 26060 1294 1 2 . 1 1 108 108 PHE N N 108 118.960 118.960 121.687 -2.727 26060 1295 1 2 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.932 -0.242 26060 1296 1 2 . 1 1 108 108 PHE C C 108 174.300 174.300 173.881 0.419 26060 1297 1 2 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.267 -0.577 26060 1298 1 2 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.567 -0.277 26060 1299 1 2 . 1 1 108 108 PHE H H 108 6.060 6.060 7.050 -0.990 26060 1300 1 2 . 1 1 109 109 LEU N N 109 118.900 118.900 123.655 -4.755 26060 1301 1 2 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.803 -0.403 26060 1302 1 2 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.485 -1.325 26060 1303 1 2 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.351 -1.271 26060 1304 1 2 . 1 1 109 109 LEU H H 109 8.388 8.388 8.470 -0.082 26060 1305 1 2 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.416 0.024 26060 1306 1 2 . 1 1 111 111 LEU C C 111 177.300 177.300 177.080 0.220 26060 1307 1 2 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.108 -0.888 26060 1308 1 2 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.618 1.252 26060 1309 1 2 . 1 1 112 112 GLU N N 112 120.660 120.660 122.923 -2.263 26060 1310 1 2 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.029 0.141 26060 1311 1 2 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.519 -0.059 26060 1312 1 2 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.916 -0.226 26060 1313 1 2 . 1 1 112 112 GLU H H 112 8.780 8.780 8.770 0.010 26060 1314 1 2 . 1 1 113 113 GLY C C 113 173.900 173.900 173.891 0.009 26060 1315 1 2 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.837 0.113 26060 1316 1 2 . 1 1 114 114 HIS N N 114 120.890 120.890 120.117 0.773 26060 1317 1 2 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.066 -0.160 26060 1318 1 2 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.476 0.294 26060 1319 1 2 . 1 1 114 114 HIS CB C 114 30.590 30.590 32.186 -1.596 26060 1320 1 2 . 1 1 114 114 HIS H H 114 7.934 7.934 7.925 0.009 26060 1321 1 2 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.122 -0.322 26060 1322 1 2 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.983 1.107 26060 1323 1 2 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.725 -1.045 26060 1324 1 2 . 1 1 116 116 PRO C C 116 176.600 176.600 175.582 1.018 26060 1325 1 2 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.059 0.241 26060 1326 1 2 . 1 1 117 117 VAL N N 117 127.480 127.480 126.508 0.972 26060 1327 1 2 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.237 -0.447 26060 1328 1 2 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.850 0.850 26060 1329 1 2 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.756 -0.556 26060 1330 1 2 . 1 1 117 117 VAL H H 117 8.890 8.890 7.923 0.967 26060 1331 1 2 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.895 0.095 26060 1332 1 2 . 1 1 118 118 ASN C C 118 172.700 172.700 173.626 -0.926 26060 1333 1 2 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.600 -0.240 26060 1334 1 2 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.951 -0.751 26060 1335 1 2 . 1 1 119 119 HIS N N 119 124.930 124.930 125.913 -0.983 26060 1336 1 2 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.080 -0.260 26060 1337 1 2 . 1 1 119 119 HIS C C 119 173.500 173.500 172.862 0.638 26060 1338 1 2 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.039 1.931 26060 1339 1 2 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.040 0.630 26060 1340 1 2 . 1 1 119 119 HIS H H 119 8.790 8.790 8.900 -0.110 26060 1341 1 2 . 1 1 120 120 LEU N N 120 128.280 128.280 124.742 3.538 26060 1342 1 2 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.269 -0.319 26060 1343 1 2 . 1 1 120 120 LEU C C 120 174.030 174.030 174.957 -0.927 26060 1344 1 2 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.211 1.229 26060 1345 1 2 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.389 0.211 26060 1346 1 2 . 1 1 120 120 LEU H H 120 7.460 7.460 8.529 -1.069 26060 1347 1 2 . 1 1 121 121 ARG N N 121 128.060 128.060 122.591 5.469 26060 1348 1 2 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.574 0.066 26060 1349 1 2 . 1 1 121 121 ARG C C 121 173.400 173.400 173.424 -0.024 26060 1350 1 2 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.586 -0.226 26060 1351 1 2 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.984 1.276 26060 1352 1 2 . 1 1 121 121 ARG H H 121 9.860 9.860 8.714 1.146 26060 1353 1 2 . 1 1 122 122 CYS N N 122 125.290 125.290 121.053 4.237 26060 1354 1 2 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.094 -0.074 26060 1355 1 2 . 1 1 122 122 CYS C C 122 174.600 174.600 174.470 0.130 26060 1356 1 2 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.385 1.905 26060 1357 1 2 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.429 -1.399 26060 1358 1 2 . 1 1 122 122 CYS H H 122 8.835 8.835 8.557 0.278 26060 1359 1 2 . 1 1 123 123 GLU N N 123 125.920 125.920 124.871 1.049 26060 1360 1 2 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.494 0.186 26060 1361 1 2 . 1 1 123 123 GLU C C 123 174.500 174.500 174.659 -0.159 26060 1362 1 2 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.717 -0.297 26060 1363 1 2 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.690 0.893 26060 1364 1 2 . 1 1 123 123 GLU H H 123 8.970 8.970 9.168 -0.198 26060 1365 1 2 . 1 1 124 124 LYS N N 124 121.837 121.837 121.408 0.429 26060 1366 1 2 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.882 0.078 26060 1367 1 2 . 1 1 124 124 LYS C C 124 175.700 175.700 175.717 -0.017 26060 1368 1 2 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.054 0.303 26060 1369 1 2 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.690 -0.501 26060 1370 1 2 . 1 1 124 124 LYS H H 124 8.652 8.652 8.358 0.294 26060 1371 1 2 . 1 1 125 125 LEU N N 125 127.000 127.000 129.270 -2.270 26060 1372 1 2 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.632 0.018 26060 1373 1 2 . 1 1 125 125 LEU C C 125 175.110 175.110 175.595 -0.485 26060 1374 1 2 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.897 -0.043 26060 1375 1 2 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.611 0.656 26060 1376 1 2 . 1 1 125 125 LEU H H 125 9.175 9.175 8.945 0.230 26060 1377 1 2 . 1 1 126 126 THR N N 126 117.779 117.779 120.008 -2.229 26060 1378 1 2 . 1 1 126 126 THR HA H 126 4.650 4.650 4.643 0.007 26060 1379 1 2 . 1 1 126 126 THR C C 126 173.200 173.200 173.521 -0.321 26060 1380 1 2 . 1 1 126 126 THR CA C 126 62.036 62.036 61.724 0.312 26060 1381 1 2 . 1 1 126 126 THR CB C 126 70.284 70.284 69.243 1.041 26060 1382 1 2 . 1 1 126 126 THR H H 126 8.331 8.331 8.388 -0.057 26060 1383 1 2 . 1 1 127 127 PHE N N 127 126.576 126.576 125.801 0.775 26060 1384 1 2 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.662 -0.072 26060 1385 1 2 . 1 1 127 127 PHE C C 127 174.860 174.860 174.575 0.285 26060 1386 1 2 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.582 0.282 26060 1387 1 2 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.939 -1.939 26060 1388 1 2 . 1 1 127 127 PHE H H 127 9.051 9.051 8.928 0.123 26060 1389 1 2 . 1 1 128 128 ASN N N 128 123.040 123.040 123.590 -0.550 26060 1390 1 2 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.641 -0.021 26060 1391 1 2 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.755 0.725 26060 1392 1 2 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.807 0.653 26060 1393 1 2 . 1 1 128 128 ASN H H 128 8.880 8.880 8.860 0.020 26060 1394 1 2 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.545 0.215 26060 1395 1 2 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.214 -0.314 26060 1396 1 2 . 1 1 129 129 ASN CB C 129 38.730 38.730 38.627 0.103 26060 1397 1 2 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.625 0.165 26060 1398 1 2 . 1 1 130 130 PRO C C 130 177.470 177.470 176.803 0.667 26060 1399 1 2 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.621 -0.047 26060 1400 1 2 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.969 -0.659 26060 1401 1 2 . 1 1 131 131 THR N N 131 113.400 113.400 115.109 -1.709 26060 1402 1 2 . 1 1 131 131 THR HA H 131 4.300 4.300 4.199 0.101 26060 1403 1 2 . 1 1 131 131 THR C C 131 175.200 175.200 176.062 -0.862 26060 1404 1 2 . 1 1 131 131 THR CA C 131 62.200 62.200 61.821 0.379 26060 1405 1 2 . 1 1 131 131 THR CB C 131 70.600 70.600 70.263 0.337 26060 1406 1 2 . 1 1 131 131 THR H H 131 8.950 8.950 8.245 0.705 26060 1407 1 2 . 1 1 132 132 GLU N N 132 122.199 122.199 125.455 -3.256 26060 1408 1 2 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.010 -0.000 26060 1409 1 2 . 1 1 132 132 GLU C C 132 178.700 178.700 178.225 0.475 26060 1410 1 2 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.155 0.139 26060 1411 1 2 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.679 -0.518 26060 1412 1 2 . 1 1 132 132 GLU H H 132 8.932 8.932 9.053 -0.121 26060 1413 1 2 . 1 1 133 133 ASP N N 133 116.324 116.324 119.989 -3.665 26060 1414 1 2 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.371 -0.041 26060 1415 1 2 . 1 1 133 133 ASP C C 133 177.800 177.800 178.605 -0.805 26060 1416 1 2 . 1 1 133 133 ASP CA C 133 57.546 57.546 58.029 -0.483 26060 1417 1 2 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.550 1.273 26060 1418 1 2 . 1 1 133 133 ASP H H 133 8.490 8.490 7.930 0.560 26060 1419 1 2 . 1 1 134 134 PHE N N 134 119.914 119.914 120.887 -0.973 26060 1420 1 2 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.263 0.347 26060 1421 1 2 . 1 1 134 134 PHE C C 134 177.300 177.300 177.234 0.066 26060 1422 1 2 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.815 -0.277 26060 1423 1 2 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.971 0.229 26060 1424 1 2 . 1 1 134 134 PHE H H 134 7.787 7.787 7.505 0.282 26060 1425 1 2 . 1 1 135 135 ARG N N 135 119.794 119.794 120.148 -0.354 26060 1426 1 2 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.578 -0.228 26060 1427 1 2 . 1 1 135 135 ARG C C 135 177.370 177.370 178.255 -0.885 26060 1428 1 2 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.035 0.341 26060 1429 1 2 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.982 0.414 26060 1430 1 2 . 1 1 135 135 ARG H H 135 9.087 9.087 8.877 0.210 26060 1431 1 2 . 1 1 136 136 ARG N N 136 114.554 114.554 118.818 -4.264 26060 1432 1 2 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.875 -0.055 26060 1433 1 2 . 1 1 136 136 ARG C C 136 178.950 178.950 178.703 0.247 26060 1434 1 2 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.892 -0.092 26060 1435 1 2 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.157 0.059 26060 1436 1 2 . 1 1 136 136 ARG H H 136 7.747 7.747 8.203 -0.456 26060 1437 1 2 . 1 1 137 137 LYS N N 137 118.298 118.298 119.174 -0.876 26060 1438 1 2 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.938 -0.038 26060 1439 1 2 . 1 1 137 137 LYS C C 137 177.980 177.980 179.028 -1.048 26060 1440 1 2 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.582 0.813 26060 1441 1 2 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.361 0.086 26060 1442 1 2 . 1 1 137 137 LYS H H 137 7.154 7.154 7.484 -0.330 26060 1443 1 2 . 1 1 138 138 LEU N N 138 117.159 117.159 119.067 -1.908 26060 1444 1 2 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.703 -0.283 26060 1445 1 2 . 1 1 138 138 LEU C C 138 179.100 179.100 178.985 0.115 26060 1446 1 2 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.363 -0.132 26060 1447 1 2 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.248 1.080 26060 1448 1 2 . 1 1 138 138 LEU H H 138 7.709 7.709 7.763 -0.054 26060 1449 1 2 . 1 1 139 139 LEU N N 139 115.158 115.158 117.597 -2.439 26060 1450 1 2 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.038 0.112 26060 1451 1 2 . 1 1 139 139 LEU C C 139 177.600 177.600 178.549 -0.949 26060 1452 1 2 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.943 -1.414 26060 1453 1 2 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.682 0.062 26060 1454 1 2 . 1 1 139 139 LEU H H 139 7.507 7.507 8.148 -0.641 26060 1455 1 2 . 1 1 140 140 LYS N N 140 120.256 120.256 118.015 2.241 26060 1456 1 2 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.074 0.036 26060 1457 1 2 . 1 1 140 140 LYS C C 140 175.800 175.800 176.959 -1.159 26060 1458 1 2 . 1 1 140 140 LYS CA C 140 57.052 57.052 56.946 0.106 26060 1459 1 2 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.488 0.158 26060 1460 1 2 . 1 1 140 140 LYS H H 140 7.304 7.304 7.527 -0.223 26060 1461 1 3 . 1 1 4 4 MET C C 4 175.800 175.800 176.066 -0.266 26060 1462 1 3 . 1 1 4 4 MET CA C 4 55.350 55.350 55.998 -0.648 26060 1463 1 3 . 1 1 4 4 MET CB C 4 32.880 32.880 33.515 -0.635 26060 1464 1 3 . 1 1 5 5 ALA N N 5 125.230 125.230 122.448 2.782 26060 1465 1 3 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.423 -0.073 26060 1466 1 3 . 1 1 5 5 ALA CA C 5 52.430 52.430 52.387 0.043 26060 1467 1 3 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.602 -0.232 26060 1468 1 3 . 1 1 5 5 ALA H H 5 8.320 8.320 8.011 0.309 26060 1469 1 3 . 1 1 6 6 SER HA H 6 4.490 4.490 4.521 -0.031 26060 1470 1 3 . 1 1 6 6 SER CA C 6 58.200 58.200 58.120 0.080 26060 1471 1 3 . 1 1 6 6 SER CB C 6 63.700 63.700 63.103 0.597 26060 1472 1 3 . 1 1 7 7 SER HA H 7 4.530 4.530 5.288 -0.758 26060 1473 1 3 . 1 1 7 7 SER CA C 7 58.200 58.200 57.287 0.913 26060 1474 1 3 . 1 1 7 7 SER CB C 7 63.700 63.700 64.038 -0.338 26060 1475 1 3 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.639 -0.029 26060 1476 1 3 . 1 1 8 8 CYS C C 8 173.500 173.500 173.100 0.400 26060 1477 1 3 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.379 0.961 26060 1478 1 3 . 1 1 8 8 CYS CB C 8 28.490 28.490 29.759 -1.269 26060 1479 1 3 . 1 1 9 9 ALA N N 9 124.700 124.700 131.954 -7.254 26060 1480 1 3 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.276 -0.486 26060 1481 1 3 . 1 1 9 9 ALA C C 9 177.400 177.400 176.248 1.152 26060 1482 1 3 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.311 1.759 26060 1483 1 3 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.234 0.395 26060 1484 1 3 . 1 1 9 9 ALA H H 9 7.960 7.960 8.559 -0.599 26060 1485 1 3 . 1 1 10 10 VAL N N 10 120.124 120.124 124.955 -4.831 26060 1486 1 3 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.270 0.020 26060 1487 1 3 . 1 1 10 10 VAL C C 10 173.900 173.900 175.001 -1.101 26060 1488 1 3 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.507 0.043 26060 1489 1 3 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.979 1.921 26060 1490 1 3 . 1 1 10 10 VAL H H 10 8.424 8.424 8.457 -0.033 26060 1491 1 3 . 1 1 11 11 GLN N N 11 125.818 125.818 126.135 -0.317 26060 1492 1 3 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.314 0.246 26060 1493 1 3 . 1 1 11 11 GLN C C 11 175.400 175.400 175.119 0.281 26060 1494 1 3 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.454 -0.331 26060 1495 1 3 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.732 1.297 26060 1496 1 3 . 1 1 11 11 GLN H H 11 8.636 8.636 8.551 0.085 26060 1497 1 3 . 1 1 12 12 VAL N N 12 119.106 119.106 120.126 -1.020 26060 1498 1 3 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.386 0.244 26060 1499 1 3 . 1 1 12 12 VAL C C 12 173.800 173.800 175.027 -1.227 26060 1500 1 3 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.702 0.098 26060 1501 1 3 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.463 2.248 26060 1502 1 3 . 1 1 12 12 VAL H H 12 8.827 8.827 8.804 0.023 26060 1503 1 3 . 1 1 13 13 LYS N N 13 121.700 121.700 125.551 -3.851 26060 1504 1 3 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.226 -0.026 26060 1505 1 3 . 1 1 13 13 LYS C C 13 175.030 175.030 175.863 -0.833 26060 1506 1 3 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.205 0.225 26060 1507 1 3 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.245 1.675 26060 1508 1 3 . 1 1 13 13 LYS H H 13 8.234 8.234 8.566 -0.332 26060 1509 1 3 . 1 1 14 14 LEU N N 14 119.100 119.100 124.849 -5.749 26060 1510 1 3 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.330 -0.380 26060 1511 1 3 . 1 1 14 14 LEU C C 14 175.110 175.110 175.383 -0.273 26060 1512 1 3 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.413 -0.056 26060 1513 1 3 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.675 1.246 26060 1514 1 3 . 1 1 14 14 LEU H H 14 8.840 8.840 8.567 0.273 26060 1515 1 3 . 1 1 15 15 GLU N N 15 120.978 120.978 123.271 -2.293 26060 1516 1 3 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.132 -0.142 26060 1517 1 3 . 1 1 15 15 GLU C C 15 173.800 173.800 175.013 -1.213 26060 1518 1 3 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.627 0.801 26060 1519 1 3 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.754 -0.928 26060 1520 1 3 . 1 1 15 15 GLU H H 15 9.181 9.181 9.331 -0.150 26060 1521 1 3 . 1 1 16 16 LEU N N 16 124.438 124.438 126.475 -2.037 26060 1522 1 3 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.291 -0.181 26060 1523 1 3 . 1 1 16 16 LEU C C 16 174.700 174.700 176.282 -1.582 26060 1524 1 3 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.769 0.307 26060 1525 1 3 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.477 2.415 26060 1526 1 3 . 1 1 16 16 LEU H H 16 8.891 8.891 8.912 -0.021 26060 1527 1 3 . 1 1 17 17 GLY N N 17 108.067 108.067 108.540 -0.473 26060 1528 1 3 . 1 1 17 17 GLY C C 17 170.350 170.350 172.342 -1.992 26060 1529 1 3 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.230 1.754 26060 1530 1 3 . 1 1 17 17 GLY H H 17 7.227 7.227 8.534 -1.307 26060 1531 1 3 . 1 1 18 18 HIS N N 18 111.200 111.200 118.652 -7.452 26060 1532 1 3 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.899 -0.279 26060 1533 1 3 . 1 1 18 18 HIS C C 18 172.400 172.400 172.757 -0.357 26060 1534 1 3 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.779 -0.839 26060 1535 1 3 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.530 1.630 26060 1536 1 3 . 1 1 18 18 HIS H H 18 8.150 8.150 9.116 -0.966 26060 1537 1 3 . 1 1 19 19 ARG N N 19 117.800 117.800 121.921 -4.121 26060 1538 1 3 . 1 1 19 19 ARG HA H 19 5.100 5.100 5.013 0.087 26060 1539 1 3 . 1 1 19 19 ARG C C 19 175.800 175.800 174.379 1.421 26060 1540 1 3 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.850 -0.350 26060 1541 1 3 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.056 -0.406 26060 1542 1 3 . 1 1 19 19 ARG H H 19 9.010 9.010 8.833 0.177 26060 1543 1 3 . 1 1 20 20 ALA N N 20 120.390 120.390 120.890 -0.500 26060 1544 1 3 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.557 -0.027 26060 1545 1 3 . 1 1 20 20 ALA C C 20 175.800 175.800 175.029 0.771 26060 1546 1 3 . 1 1 20 20 ALA CA C 20 52.190 52.190 51.331 0.858 26060 1547 1 3 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.054 0.696 26060 1548 1 3 . 1 1 20 20 ALA H H 20 8.070 8.070 8.485 -0.415 26060 1549 1 3 . 1 1 21 21 GLN N N 21 121.790 121.790 121.544 0.246 26060 1550 1 3 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.056 0.174 26060 1551 1 3 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.686 -0.356 26060 1552 1 3 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.969 -0.069 26060 1553 1 3 . 1 1 21 21 GLN H H 21 9.240 9.240 9.208 0.032 26060 1554 1 3 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.450 -0.820 26060 1555 1 3 . 1 1 22 22 VAL C C 22 176.500 176.500 175.001 1.499 26060 1556 1 3 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.123 2.907 26060 1557 1 3 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.741 -2.141 26060 1558 1 3 . 1 1 23 23 ARG N N 23 127.840 127.840 127.588 0.252 26060 1559 1 3 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.577 -0.447 26060 1560 1 3 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.268 1.332 26060 1561 1 3 . 1 1 23 23 ARG CB C 23 32.150 32.150 31.010 1.140 26060 1562 1 3 . 1 1 23 23 ARG H H 23 8.720 8.720 8.019 0.701 26060 1563 1 3 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.170 -0.130 26060 1564 1 3 . 1 1 24 24 LYS C C 24 176.960 176.960 176.707 0.253 26060 1565 1 3 . 1 1 24 24 LYS CA C 24 58.800 58.800 58.114 0.686 26060 1566 1 3 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.308 -0.248 26060 1567 1 3 . 1 1 25 25 LYS N N 25 115.870 115.870 119.437 -3.567 26060 1568 1 3 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.743 0.087 26060 1569 1 3 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.514 -0.554 26060 1570 1 3 . 1 1 25 25 LYS CB C 25 35.080 35.080 34.427 0.653 26060 1571 1 3 . 1 1 25 25 LYS H H 25 7.720 7.720 7.533 0.187 26060 1572 1 3 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.588 0.242 26060 1573 1 3 . 1 1 26 26 PRO C C 26 177.400 177.400 176.899 0.501 26060 1574 1 3 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.763 -0.113 26060 1575 1 3 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.385 0.005 26060 1576 1 3 . 1 1 27 27 THR N N 27 111.270 111.270 114.038 -2.768 26060 1577 1 3 . 1 1 27 27 THR HA H 27 4.530 4.530 4.276 0.254 26060 1578 1 3 . 1 1 27 27 THR C C 27 177.300 177.300 176.820 0.480 26060 1579 1 3 . 1 1 27 27 THR CA C 27 61.300 61.300 60.736 0.564 26060 1580 1 3 . 1 1 27 27 THR CB C 27 71.460 71.460 70.087 1.373 26060 1581 1 3 . 1 1 27 27 THR H H 27 8.380 8.380 8.224 0.156 26060 1582 1 3 . 1 1 28 28 VAL N N 28 121.170 121.170 122.760 -1.590 26060 1583 1 3 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.804 0.079 26060 1584 1 3 . 1 1 28 28 VAL C C 28 177.030 177.030 176.029 1.001 26060 1585 1 3 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.117 0.083 26060 1586 1 3 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.660 -0.260 26060 1587 1 3 . 1 1 28 28 VAL H H 28 8.910 8.910 8.527 0.383 26060 1588 1 3 . 1 1 29 29 GLU N N 29 116.800 116.800 118.619 -1.819 26060 1589 1 3 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.150 -0.230 26060 1590 1 3 . 1 1 29 29 GLU C C 29 176.200 176.200 175.883 0.317 26060 1591 1 3 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.306 1.944 26060 1592 1 3 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.283 -1.113 26060 1593 1 3 . 1 1 29 29 GLU H H 29 7.990 7.990 7.917 0.073 26060 1594 1 3 . 1 1 30 30 GLY N N 30 105.500 105.500 107.240 -1.740 26060 1595 1 3 . 1 1 30 30 GLY C C 30 174.900 174.900 173.729 1.171 26060 1596 1 3 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.192 -0.732 26060 1597 1 3 . 1 1 30 30 GLY H H 30 7.950 7.950 7.725 0.225 26060 1598 1 3 . 1 1 31 31 PHE N N 31 119.300 119.300 118.845 0.455 26060 1599 1 3 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.981 -0.221 26060 1600 1 3 . 1 1 31 31 PHE C C 31 176.400 176.400 175.895 0.505 26060 1601 1 3 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.407 1.493 26060 1602 1 3 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.150 -3.650 26060 1603 1 3 . 1 1 31 31 PHE H H 31 7.520 7.520 7.389 0.131 26060 1604 1 3 . 1 1 32 32 THR N N 32 112.300 112.300 116.567 -4.267 26060 1605 1 3 . 1 1 32 32 THR HA H 32 4.330 4.330 4.459 -0.129 26060 1606 1 3 . 1 1 32 32 THR C C 32 175.200 175.200 174.377 0.823 26060 1607 1 3 . 1 1 32 32 THR CA C 32 62.780 62.780 62.924 -0.144 26060 1608 1 3 . 1 1 32 32 THR CB C 32 70.350 70.350 69.900 0.450 26060 1609 1 3 . 1 1 32 32 THR H H 32 7.770 7.770 9.145 -1.375 26060 1610 1 3 . 1 1 33 33 HIS N N 33 121.900 121.900 121.987 -0.087 26060 1611 1 3 . 1 1 33 33 HIS HA H 33 5.500 5.500 4.986 0.514 26060 1612 1 3 . 1 1 33 33 HIS C C 33 173.880 173.880 173.479 0.401 26060 1613 1 3 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.893 -0.113 26060 1614 1 3 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.164 3.476 26060 1615 1 3 . 1 1 33 33 HIS H H 33 9.110 9.110 8.860 0.250 26060 1616 1 3 . 1 1 34 34 ASP N N 34 120.300 120.300 125.007 -4.707 26060 1617 1 3 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.533 -0.133 26060 1618 1 3 . 1 1 34 34 ASP C C 34 175.100 175.100 175.194 -0.094 26060 1619 1 3 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.282 -0.972 26060 1620 1 3 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.470 -0.370 26060 1621 1 3 . 1 1 34 34 ASP H H 34 8.810 8.810 8.903 -0.093 26060 1622 1 3 . 1 1 35 35 TRP N N 35 119.800 119.800 120.474 -0.674 26060 1623 1 3 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.409 0.321 26060 1624 1 3 . 1 1 35 35 TRP C C 35 174.900 174.900 173.352 1.548 26060 1625 1 3 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.120 -0.220 26060 1626 1 3 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.091 1.979 26060 1627 1 3 . 1 1 35 35 TRP H H 35 9.250 9.250 9.005 0.245 26060 1628 1 3 . 1 1 36 36 MET N N 36 120.980 120.980 121.762 -0.782 26060 1629 1 3 . 1 1 36 36 MET HA H 36 5.750 5.750 5.819 -0.069 26060 1630 1 3 . 1 1 36 36 MET C C 36 173.700 173.700 174.310 -0.610 26060 1631 1 3 . 1 1 36 36 MET CA C 36 54.830 54.830 54.655 0.175 26060 1632 1 3 . 1 1 36 36 MET CB C 36 35.220 35.220 36.380 -1.160 26060 1633 1 3 . 1 1 36 36 MET H H 36 9.080 9.080 8.615 0.465 26060 1634 1 3 . 1 1 37 37 VAL N N 37 126.220 126.220 121.893 4.327 26060 1635 1 3 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.113 0.197 26060 1636 1 3 . 1 1 37 37 VAL C C 37 172.300 172.300 174.351 -2.051 26060 1637 1 3 . 1 1 37 37 VAL CA C 37 58.540 58.540 60.042 -1.502 26060 1638 1 3 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.380 1.690 26060 1639 1 3 . 1 1 37 37 VAL H H 37 9.080 9.080 8.811 0.269 26060 1640 1 3 . 1 1 38 38 PHE N N 38 120.640 120.640 122.471 -1.831 26060 1641 1 3 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.345 0.625 26060 1642 1 3 . 1 1 38 38 PHE C C 38 172.960 172.960 175.107 -2.147 26060 1643 1 3 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.731 -0.601 26060 1644 1 3 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.477 -0.477 26060 1645 1 3 . 1 1 38 38 PHE H H 38 8.320 8.320 9.025 -0.705 26060 1646 1 3 . 1 1 39 39 VAL N N 39 116.500 116.500 120.960 -4.460 26060 1647 1 3 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.591 -0.581 26060 1648 1 3 . 1 1 39 39 VAL C C 39 174.700 174.700 174.430 0.270 26060 1649 1 3 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.035 1.605 26060 1650 1 3 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.579 1.821 26060 1651 1 3 . 1 1 39 39 VAL H H 39 8.580 8.580 9.271 -0.691 26060 1652 1 3 . 1 1 40 40 ARG N N 40 124.100 124.100 124.400 -0.300 26060 1653 1 3 . 1 1 40 40 ARG HA H 40 5.080 5.080 5.021 0.059 26060 1654 1 3 . 1 1 40 40 ARG C C 40 173.800 173.800 174.470 -0.670 26060 1655 1 3 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.558 -0.628 26060 1656 1 3 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.731 0.849 26060 1657 1 3 . 1 1 40 40 ARG H H 40 9.880 9.880 8.691 1.189 26060 1658 1 3 . 1 1 41 41 GLY N N 41 107.640 107.640 106.420 1.220 26060 1659 1 3 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.546 1.424 26060 1660 1 3 . 1 1 41 41 GLY H H 41 8.910 8.910 8.633 0.277 26060 1661 1 3 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.514 -0.024 26060 1662 1 3 . 1 1 42 42 PRO C C 42 177.300 177.300 176.867 0.433 26060 1663 1 3 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.093 0.347 26060 1664 1 3 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.708 -0.598 26060 1665 1 3 . 1 1 43 43 GLU N N 43 121.050 121.050 121.691 -0.641 26060 1666 1 3 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.994 -0.204 26060 1667 1 3 . 1 1 43 43 GLU C C 43 176.110 176.110 176.180 -0.070 26060 1668 1 3 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.495 -0.645 26060 1669 1 3 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.579 -0.729 26060 1670 1 3 . 1 1 43 43 GLU H H 43 9.060 9.060 8.697 0.363 26060 1671 1 3 . 1 1 44 44 HIS N N 44 114.100 114.100 115.405 -1.305 26060 1672 1 3 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.309 0.042 26060 1673 1 3 . 1 1 44 44 HIS C C 44 175.170 175.170 175.035 0.135 26060 1674 1 3 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.332 0.318 26060 1675 1 3 . 1 1 44 44 HIS CB C 44 28.370 28.370 29.014 -0.644 26060 1676 1 3 . 1 1 44 44 HIS H H 44 8.420 8.420 8.638 -0.218 26060 1677 1 3 . 1 1 45 45 SER N N 45 115.540 115.540 117.470 -1.930 26060 1678 1 3 . 1 1 45 45 SER HA H 45 4.560 4.560 4.675 -0.115 26060 1679 1 3 . 1 1 45 45 SER C C 45 173.700 173.700 173.656 0.044 26060 1680 1 3 . 1 1 45 45 SER CA C 45 58.710 58.710 57.405 1.305 26060 1681 1 3 . 1 1 45 45 SER CB C 45 65.040 65.040 63.683 1.357 26060 1682 1 3 . 1 1 45 45 SER H H 45 7.870 7.870 8.089 -0.219 26060 1683 1 3 . 1 1 46 46 ASN N N 46 123.900 123.900 124.462 -0.562 26060 1684 1 3 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.995 0.125 26060 1685 1 3 . 1 1 46 46 ASN C C 46 176.300 176.300 175.753 0.547 26060 1686 1 3 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.935 -0.245 26060 1687 1 3 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.894 -2.164 26060 1688 1 3 . 1 1 46 46 ASN H H 46 9.480 9.480 8.670 0.810 26060 1689 1 3 . 1 1 47 47 ILE N N 47 115.240 115.240 119.282 -4.042 26060 1690 1 3 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.079 0.861 26060 1691 1 3 . 1 1 47 47 ILE C C 47 176.000 176.000 176.434 -0.434 26060 1692 1 3 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.207 -0.007 26060 1693 1 3 . 1 1 47 47 ILE CB C 47 36.700 36.700 37.923 -1.223 26060 1694 1 3 . 1 1 47 47 ILE H H 47 8.170 8.170 8.544 -0.374 26060 1695 1 3 . 1 1 48 48 GLN N N 48 123.200 123.200 119.721 3.479 26060 1696 1 3 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.057 0.223 26060 1697 1 3 . 1 1 48 48 GLN C C 48 175.670 175.670 177.086 -1.416 26060 1698 1 3 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.999 -0.099 26060 1699 1 3 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.614 -0.625 26060 1700 1 3 . 1 1 48 48 GLN H H 48 8.850 8.850 8.475 0.375 26060 1701 1 3 . 1 1 49 49 HIS N N 49 115.400 115.400 117.606 -2.206 26060 1702 1 3 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.425 0.145 26060 1703 1 3 . 1 1 49 49 HIS C C 49 176.380 176.380 176.863 -0.483 26060 1704 1 3 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.557 0.193 26060 1705 1 3 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.683 0.937 26060 1706 1 3 . 1 1 49 49 HIS H H 49 7.400 7.400 7.527 -0.127 26060 1707 1 3 . 1 1 50 50 PHE N N 50 109.800 109.800 112.828 -3.028 26060 1708 1 3 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.865 0.365 26060 1709 1 3 . 1 1 50 50 PHE C C 50 173.800 173.800 174.301 -0.501 26060 1710 1 3 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.941 -0.282 26060 1711 1 3 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.633 1.367 26060 1712 1 3 . 1 1 50 50 PHE H H 50 7.570 7.570 7.561 0.009 26060 1713 1 3 . 1 1 51 51 VAL N N 51 127.810 127.810 120.425 7.385 26060 1714 1 3 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.819 -0.449 26060 1715 1 3 . 1 1 51 51 VAL C C 51 174.500 174.500 174.617 -0.117 26060 1716 1 3 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.614 1.386 26060 1717 1 3 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.860 -1.580 26060 1718 1 3 . 1 1 51 51 VAL H H 51 7.810 7.810 8.042 -0.232 26060 1719 1 3 . 1 1 52 52 GLU N N 52 130.700 130.700 126.759 3.941 26060 1720 1 3 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.460 -0.480 26060 1721 1 3 . 1 1 52 52 GLU C C 52 175.400 175.400 175.279 0.121 26060 1722 1 3 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.186 0.914 26060 1723 1 3 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.217 -0.637 26060 1724 1 3 . 1 1 52 52 GLU H H 52 9.380 9.380 8.997 0.383 26060 1725 1 3 . 1 1 53 53 LYS N N 53 109.200 109.200 114.985 -5.785 26060 1726 1 3 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.913 -0.113 26060 1727 1 3 . 1 1 53 53 LYS C C 53 172.300 172.300 174.309 -2.009 26060 1728 1 3 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.490 0.350 26060 1729 1 3 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.100 -1.850 26060 1730 1 3 . 1 1 53 53 LYS H H 53 7.190 7.190 7.683 -0.493 26060 1731 1 3 . 1 1 54 54 VAL N N 54 120.380 120.380 117.788 2.592 26060 1732 1 3 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.610 0.160 26060 1733 1 3 . 1 1 54 54 VAL C C 54 173.600 173.600 173.970 -0.370 26060 1734 1 3 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.384 -0.344 26060 1735 1 3 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.608 -1.908 26060 1736 1 3 . 1 1 54 54 VAL H H 54 8.450 8.450 8.388 0.062 26060 1737 1 3 . 1 1 55 55 VAL N N 55 126.920 126.920 122.903 4.017 26060 1738 1 3 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.125 -0.425 26060 1739 1 3 . 1 1 55 55 VAL C C 55 173.800 173.800 173.810 -0.010 26060 1740 1 3 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.812 0.058 26060 1741 1 3 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.965 -2.865 26060 1742 1 3 . 1 1 55 55 VAL H H 55 9.260 9.260 9.095 0.165 26060 1743 1 3 . 1 1 56 56 PHE N N 56 126.130 126.130 123.951 2.179 26060 1744 1 3 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.009 -0.319 26060 1745 1 3 . 1 1 56 56 PHE C C 56 174.000 174.000 174.153 -0.153 26060 1746 1 3 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.725 -0.145 26060 1747 1 3 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.596 -1.706 26060 1748 1 3 . 1 1 56 56 PHE H H 56 9.290 9.290 9.273 0.017 26060 1749 1 3 . 1 1 57 57 HIS N N 57 124.180 124.180 124.298 -0.118 26060 1750 1 3 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.972 -0.172 26060 1751 1 3 . 1 1 57 57 HIS C C 57 174.700 174.700 175.013 -0.313 26060 1752 1 3 . 1 1 57 57 HIS CA C 57 55.320 55.320 54.898 0.422 26060 1753 1 3 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.746 1.354 26060 1754 1 3 . 1 1 57 57 HIS H H 57 8.690 8.690 8.581 0.109 26060 1755 1 3 . 1 1 58 58 LEU N N 58 122.050 122.050 123.282 -1.232 26060 1756 1 3 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.356 -0.116 26060 1757 1 3 . 1 1 58 58 LEU C C 58 174.400 174.400 176.952 -2.552 26060 1758 1 3 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.827 0.583 26060 1759 1 3 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.336 -1.176 26060 1760 1 3 . 1 1 58 58 LEU H H 58 9.050 9.050 7.829 1.221 26060 1761 1 3 . 1 1 59 59 HIS N N 59 118.510 118.510 117.617 0.893 26060 1762 1 3 . 1 1 59 59 HIS C C 59 175.300 175.300 176.458 -1.158 26060 1763 1 3 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.254 2.856 26060 1764 1 3 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.858 0.072 26060 1765 1 3 . 1 1 59 59 HIS H H 59 5.160 5.160 7.734 -2.574 26060 1766 1 3 . 1 1 60 60 GLU N N 60 122.190 122.190 125.337 -3.147 26060 1767 1 3 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.975 -0.015 26060 1768 1 3 . 1 1 60 60 GLU C C 60 175.130 175.130 176.972 -1.842 26060 1769 1 3 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.466 -0.456 26060 1770 1 3 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.572 0.248 26060 1771 1 3 . 1 1 60 60 GLU H H 60 7.960 7.960 8.366 -0.406 26060 1772 1 3 . 1 1 61 61 SER N N 61 116.940 116.940 113.509 3.431 26060 1773 1 3 . 1 1 61 61 SER HA H 61 4.200 4.200 4.364 -0.164 26060 1774 1 3 . 1 1 61 61 SER CA C 61 60.010 60.010 59.617 0.393 26060 1775 1 3 . 1 1 61 61 SER CB C 61 63.140 63.140 63.593 -0.453 26060 1776 1 3 . 1 1 61 61 SER H H 61 8.540 8.540 8.181 0.359 26060 1777 1 3 . 1 1 62 62 PHE N N 62 123.700 123.700 121.934 1.766 26060 1778 1 3 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.642 -0.092 26060 1779 1 3 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.371 2.569 26060 1780 1 3 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.092 -0.692 26060 1781 1 3 . 1 1 62 62 PHE H H 62 8.640 8.640 8.147 0.493 26060 1782 1 3 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.480 -0.070 26060 1783 1 3 . 1 1 63 63 PRO C C 63 176.400 176.400 176.497 -0.097 26060 1784 1 3 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.115 -0.515 26060 1785 1 3 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.082 -0.222 26060 1786 1 3 . 1 1 64 64 ARG N N 64 116.840 116.840 120.805 -3.965 26060 1787 1 3 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.081 0.019 26060 1788 1 3 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.136 -0.526 26060 1789 1 3 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.751 0.079 26060 1790 1 3 . 1 1 64 64 ARG H H 64 8.890 8.890 8.749 0.141 26060 1791 1 3 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.391 -0.401 26060 1792 1 3 . 1 1 65 65 PRO C C 65 175.800 175.800 177.216 -1.416 26060 1793 1 3 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.883 1.927 26060 1794 1 3 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.968 -0.088 26060 1795 1 3 . 1 1 66 66 LYS N N 66 119.035 119.035 120.321 -1.286 26060 1796 1 3 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.047 -0.437 26060 1797 1 3 . 1 1 66 66 LYS C C 66 175.400 175.400 175.904 -0.504 26060 1798 1 3 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.550 -0.097 26060 1799 1 3 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.047 -0.317 26060 1800 1 3 . 1 1 66 66 LYS H H 66 7.630 7.630 7.849 -0.219 26060 1801 1 3 . 1 1 67 67 ARG N N 67 127.394 127.394 127.358 0.036 26060 1802 1 3 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.644 0.096 26060 1803 1 3 . 1 1 67 67 ARG C C 67 174.500 174.500 174.690 -0.190 26060 1804 1 3 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.481 0.319 26060 1805 1 3 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.755 -2.041 26060 1806 1 3 . 1 1 67 67 ARG H H 67 8.855 8.855 8.751 0.104 26060 1807 1 3 . 1 1 68 68 VAL N N 68 124.388 124.388 119.271 5.117 26060 1808 1 3 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.092 -0.512 26060 1809 1 3 . 1 1 68 68 VAL C C 68 176.850 176.850 175.292 1.558 26060 1810 1 3 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.775 2.298 26060 1811 1 3 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.968 -0.364 26060 1812 1 3 . 1 1 68 68 VAL H H 68 8.681 8.681 8.378 0.303 26060 1813 1 3 . 1 1 69 69 CYS N N 69 127.080 127.080 125.607 1.473 26060 1814 1 3 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.771 0.299 26060 1815 1 3 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.693 0.653 26060 1816 1 3 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.045 0.725 26060 1817 1 3 . 1 1 69 69 CYS H H 69 9.455 9.455 9.020 0.435 26060 1818 1 3 . 1 1 70 70 LYS N N 70 125.480 125.480 122.813 2.667 26060 1819 1 3 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.502 -0.012 26060 1820 1 3 . 1 1 70 70 LYS C C 70 174.300 174.300 175.705 -1.405 26060 1821 1 3 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.715 1.045 26060 1822 1 3 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.407 -0.237 26060 1823 1 3 . 1 1 70 70 LYS H H 70 9.050 9.050 8.704 0.346 26060 1824 1 3 . 1 1 71 71 ASP N N 71 116.940 116.940 119.289 -2.349 26060 1825 1 3 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.787 0.313 26060 1826 1 3 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.728 -0.648 26060 1827 1 3 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.057 2.323 26060 1828 1 3 . 1 1 71 71 ASP H H 71 7.620 7.620 7.518 0.102 26060 1829 1 3 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.112 -0.852 26060 1830 1 3 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.943 -2.293 26060 1831 1 3 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.221 -1.181 26060 1832 1 3 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.137 -0.037 26060 1833 1 3 . 1 1 73 73 PRO C C 73 174.700 174.700 175.860 -1.160 26060 1834 1 3 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.331 -2.641 26060 1835 1 3 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.298 2.742 26060 1836 1 3 . 1 1 74 74 TYR N N 74 125.400 125.400 124.728 0.672 26060 1837 1 3 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.468 0.382 26060 1838 1 3 . 1 1 74 74 TYR C C 74 172.900 172.900 175.337 -2.437 26060 1839 1 3 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.950 -2.280 26060 1840 1 3 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.098 -3.698 26060 1841 1 3 . 1 1 74 74 TYR H H 74 8.960 8.960 8.331 0.629 26060 1842 1 3 . 1 1 75 75 LYS N N 75 121.400 121.400 119.975 1.425 26060 1843 1 3 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.057 0.533 26060 1844 1 3 . 1 1 75 75 LYS C C 75 173.800 173.800 174.497 -0.697 26060 1845 1 3 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.676 -0.026 26060 1846 1 3 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.648 -0.758 26060 1847 1 3 . 1 1 75 75 LYS H H 75 7.670 7.670 7.909 -0.239 26060 1848 1 3 . 1 1 76 76 VAL N N 76 119.800 119.800 121.647 -1.847 26060 1849 1 3 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.134 -0.244 26060 1850 1 3 . 1 1 76 76 VAL C C 76 173.900 173.900 174.555 -0.655 26060 1851 1 3 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.337 1.393 26060 1852 1 3 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.714 0.826 26060 1853 1 3 . 1 1 76 76 VAL H H 76 8.180 8.180 7.788 0.392 26060 1854 1 3 . 1 1 77 77 GLU N N 77 126.190 126.190 128.163 -1.973 26060 1855 1 3 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.866 0.084 26060 1856 1 3 . 1 1 77 77 GLU C C 77 174.700 174.700 175.233 -0.533 26060 1857 1 3 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.378 -0.438 26060 1858 1 3 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.023 0.527 26060 1859 1 3 . 1 1 77 77 GLU H H 77 8.270 8.270 8.667 -0.397 26060 1860 1 3 . 1 1 78 78 GLU N N 78 126.180 126.180 123.212 2.968 26060 1861 1 3 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.554 -0.104 26060 1862 1 3 . 1 1 78 78 GLU C C 78 175.400 175.400 174.054 1.346 26060 1863 1 3 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.966 0.076 26060 1864 1 3 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.135 2.965 26060 1865 1 3 . 1 1 78 78 GLU H H 78 7.870 7.870 8.386 -0.516 26060 1866 1 3 . 1 1 79 79 SER N N 79 112.109 112.109 114.812 -2.703 26060 1867 1 3 . 1 1 79 79 SER HA H 79 5.560 5.560 5.450 0.110 26060 1868 1 3 . 1 1 79 79 SER C C 79 172.490 172.490 173.658 -1.168 26060 1869 1 3 . 1 1 79 79 SER CA C 79 57.754 57.754 56.960 0.794 26060 1870 1 3 . 1 1 79 79 SER CB C 79 65.861 65.861 65.930 -0.069 26060 1871 1 3 . 1 1 79 79 SER H H 79 7.714 7.714 8.363 -0.649 26060 1872 1 3 . 1 1 80 80 GLY N N 80 106.048 106.048 109.016 -2.968 26060 1873 1 3 . 1 1 80 80 GLY C C 80 172.630 172.630 171.917 0.713 26060 1874 1 3 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.203 1.367 26060 1875 1 3 . 1 1 80 80 GLY H H 80 8.828 8.828 9.146 -0.318 26060 1876 1 3 . 1 1 81 81 TYR N N 81 115.280 115.280 114.386 0.894 26060 1877 1 3 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.323 0.357 26060 1878 1 3 . 1 1 81 81 TYR C C 81 174.100 174.100 174.101 -0.001 26060 1879 1 3 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.803 -1.302 26060 1880 1 3 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.193 2.147 26060 1881 1 3 . 1 1 81 81 TYR H H 81 8.770 8.770 8.023 0.747 26060 1882 1 3 . 1 1 82 82 ALA N N 82 122.350 122.350 122.654 -0.304 26060 1883 1 3 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.572 -0.172 26060 1884 1 3 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.745 0.295 26060 1885 1 3 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.110 1.290 26060 1886 1 3 . 1 1 82 82 ALA H H 82 7.160 7.160 7.395 -0.235 26060 1887 1 3 . 1 1 83 83 GLY N N 83 107.100 107.100 106.523 0.577 26060 1888 1 3 . 1 1 83 83 GLY C C 83 172.500 172.500 173.581 -1.081 26060 1889 1 3 . 1 1 83 83 GLY CA C 83 44.610 44.610 43.994 0.616 26060 1890 1 3 . 1 1 83 83 GLY H H 83 8.220 8.220 8.244 -0.024 26060 1891 1 3 . 1 1 84 84 PHE N N 84 111.660 111.660 115.537 -3.877 26060 1892 1 3 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.590 0.100 26060 1893 1 3 . 1 1 84 84 PHE C C 84 172.460 172.460 173.504 -1.044 26060 1894 1 3 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.719 -0.219 26060 1895 1 3 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.654 -1.075 26060 1896 1 3 . 1 1 84 84 PHE H H 84 7.700 7.700 8.361 -0.661 26060 1897 1 3 . 1 1 85 85 ILE N N 85 117.810 117.810 121.611 -3.801 26060 1898 1 3 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.086 0.224 26060 1899 1 3 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.243 -1.903 26060 1900 1 3 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.244 -1.984 26060 1901 1 3 . 1 1 85 85 ILE H H 85 8.340 8.340 8.654 -0.314 26060 1902 1 3 . 1 1 86 86 LEU N N 86 108.130 108.130 129.461 -21.331 26060 1903 1 3 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.067 -0.087 26060 1904 1 3 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.212 1.988 26060 1905 1 3 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.575 -0.275 26060 1906 1 3 . 1 1 86 86 LEU H H 86 9.900 9.900 8.841 1.059 26060 1907 1 3 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.649 0.451 26060 1908 1 3 . 1 1 87 87 PRO C C 87 175.340 175.340 176.003 -0.663 26060 1909 1 3 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.746 0.364 26060 1910 1 3 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.524 1.036 26060 1911 1 3 . 1 1 88 88 ILE N N 88 126.000 126.000 126.118 -0.118 26060 1912 1 3 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.208 0.582 26060 1913 1 3 . 1 1 88 88 ILE C C 88 176.100 176.100 175.150 0.950 26060 1914 1 3 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.560 0.000 26060 1915 1 3 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.114 1.886 26060 1916 1 3 . 1 1 88 88 ILE H H 88 9.380 9.380 8.991 0.389 26060 1917 1 3 . 1 1 89 89 GLU N N 89 123.900 123.900 124.108 -0.208 26060 1918 1 3 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.342 -0.142 26060 1919 1 3 . 1 1 89 89 GLU C C 89 173.800 173.800 175.532 -1.732 26060 1920 1 3 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.419 -0.449 26060 1921 1 3 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.710 0.670 26060 1922 1 3 . 1 1 89 89 GLU H H 89 9.320 9.320 8.938 0.382 26060 1923 1 3 . 1 1 90 90 VAL N N 90 123.980 123.980 123.031 0.949 26060 1924 1 3 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.181 -0.021 26060 1925 1 3 . 1 1 90 90 VAL C C 90 174.800 174.800 174.453 0.347 26060 1926 1 3 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.114 0.876 26060 1927 1 3 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.406 -0.916 26060 1928 1 3 . 1 1 90 90 VAL H H 90 8.630 8.630 8.697 -0.067 26060 1929 1 3 . 1 1 91 91 TYR N N 91 124.230 124.230 126.132 -1.902 26060 1930 1 3 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.608 0.052 26060 1931 1 3 . 1 1 91 91 TYR C C 91 176.800 176.800 175.587 1.213 26060 1932 1 3 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.067 -0.367 26060 1933 1 3 . 1 1 91 91 TYR CB C 91 40.240 40.240 39.093 1.147 26060 1934 1 3 . 1 1 91 91 TYR H H 91 8.640 8.640 9.151 -0.511 26060 1935 1 3 . 1 1 92 92 PHE N N 92 121.200 121.200 122.255 -1.055 26060 1936 1 3 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.217 0.443 26060 1937 1 3 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.120 1.390 26060 1938 1 3 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.849 0.851 26060 1939 1 3 . 1 1 92 92 PHE H H 92 8.750 8.750 9.165 -0.415 26060 1940 1 3 . 1 1 93 93 LYS N N 93 123.450 123.450 121.938 1.512 26060 1941 1 3 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.589 0.011 26060 1942 1 3 . 1 1 93 93 LYS C C 93 174.200 174.200 175.091 -0.891 26060 1943 1 3 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.016 -0.835 26060 1944 1 3 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.391 -0.710 26060 1945 1 3 . 1 1 93 93 LYS H H 93 8.560 8.560 8.937 -0.377 26060 1946 1 3 . 1 1 94 94 ASN N N 94 118.800 118.800 121.664 -2.864 26060 1947 1 3 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.738 -0.298 26060 1948 1 3 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.643 -1.433 26060 1949 1 3 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.130 -1.330 26060 1950 1 3 . 1 1 94 94 ASN H H 94 7.820 7.820 8.253 -0.433 26060 1951 1 3 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.475 -0.145 26060 1952 1 3 . 1 1 95 95 LYS C C 95 175.800 175.800 175.672 0.128 26060 1953 1 3 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.627 -0.416 26060 1954 1 3 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.311 -0.301 26060 1955 1 3 . 1 1 96 96 GLU N N 96 118.330 118.330 119.585 -1.255 26060 1956 1 3 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.328 0.182 26060 1957 1 3 . 1 1 96 96 GLU C C 96 173.200 173.200 175.830 -2.630 26060 1958 1 3 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.281 -1.181 26060 1959 1 3 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.379 2.091 26060 1960 1 3 . 1 1 96 96 GLU H H 96 7.120 7.120 7.841 -0.721 26060 1961 1 3 . 1 1 97 97 GLU N N 97 115.630 115.630 120.251 -4.621 26060 1962 1 3 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.181 0.249 26060 1963 1 3 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.285 -1.425 26060 1964 1 3 . 1 1 97 97 GLU CB C 97 29.270 29.270 29.020 0.250 26060 1965 1 3 . 1 1 97 97 GLU H H 97 8.060 8.060 8.373 -0.313 26060 1966 1 3 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.258 0.742 26060 1967 1 3 . 1 1 98 98 PRO C C 98 175.900 175.900 176.114 -0.214 26060 1968 1 3 . 1 1 98 98 PRO CA C 98 62.160 62.160 63.975 -1.815 26060 1969 1 3 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.987 2.013 26060 1970 1 3 . 1 1 99 99 ARG N N 99 122.800 122.800 120.440 2.360 26060 1971 1 3 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.443 0.187 26060 1972 1 3 . 1 1 99 99 ARG C C 99 175.800 175.800 175.433 0.367 26060 1973 1 3 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.319 0.171 26060 1974 1 3 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.678 -0.268 26060 1975 1 3 . 1 1 99 99 ARG H H 99 8.602 8.602 8.677 -0.075 26060 1976 1 3 . 1 1 100 100 LYS N N 100 113.220 113.220 117.641 -4.421 26060 1977 1 3 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.721 0.219 26060 1978 1 3 . 1 1 100 100 LYS C C 100 174.100 174.100 174.499 -0.399 26060 1979 1 3 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.091 -0.181 26060 1980 1 3 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.861 -1.141 26060 1981 1 3 . 1 1 100 100 LYS H H 100 7.650 7.650 7.355 0.295 26060 1982 1 3 . 1 1 101 101 VAL N N 101 116.230 116.230 121.715 -5.485 26060 1983 1 3 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.153 0.117 26060 1984 1 3 . 1 1 101 101 VAL C C 101 171.600 171.600 173.497 -1.897 26060 1985 1 3 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.360 0.900 26060 1986 1 3 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.129 0.051 26060 1987 1 3 . 1 1 101 101 VAL H H 101 8.120 8.120 8.428 -0.308 26060 1988 1 3 . 1 1 102 102 ARG N N 102 124.980 124.980 128.522 -3.542 26060 1989 1 3 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.887 0.273 26060 1990 1 3 . 1 1 102 102 ARG C C 102 174.340 174.340 175.096 -0.756 26060 1991 1 3 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.754 -1.004 26060 1992 1 3 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.204 2.146 26060 1993 1 3 . 1 1 102 102 ARG H H 102 7.930 7.930 8.295 -0.365 26060 1994 1 3 . 1 1 103 103 PHE N N 103 124.590 124.590 127.377 -2.787 26060 1995 1 3 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.761 0.031 26060 1996 1 3 . 1 1 103 103 PHE C C 103 174.280 174.280 174.951 -0.671 26060 1997 1 3 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.716 1.264 26060 1998 1 3 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.285 1.965 26060 1999 1 3 . 1 1 103 103 PHE H H 103 9.390 9.390 9.110 0.280 26060 2000 1 3 . 1 1 104 104 ASP N N 104 124.700 124.700 126.823 -2.123 26060 2001 1 3 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.817 -0.018 26060 2002 1 3 . 1 1 104 104 ASP C C 104 174.500 174.500 174.970 -0.470 26060 2003 1 3 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.504 -0.114 26060 2004 1 3 . 1 1 104 104 ASP CB C 104 40.230 40.230 40.028 0.202 26060 2005 1 3 . 1 1 104 104 ASP H H 104 9.010 9.010 8.954 0.056 26060 2006 1 3 . 1 1 105 105 TYR N N 105 129.840 129.840 124.995 4.845 26060 2007 1 3 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.511 -0.411 26060 2008 1 3 . 1 1 105 105 TYR C C 105 173.100 173.100 173.819 -0.719 26060 2009 1 3 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.682 0.998 26060 2010 1 3 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.882 0.968 26060 2011 1 3 . 1 1 105 105 TYR H H 105 8.140 8.140 8.309 -0.169 26060 2012 1 3 . 1 1 106 106 ASP N N 106 126.800 126.800 127.472 -0.672 26060 2013 1 3 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.368 -0.148 26060 2014 1 3 . 1 1 106 106 ASP C C 106 172.900 172.900 174.275 -1.375 26060 2015 1 3 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.843 -0.333 26060 2016 1 3 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.702 -2.202 26060 2017 1 3 . 1 1 106 106 ASP H H 106 7.730 7.730 8.271 -0.541 26060 2018 1 3 . 1 1 107 107 LEU N N 107 132.150 132.150 127.715 4.435 26060 2019 1 3 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.428 -0.588 26060 2020 1 3 . 1 1 107 107 LEU C C 107 172.100 172.100 174.672 -2.572 26060 2021 1 3 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.779 -0.079 26060 2022 1 3 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.121 -1.881 26060 2023 1 3 . 1 1 107 107 LEU H H 107 7.770 7.770 7.820 -0.050 26060 2024 1 3 . 1 1 108 108 PHE N N 108 118.960 118.960 121.589 -2.629 26060 2025 1 3 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.920 -0.230 26060 2026 1 3 . 1 1 108 108 PHE C C 108 174.300 174.300 173.669 0.631 26060 2027 1 3 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.285 -0.595 26060 2028 1 3 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.973 -0.683 26060 2029 1 3 . 1 1 108 108 PHE H H 108 6.060 6.060 7.121 -1.061 26060 2030 1 3 . 1 1 109 109 LEU N N 109 118.900 118.900 123.111 -4.211 26060 2031 1 3 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.741 -0.341 26060 2032 1 3 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.115 -0.955 26060 2033 1 3 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.704 -1.624 26060 2034 1 3 . 1 1 109 109 LEU H H 109 8.388 8.388 8.359 0.029 26060 2035 1 3 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.285 0.155 26060 2036 1 3 . 1 1 111 111 LEU C C 111 177.300 177.300 176.812 0.488 26060 2037 1 3 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.069 -0.849 26060 2038 1 3 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.578 1.292 26060 2039 1 3 . 1 1 112 112 GLU N N 112 120.660 120.660 123.645 -2.985 26060 2040 1 3 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.067 0.103 26060 2041 1 3 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.547 -0.087 26060 2042 1 3 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.977 -0.287 26060 2043 1 3 . 1 1 112 112 GLU H H 112 8.780 8.780 8.818 -0.038 26060 2044 1 3 . 1 1 113 113 GLY C C 113 173.900 173.900 173.587 0.313 26060 2045 1 3 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.027 -0.077 26060 2046 1 3 . 1 1 114 114 HIS N N 114 120.890 120.890 121.297 -0.407 26060 2047 1 3 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.194 -0.288 26060 2048 1 3 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.454 0.316 26060 2049 1 3 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.979 -1.389 26060 2050 1 3 . 1 1 114 114 HIS H H 114 7.934 7.934 7.930 0.004 26060 2051 1 3 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.414 -0.614 26060 2052 1 3 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.735 1.355 26060 2053 1 3 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.912 -1.232 26060 2054 1 3 . 1 1 116 116 PRO C C 116 176.600 176.600 175.597 1.003 26060 2055 1 3 . 1 1 116 116 PRO CB C 116 32.300 32.300 31.995 0.305 26060 2056 1 3 . 1 1 117 117 VAL N N 117 127.480 127.480 125.937 1.543 26060 2057 1 3 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.282 -0.492 26060 2058 1 3 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.629 1.071 26060 2059 1 3 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.425 -0.224 26060 2060 1 3 . 1 1 117 117 VAL H H 117 8.890 8.890 7.906 0.984 26060 2061 1 3 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.994 -0.004 26060 2062 1 3 . 1 1 118 118 ASN C C 118 172.700 172.700 173.555 -0.855 26060 2063 1 3 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.448 -0.088 26060 2064 1 3 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.975 -0.775 26060 2065 1 3 . 1 1 119 119 HIS N N 119 124.930 124.930 126.063 -1.133 26060 2066 1 3 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.054 -0.234 26060 2067 1 3 . 1 1 119 119 HIS C C 119 173.500 173.500 172.799 0.701 26060 2068 1 3 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.931 2.038 26060 2069 1 3 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.094 0.576 26060 2070 1 3 . 1 1 119 119 HIS H H 119 8.790 8.790 9.057 -0.267 26060 2071 1 3 . 1 1 120 120 LEU N N 120 128.280 128.280 124.812 3.468 26060 2072 1 3 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.174 -0.224 26060 2073 1 3 . 1 1 120 120 LEU C C 120 174.030 174.030 175.147 -1.117 26060 2074 1 3 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.443 0.997 26060 2075 1 3 . 1 1 120 120 LEU CB C 120 46.600 46.600 45.741 0.859 26060 2076 1 3 . 1 1 120 120 LEU H H 120 7.460 7.460 8.450 -0.990 26060 2077 1 3 . 1 1 121 121 ARG N N 121 128.060 128.060 122.253 5.807 26060 2078 1 3 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.708 -0.068 26060 2079 1 3 . 1 1 121 121 ARG C C 121 173.400 173.400 174.296 -0.896 26060 2080 1 3 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.131 0.229 26060 2081 1 3 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.359 1.901 26060 2082 1 3 . 1 1 121 121 ARG H H 121 9.860 9.860 9.112 0.748 26060 2083 1 3 . 1 1 122 122 CYS N N 122 125.290 125.290 123.658 1.632 26060 2084 1 3 . 1 1 122 122 CYS HA H 122 5.020 5.020 4.912 0.108 26060 2085 1 3 . 1 1 122 122 CYS C C 122 174.600 174.600 175.107 -0.507 26060 2086 1 3 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.070 1.220 26060 2087 1 3 . 1 1 122 122 CYS CB C 122 28.030 28.030 27.837 0.193 26060 2088 1 3 . 1 1 122 122 CYS H H 122 8.835 8.835 8.870 -0.035 26060 2089 1 3 . 1 1 123 123 GLU N N 123 125.920 125.920 124.856 1.064 26060 2090 1 3 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.536 0.144 26060 2091 1 3 . 1 1 123 123 GLU C C 123 174.500 174.500 174.663 -0.163 26060 2092 1 3 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.998 -0.578 26060 2093 1 3 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.703 0.880 26060 2094 1 3 . 1 1 123 123 GLU H H 123 8.970 8.970 9.109 -0.139 26060 2095 1 3 . 1 1 124 124 LYS N N 124 121.837 121.837 122.312 -0.475 26060 2096 1 3 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.877 0.083 26060 2097 1 3 . 1 1 124 124 LYS C C 124 175.700 175.700 175.650 0.050 26060 2098 1 3 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.083 0.274 26060 2099 1 3 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.638 -0.449 26060 2100 1 3 . 1 1 124 124 LYS H H 124 8.652 8.652 8.370 0.282 26060 2101 1 3 . 1 1 125 125 LEU N N 125 127.000 127.000 129.797 -2.797 26060 2102 1 3 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.591 0.059 26060 2103 1 3 . 1 1 125 125 LEU C C 125 175.110 175.110 175.515 -0.405 26060 2104 1 3 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.766 0.088 26060 2105 1 3 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.028 1.239 26060 2106 1 3 . 1 1 125 125 LEU H H 125 9.175 9.175 9.125 0.050 26060 2107 1 3 . 1 1 126 126 THR N N 126 117.779 117.779 120.099 -2.320 26060 2108 1 3 . 1 1 126 126 THR HA H 126 4.650 4.650 4.645 0.005 26060 2109 1 3 . 1 1 126 126 THR C C 126 173.200 173.200 173.730 -0.530 26060 2110 1 3 . 1 1 126 126 THR CA C 126 62.036 62.036 61.714 0.322 26060 2111 1 3 . 1 1 126 126 THR CB C 126 70.284 70.284 69.103 1.181 26060 2112 1 3 . 1 1 126 126 THR H H 126 8.331 8.331 8.391 -0.060 26060 2113 1 3 . 1 1 127 127 PHE N N 127 126.576 126.576 126.583 -0.007 26060 2114 1 3 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.633 -0.043 26060 2115 1 3 . 1 1 127 127 PHE C C 127 174.860 174.860 174.589 0.271 26060 2116 1 3 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.715 0.149 26060 2117 1 3 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.071 -1.071 26060 2118 1 3 . 1 1 127 127 PHE H H 127 9.051 9.051 9.054 -0.003 26060 2119 1 3 . 1 1 128 128 ASN N N 128 123.040 123.040 123.967 -0.927 26060 2120 1 3 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.722 -0.102 26060 2121 1 3 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.695 0.785 26060 2122 1 3 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.990 0.470 26060 2123 1 3 . 1 1 128 128 ASN H H 128 8.880 8.880 8.857 0.023 26060 2124 1 3 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.534 0.226 26060 2125 1 3 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.574 -0.674 26060 2126 1 3 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.421 1.309 26060 2127 1 3 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.731 0.059 26060 2128 1 3 . 1 1 130 130 PRO C C 130 177.470 177.470 176.520 0.950 26060 2129 1 3 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.424 0.150 26060 2130 1 3 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.805 -0.495 26060 2131 1 3 . 1 1 131 131 THR N N 131 113.400 113.400 113.628 -0.228 26060 2132 1 3 . 1 1 131 131 THR HA H 131 4.300 4.300 4.186 0.114 26060 2133 1 3 . 1 1 131 131 THR C C 131 175.200 175.200 176.126 -0.926 26060 2134 1 3 . 1 1 131 131 THR CA C 131 62.200 62.200 61.337 0.863 26060 2135 1 3 . 1 1 131 131 THR CB C 131 70.600 70.600 70.453 0.147 26060 2136 1 3 . 1 1 131 131 THR H H 131 8.950 8.950 8.095 0.855 26060 2137 1 3 . 1 1 132 132 GLU N N 132 122.199 122.199 124.904 -2.705 26060 2138 1 3 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.008 0.002 26060 2139 1 3 . 1 1 132 132 GLU C C 132 178.700 178.700 178.314 0.386 26060 2140 1 3 . 1 1 132 132 GLU CA C 132 60.294 60.294 59.801 0.493 26060 2141 1 3 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.673 -0.512 26060 2142 1 3 . 1 1 132 132 GLU H H 132 8.932 8.932 8.995 -0.063 26060 2143 1 3 . 1 1 133 133 ASP N N 133 116.324 116.324 119.613 -3.289 26060 2144 1 3 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.355 -0.025 26060 2145 1 3 . 1 1 133 133 ASP C C 133 177.800 177.800 178.670 -0.870 26060 2146 1 3 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.694 -0.148 26060 2147 1 3 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.571 1.252 26060 2148 1 3 . 1 1 133 133 ASP H H 133 8.490 8.490 7.887 0.603 26060 2149 1 3 . 1 1 134 134 PHE N N 134 119.914 119.914 121.122 -1.208 26060 2150 1 3 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.267 0.343 26060 2151 1 3 . 1 1 134 134 PHE C C 134 177.300 177.300 177.240 0.060 26060 2152 1 3 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.493 0.045 26060 2153 1 3 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.873 0.327 26060 2154 1 3 . 1 1 134 134 PHE H H 134 7.787 7.787 7.445 0.342 26060 2155 1 3 . 1 1 135 135 ARG N N 135 119.794 119.794 119.809 -0.015 26060 2156 1 3 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.611 -0.261 26060 2157 1 3 . 1 1 135 135 ARG C C 135 177.370 177.370 178.234 -0.864 26060 2158 1 3 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.919 0.457 26060 2159 1 3 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.023 0.373 26060 2160 1 3 . 1 1 135 135 ARG H H 135 9.087 9.087 8.266 0.821 26060 2161 1 3 . 1 1 136 136 ARG N N 136 114.554 114.554 118.828 -4.274 26060 2162 1 3 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.896 -0.076 26060 2163 1 3 . 1 1 136 136 ARG C C 136 178.950 178.950 178.771 0.179 26060 2164 1 3 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.747 0.053 26060 2165 1 3 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.096 0.121 26060 2166 1 3 . 1 1 136 136 ARG H H 136 7.747 7.747 8.481 -0.734 26060 2167 1 3 . 1 1 137 137 LYS N N 137 118.298 118.298 118.854 -0.556 26060 2168 1 3 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.977 -0.077 26060 2169 1 3 . 1 1 137 137 LYS C C 137 177.980 177.980 179.017 -1.037 26060 2170 1 3 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.571 0.824 26060 2171 1 3 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.437 0.010 26060 2172 1 3 . 1 1 137 137 LYS H H 137 7.154 7.154 7.463 -0.309 26060 2173 1 3 . 1 1 138 138 LEU N N 138 117.159 117.159 118.857 -1.698 26060 2174 1 3 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.733 -0.313 26060 2175 1 3 . 1 1 138 138 LEU C C 138 179.100 179.100 178.515 0.585 26060 2176 1 3 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.178 0.053 26060 2177 1 3 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.458 0.870 26060 2178 1 3 . 1 1 138 138 LEU H H 138 7.709 7.709 7.740 -0.031 26060 2179 1 3 . 1 1 139 139 LEU N N 139 115.158 115.158 116.644 -1.486 26060 2180 1 3 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.109 0.041 26060 2181 1 3 . 1 1 139 139 LEU C C 139 177.600 177.600 178.659 -1.059 26060 2182 1 3 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.498 -0.970 26060 2183 1 3 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.893 -0.149 26060 2184 1 3 . 1 1 139 139 LEU H H 139 7.507 7.507 8.132 -0.625 26060 2185 1 3 . 1 1 140 140 LYS N N 140 120.256 120.256 118.463 1.793 26060 2186 1 3 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.045 0.065 26060 2187 1 3 . 1 1 140 140 LYS C C 140 175.800 175.800 177.174 -1.374 26060 2188 1 3 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.349 -0.297 26060 2189 1 3 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.462 0.184 26060 2190 1 3 . 1 1 140 140 LYS H H 140 7.304 7.304 7.557 -0.253 26060 2191 1 4 . 1 1 4 4 MET C C 4 175.800 175.800 176.475 -0.675 26060 2192 1 4 . 1 1 4 4 MET CA C 4 55.350 55.350 54.563 0.786 26060 2193 1 4 . 1 1 4 4 MET CB C 4 32.880 32.880 32.327 0.553 26060 2194 1 4 . 1 1 5 5 ALA N N 5 125.230 125.230 122.192 3.038 26060 2195 1 4 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.226 0.124 26060 2196 1 4 . 1 1 5 5 ALA CA C 5 52.430 52.430 53.202 -0.772 26060 2197 1 4 . 1 1 5 5 ALA CB C 5 19.370 19.370 18.716 0.654 26060 2198 1 4 . 1 1 5 5 ALA H H 5 8.320 8.320 8.020 0.300 26060 2199 1 4 . 1 1 6 6 SER HA H 6 4.490 4.490 4.533 -0.043 26060 2200 1 4 . 1 1 6 6 SER CA C 6 58.200 58.200 57.037 1.163 26060 2201 1 4 . 1 1 6 6 SER CB C 6 63.700 63.700 62.951 0.749 26060 2202 1 4 . 1 1 7 7 SER HA H 7 4.530 4.530 4.689 -0.159 26060 2203 1 4 . 1 1 7 7 SER CA C 7 58.200 58.200 57.666 0.534 26060 2204 1 4 . 1 1 7 7 SER CB C 7 63.700 63.700 63.650 0.050 26060 2205 1 4 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.555 0.055 26060 2206 1 4 . 1 1 8 8 CYS C C 8 173.500 173.500 172.876 0.624 26060 2207 1 4 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.050 1.290 26060 2208 1 4 . 1 1 8 8 CYS CB C 8 28.490 28.490 28.139 0.351 26060 2209 1 4 . 1 1 9 9 ALA N N 9 124.700 124.700 132.146 -7.446 26060 2210 1 4 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.214 -0.424 26060 2211 1 4 . 1 1 9 9 ALA C C 9 177.400 177.400 176.342 1.058 26060 2212 1 4 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.193 1.877 26060 2213 1 4 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.250 0.379 26060 2214 1 4 . 1 1 9 9 ALA H H 9 7.960 7.960 8.532 -0.572 26060 2215 1 4 . 1 1 10 10 VAL N N 10 120.124 120.124 125.343 -5.219 26060 2216 1 4 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.235 0.055 26060 2217 1 4 . 1 1 10 10 VAL C C 10 173.900 173.900 175.099 -1.199 26060 2218 1 4 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.605 -0.055 26060 2219 1 4 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.298 2.602 26060 2220 1 4 . 1 1 10 10 VAL H H 10 8.424 8.424 8.684 -0.260 26060 2221 1 4 . 1 1 11 11 GLN N N 11 125.818 125.818 127.302 -1.484 26060 2222 1 4 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.221 0.339 26060 2223 1 4 . 1 1 11 11 GLN C C 11 175.400 175.400 175.279 0.121 26060 2224 1 4 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.567 -0.444 26060 2225 1 4 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.309 1.720 26060 2226 1 4 . 1 1 11 11 GLN H H 11 8.636 8.636 8.632 0.004 26060 2227 1 4 . 1 1 12 12 VAL N N 12 119.106 119.106 119.466 -0.360 26060 2228 1 4 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.417 0.213 26060 2229 1 4 . 1 1 12 12 VAL C C 12 173.800 173.800 174.768 -0.968 26060 2230 1 4 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.426 0.374 26060 2231 1 4 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.210 2.501 26060 2232 1 4 . 1 1 12 12 VAL H H 12 8.827 8.827 8.784 0.043 26060 2233 1 4 . 1 1 13 13 LYS N N 13 121.700 121.700 127.141 -5.441 26060 2234 1 4 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.238 -0.038 26060 2235 1 4 . 1 1 13 13 LYS C C 13 175.030 175.030 175.907 -0.877 26060 2236 1 4 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.348 0.082 26060 2237 1 4 . 1 1 13 13 LYS CB C 13 35.920 35.920 33.706 2.214 26060 2238 1 4 . 1 1 13 13 LYS H H 13 8.234 8.234 8.630 -0.396 26060 2239 1 4 . 1 1 14 14 LEU N N 14 119.100 119.100 125.070 -5.970 26060 2240 1 4 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.228 -0.278 26060 2241 1 4 . 1 1 14 14 LEU C C 14 175.110 175.110 175.436 -0.326 26060 2242 1 4 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.484 -0.127 26060 2243 1 4 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.640 1.281 26060 2244 1 4 . 1 1 14 14 LEU H H 14 8.840 8.840 8.482 0.358 26060 2245 1 4 . 1 1 15 15 GLU N N 15 120.978 120.978 122.923 -1.945 26060 2246 1 4 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.150 -0.160 26060 2247 1 4 . 1 1 15 15 GLU C C 15 173.800 173.800 174.928 -1.128 26060 2248 1 4 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.666 0.762 26060 2249 1 4 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.874 -1.048 26060 2250 1 4 . 1 1 15 15 GLU H H 15 9.181 9.181 9.356 -0.175 26060 2251 1 4 . 1 1 16 16 LEU N N 16 124.438 124.438 126.302 -1.864 26060 2252 1 4 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.292 -0.182 26060 2253 1 4 . 1 1 16 16 LEU C C 16 174.700 174.700 176.243 -1.543 26060 2254 1 4 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.751 0.325 26060 2255 1 4 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.844 2.048 26060 2256 1 4 . 1 1 16 16 LEU H H 16 8.891 8.891 8.896 -0.005 26060 2257 1 4 . 1 1 17 17 GLY N N 17 108.067 108.067 108.110 -0.043 26060 2258 1 4 . 1 1 17 17 GLY C C 17 170.350 170.350 172.270 -1.920 26060 2259 1 4 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.492 1.492 26060 2260 1 4 . 1 1 17 17 GLY H H 17 7.227 7.227 8.341 -1.114 26060 2261 1 4 . 1 1 18 18 HIS N N 18 111.200 111.200 118.397 -7.197 26060 2262 1 4 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.776 -0.156 26060 2263 1 4 . 1 1 18 18 HIS C C 18 172.400 172.400 172.597 -0.197 26060 2264 1 4 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.832 -0.892 26060 2265 1 4 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.711 1.449 26060 2266 1 4 . 1 1 18 18 HIS H H 18 8.150 8.150 9.112 -0.962 26060 2267 1 4 . 1 1 19 19 ARG N N 19 117.800 117.800 121.382 -3.582 26060 2268 1 4 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.840 0.260 26060 2269 1 4 . 1 1 19 19 ARG C C 19 175.800 175.800 174.124 1.676 26060 2270 1 4 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.083 -0.583 26060 2271 1 4 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.260 -0.610 26060 2272 1 4 . 1 1 19 19 ARG H H 19 9.010 9.010 8.974 0.036 26060 2273 1 4 . 1 1 20 20 ALA N N 20 120.390 120.390 122.341 -1.951 26060 2274 1 4 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.586 -0.056 26060 2275 1 4 . 1 1 20 20 ALA C C 20 175.800 175.800 175.265 0.535 26060 2276 1 4 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.959 1.231 26060 2277 1 4 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.052 0.698 26060 2278 1 4 . 1 1 20 20 ALA H H 20 8.070 8.070 8.274 -0.204 26060 2279 1 4 . 1 1 21 21 GLN N N 21 121.790 121.790 120.731 1.059 26060 2280 1 4 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.083 0.147 26060 2281 1 4 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.473 -0.143 26060 2282 1 4 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.061 -0.161 26060 2283 1 4 . 1 1 21 21 GLN H H 21 9.240 9.240 9.372 -0.132 26060 2284 1 4 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.627 -0.997 26060 2285 1 4 . 1 1 22 22 VAL C C 22 176.500 176.500 175.414 1.086 26060 2286 1 4 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.935 3.095 26060 2287 1 4 . 1 1 22 22 VAL CB C 22 31.600 31.600 34.098 -2.498 26060 2288 1 4 . 1 1 23 23 ARG N N 23 127.840 127.840 127.566 0.274 26060 2289 1 4 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.542 -0.412 26060 2290 1 4 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.413 1.187 26060 2291 1 4 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.573 1.577 26060 2292 1 4 . 1 1 23 23 ARG H H 23 8.720 8.720 8.413 0.307 26060 2293 1 4 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.155 -0.115 26060 2294 1 4 . 1 1 24 24 LYS C C 24 176.960 176.960 176.159 0.801 26060 2295 1 4 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.681 1.119 26060 2296 1 4 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.605 -0.545 26060 2297 1 4 . 1 1 25 25 LYS N N 25 115.870 115.870 119.397 -3.527 26060 2298 1 4 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.687 0.143 26060 2299 1 4 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.157 -0.197 26060 2300 1 4 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.363 1.717 26060 2301 1 4 . 1 1 25 25 LYS H H 25 7.720 7.720 7.626 0.094 26060 2302 1 4 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.658 0.172 26060 2303 1 4 . 1 1 26 26 PRO C C 26 177.400 177.400 176.979 0.421 26060 2304 1 4 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.844 -0.194 26060 2305 1 4 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.488 -0.098 26060 2306 1 4 . 1 1 27 27 THR N N 27 111.270 111.270 114.723 -3.453 26060 2307 1 4 . 1 1 27 27 THR HA H 27 4.530 4.530 4.197 0.333 26060 2308 1 4 . 1 1 27 27 THR C C 27 177.300 177.300 176.932 0.368 26060 2309 1 4 . 1 1 27 27 THR CA C 27 61.300 61.300 61.406 -0.106 26060 2310 1 4 . 1 1 27 27 THR CB C 27 71.460 71.460 70.007 1.453 26060 2311 1 4 . 1 1 27 27 THR H H 27 8.380 8.380 8.178 0.202 26060 2312 1 4 . 1 1 28 28 VAL N N 28 121.170 121.170 122.708 -1.538 26060 2313 1 4 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.805 0.078 26060 2314 1 4 . 1 1 28 28 VAL C C 28 177.030 177.030 176.106 0.924 26060 2315 1 4 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.146 0.054 26060 2316 1 4 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.635 -0.235 26060 2317 1 4 . 1 1 28 28 VAL H H 28 8.910 8.910 8.550 0.360 26060 2318 1 4 . 1 1 29 29 GLU N N 29 116.800 116.800 118.685 -1.885 26060 2319 1 4 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.110 -0.190 26060 2320 1 4 . 1 1 29 29 GLU C C 29 176.200 176.200 175.907 0.293 26060 2321 1 4 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.364 1.886 26060 2322 1 4 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.231 -1.061 26060 2323 1 4 . 1 1 29 29 GLU H H 29 7.990 7.990 7.990 -0.000 26060 2324 1 4 . 1 1 30 30 GLY N N 30 105.500 105.500 107.174 -1.674 26060 2325 1 4 . 1 1 30 30 GLY C C 30 174.900 174.900 173.718 1.182 26060 2326 1 4 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.145 -0.685 26060 2327 1 4 . 1 1 30 30 GLY H H 30 7.950 7.950 7.668 0.282 26060 2328 1 4 . 1 1 31 31 PHE N N 31 119.300 119.300 118.884 0.416 26060 2329 1 4 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.940 -0.180 26060 2330 1 4 . 1 1 31 31 PHE C C 31 176.400 176.400 175.974 0.426 26060 2331 1 4 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.584 1.315 26060 2332 1 4 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.329 -3.829 26060 2333 1 4 . 1 1 31 31 PHE H H 31 7.520 7.520 7.368 0.152 26060 2334 1 4 . 1 1 32 32 THR N N 32 112.300 112.300 116.308 -4.008 26060 2335 1 4 . 1 1 32 32 THR HA H 32 4.330 4.330 4.458 -0.128 26060 2336 1 4 . 1 1 32 32 THR C C 32 175.200 175.200 174.371 0.829 26060 2337 1 4 . 1 1 32 32 THR CA C 32 62.780 62.780 62.849 -0.069 26060 2338 1 4 . 1 1 32 32 THR CB C 32 70.350 70.350 70.022 0.328 26060 2339 1 4 . 1 1 32 32 THR H H 32 7.770 7.770 9.170 -1.400 26060 2340 1 4 . 1 1 33 33 HIS N N 33 121.900 121.900 122.131 -0.231 26060 2341 1 4 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.342 0.158 26060 2342 1 4 . 1 1 33 33 HIS C C 33 173.880 173.880 173.725 0.155 26060 2343 1 4 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.614 0.166 26060 2344 1 4 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.854 3.786 26060 2345 1 4 . 1 1 33 33 HIS H H 33 9.110 9.110 8.832 0.278 26060 2346 1 4 . 1 1 34 34 ASP N N 34 120.300 120.300 125.035 -4.735 26060 2347 1 4 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.555 -0.155 26060 2348 1 4 . 1 1 34 34 ASP C C 34 175.100 175.100 175.086 0.014 26060 2349 1 4 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.982 -0.672 26060 2350 1 4 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.593 -0.493 26060 2351 1 4 . 1 1 34 34 ASP H H 34 8.810 8.810 9.202 -0.392 26060 2352 1 4 . 1 1 35 35 TRP N N 35 119.800 119.800 120.833 -1.033 26060 2353 1 4 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.616 0.114 26060 2354 1 4 . 1 1 35 35 TRP C C 35 174.900 174.900 173.320 1.580 26060 2355 1 4 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.014 -0.114 26060 2356 1 4 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.086 1.984 26060 2357 1 4 . 1 1 35 35 TRP H H 35 9.250 9.250 8.972 0.278 26060 2358 1 4 . 1 1 36 36 MET N N 36 120.980 120.980 121.459 -0.479 26060 2359 1 4 . 1 1 36 36 MET HA H 36 5.750 5.750 5.960 -0.210 26060 2360 1 4 . 1 1 36 36 MET C C 36 173.700 173.700 174.314 -0.614 26060 2361 1 4 . 1 1 36 36 MET CA C 36 54.830 54.830 54.209 0.622 26060 2362 1 4 . 1 1 36 36 MET CB C 36 35.220 35.220 36.865 -1.645 26060 2363 1 4 . 1 1 36 36 MET H H 36 9.080 9.080 9.182 -0.102 26060 2364 1 4 . 1 1 37 37 VAL N N 37 126.220 126.220 120.982 5.238 26060 2365 1 4 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.095 0.215 26060 2366 1 4 . 1 1 37 37 VAL C C 37 172.300 172.300 174.309 -2.009 26060 2367 1 4 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.827 -1.287 26060 2368 1 4 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.649 1.421 26060 2369 1 4 . 1 1 37 37 VAL H H 37 9.080 9.080 8.698 0.382 26060 2370 1 4 . 1 1 38 38 PHE N N 38 120.640 120.640 122.225 -1.585 26060 2371 1 4 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.291 0.679 26060 2372 1 4 . 1 1 38 38 PHE C C 38 172.960 172.960 174.993 -2.033 26060 2373 1 4 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.874 -0.744 26060 2374 1 4 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.286 -0.286 26060 2375 1 4 . 1 1 38 38 PHE H H 38 8.320 8.320 9.011 -0.691 26060 2376 1 4 . 1 1 39 39 VAL N N 39 116.500 116.500 120.515 -4.015 26060 2377 1 4 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.729 -0.719 26060 2378 1 4 . 1 1 39 39 VAL C C 39 174.700 174.700 174.489 0.211 26060 2379 1 4 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.014 1.626 26060 2380 1 4 . 1 1 39 39 VAL CB C 39 35.400 35.400 34.266 1.134 26060 2381 1 4 . 1 1 39 39 VAL H H 39 8.580 8.580 9.169 -0.589 26060 2382 1 4 . 1 1 40 40 ARG N N 40 124.100 124.100 124.439 -0.339 26060 2383 1 4 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.902 0.178 26060 2384 1 4 . 1 1 40 40 ARG C C 40 173.800 173.800 174.461 -0.661 26060 2385 1 4 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.698 -0.768 26060 2386 1 4 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.891 0.689 26060 2387 1 4 . 1 1 40 40 ARG H H 40 9.880 9.880 8.521 1.359 26060 2388 1 4 . 1 1 41 41 GLY N N 41 107.640 107.640 107.112 0.528 26060 2389 1 4 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.640 1.330 26060 2390 1 4 . 1 1 41 41 GLY H H 41 8.910 8.910 8.671 0.239 26060 2391 1 4 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.401 0.089 26060 2392 1 4 . 1 1 42 42 PRO C C 42 177.300 177.300 176.752 0.548 26060 2393 1 4 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.670 -0.230 26060 2394 1 4 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.334 -0.224 26060 2395 1 4 . 1 1 43 43 GLU N N 43 121.050 121.050 125.027 -3.977 26060 2396 1 4 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.954 -0.164 26060 2397 1 4 . 1 1 43 43 GLU C C 43 176.110 176.110 176.052 0.058 26060 2398 1 4 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.149 -0.299 26060 2399 1 4 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.502 -0.652 26060 2400 1 4 . 1 1 43 43 GLU H H 43 9.060 9.060 8.817 0.243 26060 2401 1 4 . 1 1 44 44 HIS N N 44 114.100 114.100 116.848 -2.748 26060 2402 1 4 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.343 0.008 26060 2403 1 4 . 1 1 44 44 HIS C C 44 175.170 175.170 174.770 0.400 26060 2404 1 4 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.410 0.240 26060 2405 1 4 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.947 -0.577 26060 2406 1 4 . 1 1 44 44 HIS H H 44 8.420 8.420 8.765 -0.345 26060 2407 1 4 . 1 1 45 45 SER N N 45 115.540 115.540 117.755 -2.215 26060 2408 1 4 . 1 1 45 45 SER HA H 45 4.560 4.560 4.731 -0.171 26060 2409 1 4 . 1 1 45 45 SER C C 45 173.700 173.700 174.082 -0.382 26060 2410 1 4 . 1 1 45 45 SER CA C 45 58.710 58.710 57.362 1.348 26060 2411 1 4 . 1 1 45 45 SER CB C 45 65.040 65.040 63.703 1.337 26060 2412 1 4 . 1 1 45 45 SER H H 45 7.870 7.870 8.106 -0.236 26060 2413 1 4 . 1 1 46 46 ASN N N 46 123.900 123.900 124.610 -0.710 26060 2414 1 4 . 1 1 46 46 ASN HA H 46 5.120 5.120 5.032 0.088 26060 2415 1 4 . 1 1 46 46 ASN C C 46 176.300 176.300 175.778 0.522 26060 2416 1 4 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.708 -0.018 26060 2417 1 4 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.153 -1.423 26060 2418 1 4 . 1 1 46 46 ASN H H 46 9.480 9.480 8.517 0.963 26060 2419 1 4 . 1 1 47 47 ILE N N 47 115.240 115.240 121.231 -5.991 26060 2420 1 4 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.385 0.555 26060 2421 1 4 . 1 1 47 47 ILE C C 47 176.000 176.000 176.689 -0.689 26060 2422 1 4 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.974 0.226 26060 2423 1 4 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.166 -1.466 26060 2424 1 4 . 1 1 47 47 ILE H H 47 8.170 8.170 8.435 -0.265 26060 2425 1 4 . 1 1 48 48 GLN N N 48 123.200 123.200 119.986 3.214 26060 2426 1 4 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.152 0.128 26060 2427 1 4 . 1 1 48 48 GLN C C 48 175.670 175.670 176.398 -0.728 26060 2428 1 4 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.856 0.044 26060 2429 1 4 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.360 -0.370 26060 2430 1 4 . 1 1 48 48 GLN H H 48 8.850 8.850 8.589 0.261 26060 2431 1 4 . 1 1 49 49 HIS N N 49 115.400 115.400 115.892 -0.492 26060 2432 1 4 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.414 0.156 26060 2433 1 4 . 1 1 49 49 HIS C C 49 176.380 176.380 177.241 -0.861 26060 2434 1 4 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.594 0.156 26060 2435 1 4 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.851 0.769 26060 2436 1 4 . 1 1 49 49 HIS H H 49 7.400 7.400 7.615 -0.215 26060 2437 1 4 . 1 1 50 50 PHE N N 50 109.800 109.800 114.101 -4.301 26060 2438 1 4 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.908 0.322 26060 2439 1 4 . 1 1 50 50 PHE C C 50 173.800 173.800 174.296 -0.496 26060 2440 1 4 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.790 -0.130 26060 2441 1 4 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.544 1.456 26060 2442 1 4 . 1 1 50 50 PHE H H 50 7.570 7.570 7.652 -0.082 26060 2443 1 4 . 1 1 51 51 VAL N N 51 127.810 127.810 120.550 7.260 26060 2444 1 4 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.845 -0.475 26060 2445 1 4 . 1 1 51 51 VAL C C 51 174.500 174.500 174.541 -0.041 26060 2446 1 4 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.364 1.636 26060 2447 1 4 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.717 -1.437 26060 2448 1 4 . 1 1 51 51 VAL H H 51 7.810 7.810 8.088 -0.278 26060 2449 1 4 . 1 1 52 52 GLU N N 52 130.700 130.700 127.793 2.907 26060 2450 1 4 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.431 -0.451 26060 2451 1 4 . 1 1 52 52 GLU C C 52 175.400 175.400 175.767 -0.367 26060 2452 1 4 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.449 0.651 26060 2453 1 4 . 1 1 52 52 GLU CB C 52 31.580 31.580 31.906 -0.326 26060 2454 1 4 . 1 1 52 52 GLU H H 52 9.380 9.380 8.832 0.548 26060 2455 1 4 . 1 1 53 53 LYS N N 53 109.200 109.200 114.335 -5.135 26060 2456 1 4 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.994 -0.194 26060 2457 1 4 . 1 1 53 53 LYS C C 53 172.300 172.300 174.309 -2.009 26060 2458 1 4 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.621 0.219 26060 2459 1 4 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.932 -1.682 26060 2460 1 4 . 1 1 53 53 LYS H H 53 7.190 7.190 7.408 -0.218 26060 2461 1 4 . 1 1 54 54 VAL N N 54 120.380 120.380 117.773 2.607 26060 2462 1 4 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.697 0.073 26060 2463 1 4 . 1 1 54 54 VAL C C 54 173.600 173.600 173.910 -0.310 26060 2464 1 4 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.448 -0.408 26060 2465 1 4 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.705 -2.005 26060 2466 1 4 . 1 1 54 54 VAL H H 54 8.450 8.450 8.341 0.109 26060 2467 1 4 . 1 1 55 55 VAL N N 55 126.920 126.920 122.950 3.970 26060 2468 1 4 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.089 -0.389 26060 2469 1 4 . 1 1 55 55 VAL C C 55 173.800 173.800 173.863 -0.063 26060 2470 1 4 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.794 0.076 26060 2471 1 4 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.961 -2.861 26060 2472 1 4 . 1 1 55 55 VAL H H 55 9.260 9.260 8.855 0.405 26060 2473 1 4 . 1 1 56 56 PHE N N 56 126.130 126.130 123.952 2.178 26060 2474 1 4 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.036 -0.346 26060 2475 1 4 . 1 1 56 56 PHE C C 56 174.000 174.000 174.373 -0.373 26060 2476 1 4 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.706 -0.126 26060 2477 1 4 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.541 -1.651 26060 2478 1 4 . 1 1 56 56 PHE H H 56 9.290 9.290 9.002 0.288 26060 2479 1 4 . 1 1 57 57 HIS N N 57 124.180 124.180 124.289 -0.109 26060 2480 1 4 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.962 -0.162 26060 2481 1 4 . 1 1 57 57 HIS C C 57 174.700 174.700 175.026 -0.326 26060 2482 1 4 . 1 1 57 57 HIS CA C 57 55.320 55.320 54.900 0.420 26060 2483 1 4 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.843 1.257 26060 2484 1 4 . 1 1 57 57 HIS H H 57 8.690 8.690 8.603 0.087 26060 2485 1 4 . 1 1 58 58 LEU N N 58 122.050 122.050 122.672 -0.622 26060 2486 1 4 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.332 -0.092 26060 2487 1 4 . 1 1 58 58 LEU C C 58 174.400 174.400 176.374 -1.974 26060 2488 1 4 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.913 0.497 26060 2489 1 4 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.529 -1.369 26060 2490 1 4 . 1 1 58 58 LEU H H 58 9.050 9.050 7.776 1.274 26060 2491 1 4 . 1 1 59 59 HIS N N 59 118.510 118.510 118.016 0.494 26060 2492 1 4 . 1 1 59 59 HIS C C 59 175.300 175.300 176.691 -1.391 26060 2493 1 4 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.173 2.937 26060 2494 1 4 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.830 0.100 26060 2495 1 4 . 1 1 59 59 HIS H H 59 5.160 5.160 7.831 -2.671 26060 2496 1 4 . 1 1 60 60 GLU N N 60 122.190 122.190 125.308 -3.118 26060 2497 1 4 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.946 0.014 26060 2498 1 4 . 1 1 60 60 GLU C C 60 175.130 175.130 176.875 -1.745 26060 2499 1 4 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.456 -0.447 26060 2500 1 4 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.074 -0.254 26060 2501 1 4 . 1 1 60 60 GLU H H 60 7.960 7.960 8.463 -0.503 26060 2502 1 4 . 1 1 61 61 SER N N 61 116.940 116.940 113.386 3.554 26060 2503 1 4 . 1 1 61 61 SER HA H 61 4.200 4.200 4.325 -0.125 26060 2504 1 4 . 1 1 61 61 SER CA C 61 60.010 60.010 60.063 -0.053 26060 2505 1 4 . 1 1 61 61 SER CB C 61 63.140 63.140 63.389 -0.249 26060 2506 1 4 . 1 1 61 61 SER H H 61 8.540 8.540 8.214 0.326 26060 2507 1 4 . 1 1 62 62 PHE N N 62 123.700 123.700 122.729 0.971 26060 2508 1 4 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.676 -0.126 26060 2509 1 4 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.946 1.994 26060 2510 1 4 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.145 -0.745 26060 2511 1 4 . 1 1 62 62 PHE H H 62 8.640 8.640 8.131 0.509 26060 2512 1 4 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.488 -0.078 26060 2513 1 4 . 1 1 63 63 PRO C C 63 176.400 176.400 176.543 -0.143 26060 2514 1 4 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.054 -0.454 26060 2515 1 4 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.132 -0.272 26060 2516 1 4 . 1 1 64 64 ARG N N 64 116.840 116.840 120.369 -3.529 26060 2517 1 4 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.095 0.005 26060 2518 1 4 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.144 -0.534 26060 2519 1 4 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.671 0.160 26060 2520 1 4 . 1 1 64 64 ARG H H 64 8.890 8.890 8.754 0.136 26060 2521 1 4 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.410 -0.420 26060 2522 1 4 . 1 1 65 65 PRO C C 65 175.800 175.800 177.120 -1.320 26060 2523 1 4 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.902 1.908 26060 2524 1 4 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.993 -0.113 26060 2525 1 4 . 1 1 66 66 LYS N N 66 119.035 119.035 120.385 -1.350 26060 2526 1 4 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.127 -0.517 26060 2527 1 4 . 1 1 66 66 LYS C C 66 175.400 175.400 175.852 -0.452 26060 2528 1 4 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.283 0.170 26060 2529 1 4 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.039 -0.309 26060 2530 1 4 . 1 1 66 66 LYS H H 66 7.630 7.630 7.837 -0.207 26060 2531 1 4 . 1 1 67 67 ARG N N 67 127.394 127.394 127.380 0.014 26060 2532 1 4 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.628 0.112 26060 2533 1 4 . 1 1 67 67 ARG C C 67 174.500 174.500 175.029 -0.529 26060 2534 1 4 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.933 -0.133 26060 2535 1 4 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.250 -1.536 26060 2536 1 4 . 1 1 67 67 ARG H H 67 8.855 8.855 8.597 0.258 26060 2537 1 4 . 1 1 68 68 VAL N N 68 124.388 124.388 119.995 4.393 26060 2538 1 4 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.094 -0.514 26060 2539 1 4 . 1 1 68 68 VAL C C 68 176.850 176.850 175.554 1.296 26060 2540 1 4 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.893 2.180 26060 2541 1 4 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.411 0.193 26060 2542 1 4 . 1 1 68 68 VAL H H 68 8.681 8.681 8.426 0.255 26060 2543 1 4 . 1 1 69 69 CYS N N 69 127.080 127.080 126.487 0.593 26060 2544 1 4 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.764 0.306 26060 2545 1 4 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.999 0.347 26060 2546 1 4 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.205 0.565 26060 2547 1 4 . 1 1 69 69 CYS H H 69 9.455 9.455 9.034 0.421 26060 2548 1 4 . 1 1 70 70 LYS N N 70 125.480 125.480 123.350 2.130 26060 2549 1 4 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.516 -0.026 26060 2550 1 4 . 1 1 70 70 LYS C C 70 174.300 174.300 175.325 -1.025 26060 2551 1 4 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.248 1.512 26060 2552 1 4 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.259 -0.089 26060 2553 1 4 . 1 1 70 70 LYS H H 70 9.050 9.050 8.552 0.498 26060 2554 1 4 . 1 1 71 71 ASP N N 71 116.940 116.940 118.868 -1.928 26060 2555 1 4 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.804 0.296 26060 2556 1 4 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.892 -0.812 26060 2557 1 4 . 1 1 71 71 ASP CB C 71 43.380 43.380 42.042 1.338 26060 2558 1 4 . 1 1 71 71 ASP H H 71 7.620 7.620 7.481 0.139 26060 2559 1 4 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.119 -0.859 26060 2560 1 4 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.899 -2.249 26060 2561 1 4 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.203 -1.163 26060 2562 1 4 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.096 0.004 26060 2563 1 4 . 1 1 73 73 PRO C C 73 174.700 174.700 175.874 -1.174 26060 2564 1 4 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.264 -2.574 26060 2565 1 4 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.268 2.772 26060 2566 1 4 . 1 1 74 74 TYR N N 74 125.400 125.400 125.067 0.333 26060 2567 1 4 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.499 0.351 26060 2568 1 4 . 1 1 74 74 TYR C C 74 172.900 172.900 175.054 -2.154 26060 2569 1 4 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.723 -2.053 26060 2570 1 4 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.505 -3.105 26060 2571 1 4 . 1 1 74 74 TYR H H 74 8.960 8.960 8.279 0.681 26060 2572 1 4 . 1 1 75 75 LYS N N 75 121.400 121.400 120.300 1.100 26060 2573 1 4 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.020 0.570 26060 2574 1 4 . 1 1 75 75 LYS C C 75 173.800 173.800 174.479 -0.679 26060 2575 1 4 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.763 -0.113 26060 2576 1 4 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.663 -0.773 26060 2577 1 4 . 1 1 75 75 LYS H H 75 7.670 7.670 7.895 -0.225 26060 2578 1 4 . 1 1 76 76 VAL N N 76 119.800 119.800 121.795 -1.995 26060 2579 1 4 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.147 -0.257 26060 2580 1 4 . 1 1 76 76 VAL C C 76 173.900 173.900 174.387 -0.487 26060 2581 1 4 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.365 1.365 26060 2582 1 4 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.882 0.658 26060 2583 1 4 . 1 1 76 76 VAL H H 76 8.180 8.180 7.808 0.372 26060 2584 1 4 . 1 1 77 77 GLU N N 77 126.190 126.190 127.803 -1.613 26060 2585 1 4 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.963 -0.014 26060 2586 1 4 . 1 1 77 77 GLU C C 77 174.700 174.700 175.439 -0.739 26060 2587 1 4 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.072 -0.132 26060 2588 1 4 . 1 1 77 77 GLU CB C 77 31.550 31.550 30.915 0.635 26060 2589 1 4 . 1 1 77 77 GLU H H 77 8.270 8.270 8.667 -0.397 26060 2590 1 4 . 1 1 78 78 GLU N N 78 126.180 126.180 123.828 2.352 26060 2591 1 4 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.609 -0.159 26060 2592 1 4 . 1 1 78 78 GLU C C 78 175.400 175.400 173.927 1.473 26060 2593 1 4 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.190 -0.148 26060 2594 1 4 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.128 2.972 26060 2595 1 4 . 1 1 78 78 GLU H H 78 7.870 7.870 8.510 -0.640 26060 2596 1 4 . 1 1 79 79 SER N N 79 112.109 112.109 113.499 -1.390 26060 2597 1 4 . 1 1 79 79 SER HA H 79 5.560 5.560 5.405 0.155 26060 2598 1 4 . 1 1 79 79 SER C C 79 172.490 172.490 173.299 -0.809 26060 2599 1 4 . 1 1 79 79 SER CA C 79 57.754 57.754 56.566 1.188 26060 2600 1 4 . 1 1 79 79 SER CB C 79 65.861 65.861 65.309 0.552 26060 2601 1 4 . 1 1 79 79 SER H H 79 7.714 7.714 8.375 -0.661 26060 2602 1 4 . 1 1 80 80 GLY N N 80 106.048 106.048 110.968 -4.920 26060 2603 1 4 . 1 1 80 80 GLY C C 80 172.630 172.630 172.174 0.456 26060 2604 1 4 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.094 1.476 26060 2605 1 4 . 1 1 80 80 GLY H H 80 8.828 8.828 8.987 -0.159 26060 2606 1 4 . 1 1 81 81 TYR N N 81 115.280 115.280 116.853 -1.573 26060 2607 1 4 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.355 0.325 26060 2608 1 4 . 1 1 81 81 TYR C C 81 174.100 174.100 173.895 0.205 26060 2609 1 4 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.407 -0.907 26060 2610 1 4 . 1 1 81 81 TYR CB C 81 41.340 41.340 38.829 2.511 26060 2611 1 4 . 1 1 81 81 TYR H H 81 8.770 8.770 8.177 0.593 26060 2612 1 4 . 1 1 82 82 ALA N N 82 122.350 122.350 122.688 -0.338 26060 2613 1 4 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.529 -0.129 26060 2614 1 4 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.726 0.314 26060 2615 1 4 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.075 1.325 26060 2616 1 4 . 1 1 82 82 ALA H H 82 7.160 7.160 7.382 -0.222 26060 2617 1 4 . 1 1 83 83 GLY N N 83 107.100 107.100 106.515 0.585 26060 2618 1 4 . 1 1 83 83 GLY C C 83 172.500 172.500 173.550 -1.050 26060 2619 1 4 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.082 0.528 26060 2620 1 4 . 1 1 83 83 GLY H H 83 8.220 8.220 8.219 0.001 26060 2621 1 4 . 1 1 84 84 PHE N N 84 111.660 111.660 116.450 -4.790 26060 2622 1 4 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.610 0.080 26060 2623 1 4 . 1 1 84 84 PHE C C 84 172.460 172.460 173.501 -1.041 26060 2624 1 4 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.705 -0.205 26060 2625 1 4 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.723 -1.143 26060 2626 1 4 . 1 1 84 84 PHE H H 84 7.700 7.700 8.163 -0.463 26060 2627 1 4 . 1 1 85 85 ILE N N 85 117.810 117.810 121.616 -3.806 26060 2628 1 4 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.113 0.197 26060 2629 1 4 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.113 -1.773 26060 2630 1 4 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.372 -2.112 26060 2631 1 4 . 1 1 85 85 ILE H H 85 8.340 8.340 8.609 -0.269 26060 2632 1 4 . 1 1 86 86 LEU N N 86 108.130 108.130 129.214 -21.084 26060 2633 1 4 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.114 -0.134 26060 2634 1 4 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.166 2.034 26060 2635 1 4 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.632 -0.332 26060 2636 1 4 . 1 1 86 86 LEU H H 86 9.900 9.900 8.710 1.190 26060 2637 1 4 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.508 0.592 26060 2638 1 4 . 1 1 87 87 PRO C C 87 175.340 175.340 175.834 -0.494 26060 2639 1 4 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.793 0.317 26060 2640 1 4 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.510 1.050 26060 2641 1 4 . 1 1 88 88 ILE N N 88 126.000 126.000 126.314 -0.314 26060 2642 1 4 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.312 0.478 26060 2643 1 4 . 1 1 88 88 ILE C C 88 176.100 176.100 175.264 0.836 26060 2644 1 4 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.578 -0.018 26060 2645 1 4 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.881 2.119 26060 2646 1 4 . 1 1 88 88 ILE H H 88 9.380 9.380 8.640 0.740 26060 2647 1 4 . 1 1 89 89 GLU N N 89 123.900 123.900 125.310 -1.410 26060 2648 1 4 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.200 -0.000 26060 2649 1 4 . 1 1 89 89 GLU C C 89 173.800 173.800 175.621 -1.821 26060 2650 1 4 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.470 -0.500 26060 2651 1 4 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.236 1.144 26060 2652 1 4 . 1 1 89 89 GLU H H 89 9.320 9.320 8.960 0.360 26060 2653 1 4 . 1 1 90 90 VAL N N 90 123.980 123.980 123.523 0.457 26060 2654 1 4 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.185 -0.025 26060 2655 1 4 . 1 1 90 90 VAL C C 90 174.800 174.800 174.713 0.087 26060 2656 1 4 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.200 0.790 26060 2657 1 4 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.870 0.620 26060 2658 1 4 . 1 1 90 90 VAL H H 90 8.630 8.630 8.553 0.077 26060 2659 1 4 . 1 1 91 91 TYR N N 91 124.230 124.230 127.530 -3.300 26060 2660 1 4 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.251 0.409 26060 2661 1 4 . 1 1 91 91 TYR C C 91 176.800 176.800 175.592 1.208 26060 2662 1 4 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.500 -1.800 26060 2663 1 4 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.792 1.448 26060 2664 1 4 . 1 1 91 91 TYR H H 91 8.640 8.640 9.022 -0.382 26060 2665 1 4 . 1 1 92 92 PHE N N 92 121.200 121.200 122.228 -1.028 26060 2666 1 4 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.237 0.423 26060 2667 1 4 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.024 1.486 26060 2668 1 4 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.977 0.723 26060 2669 1 4 . 1 1 92 92 PHE H H 92 8.750 8.750 8.862 -0.112 26060 2670 1 4 . 1 1 93 93 LYS N N 93 123.450 123.450 123.034 0.416 26060 2671 1 4 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.576 0.024 26060 2672 1 4 . 1 1 93 93 LYS C C 93 174.200 174.200 175.151 -0.951 26060 2673 1 4 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.009 -0.829 26060 2674 1 4 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.029 -0.349 26060 2675 1 4 . 1 1 93 93 LYS H H 93 8.560 8.560 9.135 -0.575 26060 2676 1 4 . 1 1 94 94 ASN N N 94 118.800 118.800 119.406 -0.606 26060 2677 1 4 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.903 -0.463 26060 2678 1 4 . 1 1 94 94 ASN CA C 94 51.210 51.210 51.672 -0.462 26060 2679 1 4 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.373 -0.574 26060 2680 1 4 . 1 1 94 94 ASN H H 94 7.820 7.820 8.185 -0.365 26060 2681 1 4 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.280 0.050 26060 2682 1 4 . 1 1 95 95 LYS C C 95 175.800 175.800 176.050 -0.250 26060 2683 1 4 . 1 1 95 95 LYS CA C 95 56.210 56.210 57.403 -1.193 26060 2684 1 4 . 1 1 95 95 LYS CB C 95 33.010 33.010 32.949 0.061 26060 2685 1 4 . 1 1 96 96 GLU N N 96 118.330 118.330 119.871 -1.541 26060 2686 1 4 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.380 0.130 26060 2687 1 4 . 1 1 96 96 GLU C C 96 173.200 173.200 175.885 -2.685 26060 2688 1 4 . 1 1 96 96 GLU CA C 96 54.100 54.100 54.788 -0.688 26060 2689 1 4 . 1 1 96 96 GLU CB C 96 31.470 31.470 30.112 1.358 26060 2690 1 4 . 1 1 96 96 GLU H H 96 7.120 7.120 7.726 -0.606 26060 2691 1 4 . 1 1 97 97 GLU N N 97 115.630 115.630 119.072 -3.442 26060 2692 1 4 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.202 0.228 26060 2693 1 4 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.218 -1.358 26060 2694 1 4 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.869 0.401 26060 2695 1 4 . 1 1 97 97 GLU H H 97 8.060 8.060 8.482 -0.422 26060 2696 1 4 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.258 0.742 26060 2697 1 4 . 1 1 98 98 PRO C C 98 175.900 175.900 176.130 -0.230 26060 2698 1 4 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.321 -2.161 26060 2699 1 4 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.033 1.967 26060 2700 1 4 . 1 1 99 99 ARG N N 99 122.800 122.800 119.295 3.505 26060 2701 1 4 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.540 0.090 26060 2702 1 4 . 1 1 99 99 ARG C C 99 175.800 175.800 176.339 -0.539 26060 2703 1 4 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.839 -0.349 26060 2704 1 4 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.897 -0.487 26060 2705 1 4 . 1 1 99 99 ARG H H 99 8.602 8.602 8.667 -0.065 26060 2706 1 4 . 1 1 100 100 LYS N N 100 113.220 113.220 116.339 -3.119 26060 2707 1 4 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.341 0.599 26060 2708 1 4 . 1 1 100 100 LYS C C 100 174.100 174.100 174.400 -0.300 26060 2709 1 4 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.099 -0.189 26060 2710 1 4 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.730 -1.010 26060 2711 1 4 . 1 1 100 100 LYS H H 100 7.650 7.650 7.316 0.334 26060 2712 1 4 . 1 1 101 101 VAL N N 101 116.230 116.230 120.927 -4.697 26060 2713 1 4 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.122 0.148 26060 2714 1 4 . 1 1 101 101 VAL C C 101 171.600 171.600 173.593 -1.993 26060 2715 1 4 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.373 0.887 26060 2716 1 4 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.215 -0.035 26060 2717 1 4 . 1 1 101 101 VAL H H 101 8.120 8.120 7.733 0.387 26060 2718 1 4 . 1 1 102 102 ARG N N 102 124.980 124.980 127.904 -2.924 26060 2719 1 4 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.874 0.286 26060 2720 1 4 . 1 1 102 102 ARG C C 102 174.340 174.340 175.241 -0.901 26060 2721 1 4 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.685 -0.935 26060 2722 1 4 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.689 1.661 26060 2723 1 4 . 1 1 102 102 ARG H H 102 7.930 7.930 8.270 -0.340 26060 2724 1 4 . 1 1 103 103 PHE N N 103 124.590 124.590 127.166 -2.576 26060 2725 1 4 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.804 -0.012 26060 2726 1 4 . 1 1 103 103 PHE C C 103 174.280 174.280 174.995 -0.715 26060 2727 1 4 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.791 1.189 26060 2728 1 4 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.983 2.267 26060 2729 1 4 . 1 1 103 103 PHE H H 103 9.390 9.390 9.141 0.249 26060 2730 1 4 . 1 1 104 104 ASP N N 104 124.700 124.700 126.581 -1.881 26060 2731 1 4 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.691 0.108 26060 2732 1 4 . 1 1 104 104 ASP C C 104 174.500 174.500 174.967 -0.467 26060 2733 1 4 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.869 -0.479 26060 2734 1 4 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.774 0.456 26060 2735 1 4 . 1 1 104 104 ASP H H 104 9.010 9.010 8.918 0.092 26060 2736 1 4 . 1 1 105 105 TYR N N 105 129.840 129.840 125.200 4.640 26060 2737 1 4 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.525 -0.425 26060 2738 1 4 . 1 1 105 105 TYR C C 105 173.100 173.100 173.977 -0.877 26060 2739 1 4 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.818 0.862 26060 2740 1 4 . 1 1 105 105 TYR CB C 105 41.850 41.850 41.014 0.836 26060 2741 1 4 . 1 1 105 105 TYR H H 105 8.140 8.140 8.108 0.032 26060 2742 1 4 . 1 1 106 106 ASP N N 106 126.800 126.800 127.764 -0.964 26060 2743 1 4 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.388 -0.168 26060 2744 1 4 . 1 1 106 106 ASP C C 106 172.900 172.900 174.577 -1.677 26060 2745 1 4 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.535 -0.025 26060 2746 1 4 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.286 -1.786 26060 2747 1 4 . 1 1 106 106 ASP H H 106 7.730 7.730 8.223 -0.493 26060 2748 1 4 . 1 1 107 107 LEU N N 107 132.150 132.150 127.890 4.260 26060 2749 1 4 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.474 -0.634 26060 2750 1 4 . 1 1 107 107 LEU C C 107 172.100 172.100 174.912 -2.812 26060 2751 1 4 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.889 -0.188 26060 2752 1 4 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.108 -1.867 26060 2753 1 4 . 1 1 107 107 LEU H H 107 7.770 7.770 7.744 0.026 26060 2754 1 4 . 1 1 108 108 PHE N N 108 118.960 118.960 122.212 -3.252 26060 2755 1 4 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.866 -0.176 26060 2756 1 4 . 1 1 108 108 PHE C C 108 174.300 174.300 173.408 0.892 26060 2757 1 4 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.207 -0.517 26060 2758 1 4 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.766 -0.475 26060 2759 1 4 . 1 1 108 108 PHE H H 108 6.060 6.060 7.127 -1.067 26060 2760 1 4 . 1 1 109 109 LEU N N 109 118.900 118.900 122.463 -3.563 26060 2761 1 4 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.663 -0.263 26060 2762 1 4 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.368 -1.208 26060 2763 1 4 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.723 -1.643 26060 2764 1 4 . 1 1 109 109 LEU H H 109 8.388 8.388 8.333 0.055 26060 2765 1 4 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.478 -0.038 26060 2766 1 4 . 1 1 111 111 LEU C C 111 177.300 177.300 177.496 -0.196 26060 2767 1 4 . 1 1 111 111 LEU CA C 111 54.220 54.220 54.683 -0.463 26060 2768 1 4 . 1 1 111 111 LEU CB C 111 43.870 43.870 43.060 0.810 26060 2769 1 4 . 1 1 112 112 GLU N N 112 120.660 120.660 120.716 -0.056 26060 2770 1 4 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.186 -0.016 26060 2771 1 4 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.277 0.183 26060 2772 1 4 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.820 -0.130 26060 2773 1 4 . 1 1 112 112 GLU H H 112 8.780 8.780 8.765 0.015 26060 2774 1 4 . 1 1 113 113 GLY C C 113 173.900 173.900 174.074 -0.174 26060 2775 1 4 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.866 0.084 26060 2776 1 4 . 1 1 114 114 HIS N N 114 120.890 120.890 119.417 1.473 26060 2777 1 4 . 1 1 114 114 HIS HA H 114 4.906 4.906 4.984 -0.078 26060 2778 1 4 . 1 1 114 114 HIS CA C 114 54.770 54.770 52.756 2.014 26060 2779 1 4 . 1 1 114 114 HIS CB C 114 30.590 30.590 30.060 0.530 26060 2780 1 4 . 1 1 114 114 HIS H H 114 7.934 7.934 7.769 0.165 26060 2781 1 4 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.357 0.443 26060 2782 1 4 . 1 1 115 115 PRO CA C 115 62.090 62.090 62.275 -0.185 26060 2783 1 4 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.325 -0.645 26060 2784 1 4 . 1 1 116 116 PRO C C 116 176.600 176.600 176.746 -0.146 26060 2785 1 4 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.039 0.261 26060 2786 1 4 . 1 1 117 117 VAL N N 117 127.480 127.480 126.428 1.052 26060 2787 1 4 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.092 -0.302 26060 2788 1 4 . 1 1 117 117 VAL CA C 117 62.700 62.700 62.972 -0.272 26060 2789 1 4 . 1 1 117 117 VAL CB C 117 33.200 33.200 32.462 0.738 26060 2790 1 4 . 1 1 117 117 VAL H H 117 8.890 8.890 8.316 0.574 26060 2791 1 4 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.988 0.002 26060 2792 1 4 . 1 1 118 118 ASN C C 118 172.700 172.700 173.509 -0.809 26060 2793 1 4 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.118 0.242 26060 2794 1 4 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.438 -1.238 26060 2795 1 4 . 1 1 119 119 HIS N N 119 124.930 124.930 126.393 -1.463 26060 2796 1 4 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.054 -0.234 26060 2797 1 4 . 1 1 119 119 HIS C C 119 173.500 173.500 172.734 0.766 26060 2798 1 4 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.165 1.805 26060 2799 1 4 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.122 0.548 26060 2800 1 4 . 1 1 119 119 HIS H H 119 8.790 8.790 8.960 -0.170 26060 2801 1 4 . 1 1 120 120 LEU N N 120 128.280 128.280 124.133 4.147 26060 2802 1 4 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.086 -0.136 26060 2803 1 4 . 1 1 120 120 LEU C C 120 174.030 174.030 174.903 -0.873 26060 2804 1 4 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.740 0.700 26060 2805 1 4 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.337 0.262 26060 2806 1 4 . 1 1 120 120 LEU H H 120 7.460 7.460 8.215 -0.755 26060 2807 1 4 . 1 1 121 121 ARG N N 121 128.060 128.060 122.115 5.945 26060 2808 1 4 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.701 -0.061 26060 2809 1 4 . 1 1 121 121 ARG C C 121 173.400 173.400 173.634 -0.234 26060 2810 1 4 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.610 -0.250 26060 2811 1 4 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.351 1.909 26060 2812 1 4 . 1 1 121 121 ARG H H 121 9.860 9.860 9.082 0.778 26060 2813 1 4 . 1 1 122 122 CYS N N 122 125.290 125.290 119.321 5.969 26060 2814 1 4 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.192 -0.172 26060 2815 1 4 . 1 1 122 122 CYS C C 122 174.600 174.600 174.450 0.150 26060 2816 1 4 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.128 2.162 26060 2817 1 4 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.690 -2.660 26060 2818 1 4 . 1 1 122 122 CYS H H 122 8.835 8.835 8.754 0.081 26060 2819 1 4 . 1 1 123 123 GLU N N 123 125.920 125.920 123.781 2.139 26060 2820 1 4 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.514 0.166 26060 2821 1 4 . 1 1 123 123 GLU C C 123 174.500 174.500 174.580 -0.080 26060 2822 1 4 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.878 -0.458 26060 2823 1 4 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.389 0.194 26060 2824 1 4 . 1 1 123 123 GLU H H 123 8.970 8.970 9.155 -0.185 26060 2825 1 4 . 1 1 124 124 LYS N N 124 121.837 121.837 121.874 -0.037 26060 2826 1 4 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.975 -0.015 26060 2827 1 4 . 1 1 124 124 LYS C C 124 175.700 175.700 175.607 0.093 26060 2828 1 4 . 1 1 124 124 LYS CA C 124 55.357 55.357 54.792 0.565 26060 2829 1 4 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.992 -0.804 26060 2830 1 4 . 1 1 124 124 LYS H H 124 8.652 8.652 8.362 0.290 26060 2831 1 4 . 1 1 125 125 LEU N N 125 127.000 127.000 128.548 -1.548 26060 2832 1 4 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.590 0.060 26060 2833 1 4 . 1 1 125 125 LEU C C 125 175.110 175.110 175.538 -0.428 26060 2834 1 4 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.793 0.061 26060 2835 1 4 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.524 0.743 26060 2836 1 4 . 1 1 125 125 LEU H H 125 9.175 9.175 8.920 0.255 26060 2837 1 4 . 1 1 126 126 THR N N 126 117.779 117.779 120.357 -2.578 26060 2838 1 4 . 1 1 126 126 THR HA H 126 4.650 4.650 4.495 0.155 26060 2839 1 4 . 1 1 126 126 THR C C 126 173.200 173.200 173.510 -0.310 26060 2840 1 4 . 1 1 126 126 THR CA C 126 62.036 62.036 61.940 0.096 26060 2841 1 4 . 1 1 126 126 THR CB C 126 70.284 70.284 68.851 1.433 26060 2842 1 4 . 1 1 126 126 THR H H 126 8.331 8.331 8.432 -0.101 26060 2843 1 4 . 1 1 127 127 PHE N N 127 126.576 126.576 126.673 -0.097 26060 2844 1 4 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.640 -0.050 26060 2845 1 4 . 1 1 127 127 PHE C C 127 174.860 174.860 174.607 0.253 26060 2846 1 4 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.695 0.169 26060 2847 1 4 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.075 -1.075 26060 2848 1 4 . 1 1 127 127 PHE H H 127 9.051 9.051 8.773 0.278 26060 2849 1 4 . 1 1 128 128 ASN N N 128 123.040 123.040 123.929 -0.889 26060 2850 1 4 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.816 -0.196 26060 2851 1 4 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.618 0.862 26060 2852 1 4 . 1 1 128 128 ASN CB C 128 39.460 39.460 39.041 0.419 26060 2853 1 4 . 1 1 128 128 ASN H H 128 8.880 8.880 8.856 0.024 26060 2854 1 4 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.492 0.268 26060 2855 1 4 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.645 -0.745 26060 2856 1 4 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.307 1.423 26060 2857 1 4 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.737 0.053 26060 2858 1 4 . 1 1 130 130 PRO C C 130 177.470 177.470 176.905 0.565 26060 2859 1 4 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.289 0.285 26060 2860 1 4 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.427 -1.117 26060 2861 1 4 . 1 1 131 131 THR N N 131 113.400 113.400 116.613 -3.213 26060 2862 1 4 . 1 1 131 131 THR HA H 131 4.300 4.300 4.168 0.132 26060 2863 1 4 . 1 1 131 131 THR C C 131 175.200 175.200 176.006 -0.806 26060 2864 1 4 . 1 1 131 131 THR CA C 131 62.200 62.200 61.976 0.224 26060 2865 1 4 . 1 1 131 131 THR CB C 131 70.600 70.600 70.841 -0.242 26060 2866 1 4 . 1 1 131 131 THR H H 131 8.950 8.950 9.257 -0.307 26060 2867 1 4 . 1 1 132 132 GLU N N 132 122.199 122.199 126.952 -4.753 26060 2868 1 4 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.936 0.074 26060 2869 1 4 . 1 1 132 132 GLU C C 132 178.700 178.700 178.432 0.268 26060 2870 1 4 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.668 -0.374 26060 2871 1 4 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.706 -0.545 26060 2872 1 4 . 1 1 132 132 GLU H H 132 8.932 8.932 8.959 -0.027 26060 2873 1 4 . 1 1 133 133 ASP N N 133 116.324 116.324 119.253 -2.929 26060 2874 1 4 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.365 -0.035 26060 2875 1 4 . 1 1 133 133 ASP C C 133 177.800 177.800 178.413 -0.613 26060 2876 1 4 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.660 -0.114 26060 2877 1 4 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.666 1.157 26060 2878 1 4 . 1 1 133 133 ASP H H 133 8.490 8.490 7.947 0.543 26060 2879 1 4 . 1 1 134 134 PHE N N 134 119.914 119.914 120.483 -0.569 26060 2880 1 4 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.277 0.333 26060 2881 1 4 . 1 1 134 134 PHE C C 134 177.300 177.300 177.432 -0.132 26060 2882 1 4 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.438 0.100 26060 2883 1 4 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.746 0.454 26060 2884 1 4 . 1 1 134 134 PHE H H 134 7.787 7.787 7.464 0.323 26060 2885 1 4 . 1 1 135 135 ARG N N 135 119.794 119.794 120.215 -0.421 26060 2886 1 4 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.573 -0.223 26060 2887 1 4 . 1 1 135 135 ARG C C 135 177.370 177.370 178.330 -0.960 26060 2888 1 4 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.096 0.279 26060 2889 1 4 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.058 0.338 26060 2890 1 4 . 1 1 135 135 ARG H H 135 9.087 9.087 8.834 0.253 26060 2891 1 4 . 1 1 136 136 ARG N N 136 114.554 114.554 118.678 -4.124 26060 2892 1 4 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.911 -0.091 26060 2893 1 4 . 1 1 136 136 ARG C C 136 178.950 178.950 178.942 0.008 26060 2894 1 4 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.702 0.098 26060 2895 1 4 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.044 0.173 26060 2896 1 4 . 1 1 136 136 ARG H H 136 7.747 7.747 8.588 -0.841 26060 2897 1 4 . 1 1 137 137 LYS N N 137 118.298 118.298 119.711 -1.413 26060 2898 1 4 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.978 -0.078 26060 2899 1 4 . 1 1 137 137 LYS C C 137 177.980 177.980 179.007 -1.027 26060 2900 1 4 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.692 0.703 26060 2901 1 4 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.387 0.060 26060 2902 1 4 . 1 1 137 137 LYS H H 137 7.154 7.154 7.529 -0.375 26060 2903 1 4 . 1 1 138 138 LEU N N 138 117.159 117.159 118.924 -1.765 26060 2904 1 4 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.729 -0.309 26060 2905 1 4 . 1 1 138 138 LEU C C 138 179.100 179.100 178.505 0.595 26060 2906 1 4 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.157 0.074 26060 2907 1 4 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.477 0.851 26060 2908 1 4 . 1 1 138 138 LEU H H 138 7.709 7.709 7.733 -0.024 26060 2909 1 4 . 1 1 139 139 LEU N N 139 115.158 115.158 116.333 -1.175 26060 2910 1 4 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.039 0.111 26060 2911 1 4 . 1 1 139 139 LEU C C 139 177.600 177.600 178.742 -1.142 26060 2912 1 4 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.643 -1.114 26060 2913 1 4 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.852 -0.108 26060 2914 1 4 . 1 1 139 139 LEU H H 139 7.507 7.507 8.030 -0.523 26060 2915 1 4 . 1 1 140 140 LYS N N 140 120.256 120.256 118.114 2.142 26060 2916 1 4 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.997 0.113 26060 2917 1 4 . 1 1 140 140 LYS C C 140 175.800 175.800 177.092 -1.292 26060 2918 1 4 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.682 -0.630 26060 2919 1 4 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.400 0.246 26060 2920 1 4 . 1 1 140 140 LYS H H 140 7.304 7.304 7.726 -0.422 26060 2921 1 5 . 1 1 4 4 MET C C 4 175.800 175.800 175.828 -0.028 26060 2922 1 5 . 1 1 4 4 MET CA C 4 55.350 55.350 55.142 0.208 26060 2923 1 5 . 1 1 4 4 MET CB C 4 32.880 32.880 33.237 -0.357 26060 2924 1 5 . 1 1 5 5 ALA N N 5 125.230 125.230 123.834 1.396 26060 2925 1 5 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.561 -0.211 26060 2926 1 5 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.300 1.129 26060 2927 1 5 . 1 1 5 5 ALA CB C 5 19.370 19.370 20.055 -0.685 26060 2928 1 5 . 1 1 5 5 ALA H H 5 8.320 8.320 7.681 0.639 26060 2929 1 5 . 1 1 6 6 SER HA H 6 4.490 4.490 4.530 -0.040 26060 2930 1 5 . 1 1 6 6 SER CA C 6 58.200 58.200 58.111 0.089 26060 2931 1 5 . 1 1 6 6 SER CB C 6 63.700 63.700 62.996 0.704 26060 2932 1 5 . 1 1 7 7 SER HA H 7 4.530 4.530 4.600 -0.070 26060 2933 1 5 . 1 1 7 7 SER CA C 7 58.200 58.200 58.646 -0.446 26060 2934 1 5 . 1 1 7 7 SER CB C 7 63.700 63.700 62.861 0.839 26060 2935 1 5 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.580 0.030 26060 2936 1 5 . 1 1 8 8 CYS C C 8 173.500 173.500 173.109 0.391 26060 2937 1 5 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.772 0.568 26060 2938 1 5 . 1 1 8 8 CYS CB C 8 28.490 28.490 30.196 -1.706 26060 2939 1 5 . 1 1 9 9 ALA N N 9 124.700 124.700 131.085 -6.385 26060 2940 1 5 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.937 -0.147 26060 2941 1 5 . 1 1 9 9 ALA C C 9 177.400 177.400 176.614 0.786 26060 2942 1 5 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.198 0.872 26060 2943 1 5 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.512 1.117 26060 2944 1 5 . 1 1 9 9 ALA H H 9 7.960 7.960 8.398 -0.438 26060 2945 1 5 . 1 1 10 10 VAL N N 10 120.124 120.124 124.937 -4.813 26060 2946 1 5 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.195 0.095 26060 2947 1 5 . 1 1 10 10 VAL C C 10 173.900 173.900 175.052 -1.152 26060 2948 1 5 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.653 -0.103 26060 2949 1 5 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.942 1.958 26060 2950 1 5 . 1 1 10 10 VAL H H 10 8.424 8.424 8.587 -0.163 26060 2951 1 5 . 1 1 11 11 GLN N N 11 125.818 125.818 126.670 -0.852 26060 2952 1 5 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.379 0.181 26060 2953 1 5 . 1 1 11 11 GLN C C 11 175.400 175.400 175.487 -0.087 26060 2954 1 5 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.615 -0.492 26060 2955 1 5 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.448 1.581 26060 2956 1 5 . 1 1 11 11 GLN H H 11 8.636 8.636 8.524 0.112 26060 2957 1 5 . 1 1 12 12 VAL N N 12 119.106 119.106 117.605 1.501 26060 2958 1 5 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.337 0.293 26060 2959 1 5 . 1 1 12 12 VAL C C 12 173.800 173.800 174.040 -0.240 26060 2960 1 5 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.096 0.704 26060 2961 1 5 . 1 1 12 12 VAL CB C 12 35.711 35.711 34.188 1.523 26060 2962 1 5 . 1 1 12 12 VAL H H 12 8.827 8.827 8.827 0.000 26060 2963 1 5 . 1 1 13 13 LYS N N 13 121.700 121.700 124.685 -2.985 26060 2964 1 5 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.245 -0.045 26060 2965 1 5 . 1 1 13 13 LYS C C 13 175.030 175.030 175.593 -0.563 26060 2966 1 5 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.025 0.405 26060 2967 1 5 . 1 1 13 13 LYS CB C 13 35.920 35.920 35.048 0.872 26060 2968 1 5 . 1 1 13 13 LYS H H 13 8.234 8.234 8.546 -0.312 26060 2969 1 5 . 1 1 14 14 LEU N N 14 119.100 119.100 124.380 -5.280 26060 2970 1 5 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.416 -0.466 26060 2971 1 5 . 1 1 14 14 LEU C C 14 175.110 175.110 175.323 -0.213 26060 2972 1 5 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.192 0.165 26060 2973 1 5 . 1 1 14 14 LEU CB C 14 46.921 46.921 46.776 0.145 26060 2974 1 5 . 1 1 14 14 LEU H H 14 8.840 8.840 9.020 -0.180 26060 2975 1 5 . 1 1 15 15 GLU N N 15 120.978 120.978 120.064 0.914 26060 2976 1 5 . 1 1 15 15 GLU HA H 15 4.990 4.990 4.955 0.035 26060 2977 1 5 . 1 1 15 15 GLU C C 15 173.800 173.800 174.437 -0.637 26060 2978 1 5 . 1 1 15 15 GLU CA C 15 55.428 55.428 55.212 0.216 26060 2979 1 5 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.725 -1.899 26060 2980 1 5 . 1 1 15 15 GLU H H 15 9.181 9.181 9.109 0.072 26060 2981 1 5 . 1 1 16 16 LEU N N 16 124.438 124.438 125.586 -1.148 26060 2982 1 5 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.460 -0.350 26060 2983 1 5 . 1 1 16 16 LEU C C 16 174.700 174.700 176.159 -1.459 26060 2984 1 5 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.384 0.692 26060 2985 1 5 . 1 1 16 16 LEU CB C 16 44.892 44.892 43.306 1.586 26060 2986 1 5 . 1 1 16 16 LEU H H 16 8.891 8.891 8.949 -0.058 26060 2987 1 5 . 1 1 17 17 GLY N N 17 108.067 108.067 108.165 -0.098 26060 2988 1 5 . 1 1 17 17 GLY C C 17 170.350 170.350 172.321 -1.971 26060 2989 1 5 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.365 1.619 26060 2990 1 5 . 1 1 17 17 GLY H H 17 7.227 7.227 8.312 -1.085 26060 2991 1 5 . 1 1 18 18 HIS N N 18 111.200 111.200 118.306 -7.106 26060 2992 1 5 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.864 -0.243 26060 2993 1 5 . 1 1 18 18 HIS C C 18 172.400 172.400 172.769 -0.369 26060 2994 1 5 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.790 -0.850 26060 2995 1 5 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.491 1.669 26060 2996 1 5 . 1 1 18 18 HIS H H 18 8.150 8.150 9.185 -1.035 26060 2997 1 5 . 1 1 19 19 ARG N N 19 117.800 117.800 122.244 -4.444 26060 2998 1 5 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.802 0.298 26060 2999 1 5 . 1 1 19 19 ARG C C 19 175.800 175.800 174.317 1.483 26060 3000 1 5 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.035 -0.535 26060 3001 1 5 . 1 1 19 19 ARG CB C 19 34.650 34.650 34.789 -0.139 26060 3002 1 5 . 1 1 19 19 ARG H H 19 9.010 9.010 8.951 0.059 26060 3003 1 5 . 1 1 20 20 ALA N N 20 120.390 120.390 121.777 -1.387 26060 3004 1 5 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.634 -0.104 26060 3005 1 5 . 1 1 20 20 ALA C C 20 175.800 175.800 175.060 0.740 26060 3006 1 5 . 1 1 20 20 ALA CA C 20 52.190 52.190 51.066 1.124 26060 3007 1 5 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.060 0.690 26060 3008 1 5 . 1 1 20 20 ALA H H 20 8.070 8.070 8.406 -0.336 26060 3009 1 5 . 1 1 21 21 GLN N N 21 121.790 121.790 121.111 0.679 26060 3010 1 5 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.946 0.284 26060 3011 1 5 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.145 0.185 26060 3012 1 5 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.217 -0.317 26060 3013 1 5 . 1 1 21 21 GLN H H 21 9.240 9.240 9.084 0.156 26060 3014 1 5 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.506 -0.876 26060 3015 1 5 . 1 1 22 22 VAL C C 22 176.500 176.500 175.505 0.995 26060 3016 1 5 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.983 3.047 26060 3017 1 5 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.690 -2.090 26060 3018 1 5 . 1 1 23 23 ARG N N 23 127.840 127.840 127.211 0.629 26060 3019 1 5 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.558 -0.428 26060 3020 1 5 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.365 1.235 26060 3021 1 5 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.893 1.256 26060 3022 1 5 . 1 1 23 23 ARG H H 23 8.720 8.720 8.403 0.317 26060 3023 1 5 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.194 -0.154 26060 3024 1 5 . 1 1 24 24 LYS C C 24 176.960 176.960 176.038 0.922 26060 3025 1 5 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.593 1.207 26060 3026 1 5 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.416 -0.356 26060 3027 1 5 . 1 1 25 25 LYS N N 25 115.870 115.870 118.499 -2.629 26060 3028 1 5 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.641 0.189 26060 3029 1 5 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.334 -0.374 26060 3030 1 5 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.822 1.258 26060 3031 1 5 . 1 1 25 25 LYS H H 25 7.720 7.720 7.438 0.282 26060 3032 1 5 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.675 0.155 26060 3033 1 5 . 1 1 26 26 PRO C C 26 177.400 177.400 176.826 0.574 26060 3034 1 5 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.665 -0.015 26060 3035 1 5 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.536 -0.146 26060 3036 1 5 . 1 1 27 27 THR N N 27 111.270 111.270 114.769 -3.499 26060 3037 1 5 . 1 1 27 27 THR HA H 27 4.530 4.530 4.231 0.299 26060 3038 1 5 . 1 1 27 27 THR C C 27 177.300 177.300 176.920 0.380 26060 3039 1 5 . 1 1 27 27 THR CA C 27 61.300 61.300 61.124 0.176 26060 3040 1 5 . 1 1 27 27 THR CB C 27 71.460 71.460 69.999 1.462 26060 3041 1 5 . 1 1 27 27 THR H H 27 8.380 8.380 8.147 0.233 26060 3042 1 5 . 1 1 28 28 VAL N N 28 121.170 121.170 122.482 -1.312 26060 3043 1 5 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.801 0.082 26060 3044 1 5 . 1 1 28 28 VAL C C 28 177.030 177.030 176.025 1.005 26060 3045 1 5 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.112 0.088 26060 3046 1 5 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.651 -0.251 26060 3047 1 5 . 1 1 28 28 VAL H H 28 8.910 8.910 8.534 0.376 26060 3048 1 5 . 1 1 29 29 GLU N N 29 116.800 116.800 116.904 -0.104 26060 3049 1 5 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.184 -0.264 26060 3050 1 5 . 1 1 29 29 GLU C C 29 176.200 176.200 175.794 0.406 26060 3051 1 5 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.309 1.941 26060 3052 1 5 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.381 -1.211 26060 3053 1 5 . 1 1 29 29 GLU H H 29 7.990 7.990 7.947 0.043 26060 3054 1 5 . 1 1 30 30 GLY N N 30 105.500 105.500 107.796 -2.296 26060 3055 1 5 . 1 1 30 30 GLY C C 30 174.900 174.900 173.899 1.001 26060 3056 1 5 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.234 -0.774 26060 3057 1 5 . 1 1 30 30 GLY H H 30 7.950 7.950 7.872 0.078 26060 3058 1 5 . 1 1 31 31 PHE N N 31 119.300 119.300 118.960 0.340 26060 3059 1 5 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.922 -0.162 26060 3060 1 5 . 1 1 31 31 PHE C C 31 176.400 176.400 175.972 0.428 26060 3061 1 5 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.513 1.387 26060 3062 1 5 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.261 -3.761 26060 3063 1 5 . 1 1 31 31 PHE H H 31 7.520 7.520 7.399 0.121 26060 3064 1 5 . 1 1 32 32 THR N N 32 112.300 112.300 116.629 -4.329 26060 3065 1 5 . 1 1 32 32 THR HA H 32 4.330 4.330 4.434 -0.104 26060 3066 1 5 . 1 1 32 32 THR C C 32 175.200 175.200 174.341 0.859 26060 3067 1 5 . 1 1 32 32 THR CA C 32 62.780 62.780 62.979 -0.199 26060 3068 1 5 . 1 1 32 32 THR CB C 32 70.350 70.350 69.865 0.485 26060 3069 1 5 . 1 1 32 32 THR H H 32 7.770 7.770 9.245 -1.475 26060 3070 1 5 . 1 1 33 33 HIS N N 33 121.900 121.900 121.880 0.020 26060 3071 1 5 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.329 0.171 26060 3072 1 5 . 1 1 33 33 HIS C C 33 173.880 173.880 173.596 0.284 26060 3073 1 5 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.402 0.378 26060 3074 1 5 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.444 3.196 26060 3075 1 5 . 1 1 33 33 HIS H H 33 9.110 9.110 8.805 0.305 26060 3076 1 5 . 1 1 34 34 ASP N N 34 120.300 120.300 124.883 -4.583 26060 3077 1 5 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.419 -0.019 26060 3078 1 5 . 1 1 34 34 ASP C C 34 175.100 175.100 175.107 -0.007 26060 3079 1 5 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.176 -0.866 26060 3080 1 5 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.341 -0.241 26060 3081 1 5 . 1 1 34 34 ASP H H 34 8.810 8.810 9.020 -0.210 26060 3082 1 5 . 1 1 35 35 TRP N N 35 119.800 119.800 121.140 -1.340 26060 3083 1 5 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.547 0.183 26060 3084 1 5 . 1 1 35 35 TRP C C 35 174.900 174.900 173.298 1.602 26060 3085 1 5 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.909 -0.009 26060 3086 1 5 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.102 1.968 26060 3087 1 5 . 1 1 35 35 TRP H H 35 9.250 9.250 8.918 0.332 26060 3088 1 5 . 1 1 36 36 MET N N 36 120.980 120.980 121.809 -0.829 26060 3089 1 5 . 1 1 36 36 MET HA H 36 5.750 5.750 5.929 -0.179 26060 3090 1 5 . 1 1 36 36 MET C C 36 173.700 173.700 174.319 -0.619 26060 3091 1 5 . 1 1 36 36 MET CA C 36 54.830 54.830 54.238 0.592 26060 3092 1 5 . 1 1 36 36 MET CB C 36 35.220 35.220 36.762 -1.542 26060 3093 1 5 . 1 1 36 36 MET H H 36 9.080 9.080 8.698 0.382 26060 3094 1 5 . 1 1 37 37 VAL N N 37 126.220 126.220 120.665 5.555 26060 3095 1 5 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.206 0.104 26060 3096 1 5 . 1 1 37 37 VAL C C 37 172.300 172.300 174.360 -2.060 26060 3097 1 5 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.752 -1.212 26060 3098 1 5 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.786 1.284 26060 3099 1 5 . 1 1 37 37 VAL H H 37 9.080 9.080 8.778 0.302 26060 3100 1 5 . 1 1 38 38 PHE N N 38 120.640 120.640 122.244 -1.604 26060 3101 1 5 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.361 0.609 26060 3102 1 5 . 1 1 38 38 PHE C C 38 172.960 172.960 175.296 -2.336 26060 3103 1 5 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.859 -0.729 26060 3104 1 5 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.219 -0.219 26060 3105 1 5 . 1 1 38 38 PHE H H 38 8.320 8.320 9.026 -0.706 26060 3106 1 5 . 1 1 39 39 VAL N N 39 116.500 116.500 120.581 -4.081 26060 3107 1 5 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.739 -0.729 26060 3108 1 5 . 1 1 39 39 VAL C C 39 174.700 174.700 174.462 0.238 26060 3109 1 5 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.121 1.519 26060 3110 1 5 . 1 1 39 39 VAL CB C 39 35.400 35.400 34.294 1.106 26060 3111 1 5 . 1 1 39 39 VAL H H 39 8.580 8.580 9.368 -0.788 26060 3112 1 5 . 1 1 40 40 ARG N N 40 124.100 124.100 124.605 -0.505 26060 3113 1 5 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.988 0.092 26060 3114 1 5 . 1 1 40 40 ARG C C 40 173.800 173.800 174.273 -0.473 26060 3115 1 5 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.721 -0.791 26060 3116 1 5 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.959 0.621 26060 3117 1 5 . 1 1 40 40 ARG H H 40 9.880 9.880 8.511 1.369 26060 3118 1 5 . 1 1 41 41 GLY N N 41 107.640 107.640 106.310 1.330 26060 3119 1 5 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.643 1.327 26060 3120 1 5 . 1 1 41 41 GLY H H 41 8.910 8.910 8.596 0.314 26060 3121 1 5 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.361 0.129 26060 3122 1 5 . 1 1 42 42 PRO C C 42 177.300 177.300 176.850 0.450 26060 3123 1 5 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.796 -0.356 26060 3124 1 5 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.450 -0.340 26060 3125 1 5 . 1 1 43 43 GLU N N 43 121.050 121.050 123.083 -2.033 26060 3126 1 5 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.942 -0.152 26060 3127 1 5 . 1 1 43 43 GLU C C 43 176.110 176.110 176.021 0.089 26060 3128 1 5 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.437 -0.587 26060 3129 1 5 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.546 -0.696 26060 3130 1 5 . 1 1 43 43 GLU H H 43 9.060 9.060 8.740 0.320 26060 3131 1 5 . 1 1 44 44 HIS N N 44 114.100 114.100 115.852 -1.752 26060 3132 1 5 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.318 0.033 26060 3133 1 5 . 1 1 44 44 HIS C C 44 175.170 175.170 174.873 0.297 26060 3134 1 5 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.976 0.674 26060 3135 1 5 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.733 -0.363 26060 3136 1 5 . 1 1 44 44 HIS H H 44 8.420 8.420 8.681 -0.261 26060 3137 1 5 . 1 1 45 45 SER N N 45 115.540 115.540 117.271 -1.731 26060 3138 1 5 . 1 1 45 45 SER HA H 45 4.560 4.560 4.795 -0.235 26060 3139 1 5 . 1 1 45 45 SER C C 45 173.700 173.700 174.350 -0.650 26060 3140 1 5 . 1 1 45 45 SER CA C 45 58.710 58.710 57.170 1.540 26060 3141 1 5 . 1 1 45 45 SER CB C 45 65.040 65.040 63.523 1.517 26060 3142 1 5 . 1 1 45 45 SER H H 45 7.870 7.870 7.782 0.088 26060 3143 1 5 . 1 1 46 46 ASN N N 46 123.900 123.900 123.422 0.478 26060 3144 1 5 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.668 0.452 26060 3145 1 5 . 1 1 46 46 ASN C C 46 176.300 176.300 175.796 0.504 26060 3146 1 5 . 1 1 46 46 ASN CA C 46 52.690 52.690 53.538 -0.848 26060 3147 1 5 . 1 1 46 46 ASN CB C 46 38.730 38.730 39.316 -0.586 26060 3148 1 5 . 1 1 46 46 ASN H H 46 9.480 9.480 8.485 0.995 26060 3149 1 5 . 1 1 47 47 ILE N N 47 115.240 115.240 116.277 -1.037 26060 3150 1 5 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.324 0.616 26060 3151 1 5 . 1 1 47 47 ILE C C 47 176.000 176.000 176.937 -0.937 26060 3152 1 5 . 1 1 47 47 ILE CA C 47 63.200 63.200 61.881 1.319 26060 3153 1 5 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.313 -1.613 26060 3154 1 5 . 1 1 47 47 ILE H H 47 8.170 8.170 8.251 -0.081 26060 3155 1 5 . 1 1 48 48 GLN N N 48 123.200 123.200 120.994 2.206 26060 3156 1 5 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.118 0.162 26060 3157 1 5 . 1 1 48 48 GLN C C 48 175.670 175.670 177.311 -1.641 26060 3158 1 5 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.974 -0.074 26060 3159 1 5 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.381 -0.391 26060 3160 1 5 . 1 1 48 48 GLN H H 48 8.850 8.850 8.610 0.240 26060 3161 1 5 . 1 1 49 49 HIS N N 49 115.400 115.400 117.250 -1.850 26060 3162 1 5 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.442 0.128 26060 3163 1 5 . 1 1 49 49 HIS C C 49 176.380 176.380 176.525 -0.145 26060 3164 1 5 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.660 0.090 26060 3165 1 5 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.721 0.899 26060 3166 1 5 . 1 1 49 49 HIS H H 49 7.400 7.400 7.690 -0.290 26060 3167 1 5 . 1 1 50 50 PHE N N 50 109.800 109.800 111.811 -2.011 26060 3168 1 5 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.859 0.371 26060 3169 1 5 . 1 1 50 50 PHE C C 50 173.800 173.800 174.275 -0.475 26060 3170 1 5 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.940 -0.280 26060 3171 1 5 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.728 1.272 26060 3172 1 5 . 1 1 50 50 PHE H H 50 7.570 7.570 7.558 0.012 26060 3173 1 5 . 1 1 51 51 VAL N N 51 127.810 127.810 119.997 7.813 26060 3174 1 5 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.886 -0.516 26060 3175 1 5 . 1 1 51 51 VAL C C 51 174.500 174.500 174.515 -0.015 26060 3176 1 5 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.436 1.564 26060 3177 1 5 . 1 1 51 51 VAL CB C 51 33.280 33.280 35.294 -2.014 26060 3178 1 5 . 1 1 51 51 VAL H H 51 7.810 7.810 7.974 -0.164 26060 3179 1 5 . 1 1 52 52 GLU N N 52 130.700 130.700 126.144 4.556 26060 3180 1 5 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.600 -0.620 26060 3181 1 5 . 1 1 52 52 GLU C C 52 175.400 175.400 175.444 -0.044 26060 3182 1 5 . 1 1 52 52 GLU CA C 52 58.100 58.100 56.727 1.373 26060 3183 1 5 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.811 -1.231 26060 3184 1 5 . 1 1 52 52 GLU H H 52 9.380 9.380 8.910 0.470 26060 3185 1 5 . 1 1 53 53 LYS N N 53 109.200 109.200 114.554 -5.354 26060 3186 1 5 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.033 -0.233 26060 3187 1 5 . 1 1 53 53 LYS C C 53 172.300 172.300 174.565 -2.265 26060 3188 1 5 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.456 0.384 26060 3189 1 5 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.085 -1.835 26060 3190 1 5 . 1 1 53 53 LYS H H 53 7.190 7.190 7.406 -0.216 26060 3191 1 5 . 1 1 54 54 VAL N N 54 120.380 120.380 117.607 2.773 26060 3192 1 5 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.629 0.141 26060 3193 1 5 . 1 1 54 54 VAL C C 54 173.600 173.600 173.839 -0.239 26060 3194 1 5 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.474 -0.434 26060 3195 1 5 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.689 -1.989 26060 3196 1 5 . 1 1 54 54 VAL H H 54 8.450 8.450 8.280 0.170 26060 3197 1 5 . 1 1 55 55 VAL N N 55 126.920 126.920 122.883 4.037 26060 3198 1 5 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.208 -0.508 26060 3199 1 5 . 1 1 55 55 VAL C C 55 173.800 173.800 173.826 -0.026 26060 3200 1 5 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.664 0.206 26060 3201 1 5 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.945 -2.845 26060 3202 1 5 . 1 1 55 55 VAL H H 55 9.260 9.260 9.025 0.235 26060 3203 1 5 . 1 1 56 56 PHE N N 56 126.130 126.130 123.946 2.184 26060 3204 1 5 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.029 -0.339 26060 3205 1 5 . 1 1 56 56 PHE C C 56 174.000 174.000 174.370 -0.370 26060 3206 1 5 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.680 -0.100 26060 3207 1 5 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.461 -1.571 26060 3208 1 5 . 1 1 56 56 PHE H H 56 9.290 9.290 9.209 0.081 26060 3209 1 5 . 1 1 57 57 HIS N N 57 124.180 124.180 124.279 -0.099 26060 3210 1 5 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.956 -0.156 26060 3211 1 5 . 1 1 57 57 HIS C C 57 174.700 174.700 174.935 -0.235 26060 3212 1 5 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.156 0.164 26060 3213 1 5 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.921 1.179 26060 3214 1 5 . 1 1 57 57 HIS H H 57 8.690 8.690 8.471 0.219 26060 3215 1 5 . 1 1 58 58 LEU N N 58 122.050 122.050 123.177 -1.127 26060 3216 1 5 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.348 -0.108 26060 3217 1 5 . 1 1 58 58 LEU C C 58 174.400 174.400 176.934 -2.534 26060 3218 1 5 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.940 0.470 26060 3219 1 5 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.401 -1.242 26060 3220 1 5 . 1 1 58 58 LEU H H 58 9.050 9.050 8.232 0.818 26060 3221 1 5 . 1 1 59 59 HIS N N 59 118.510 118.510 117.686 0.824 26060 3222 1 5 . 1 1 59 59 HIS C C 59 175.300 175.300 176.965 -1.665 26060 3223 1 5 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.327 2.783 26060 3224 1 5 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.269 -0.339 26060 3225 1 5 . 1 1 59 59 HIS H H 59 5.160 5.160 7.851 -2.691 26060 3226 1 5 . 1 1 60 60 GLU N N 60 122.190 122.190 122.912 -0.722 26060 3227 1 5 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.122 -0.162 26060 3228 1 5 . 1 1 60 60 GLU C C 60 175.130 175.130 177.504 -2.374 26060 3229 1 5 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.441 -0.431 26060 3230 1 5 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.910 -0.090 26060 3231 1 5 . 1 1 60 60 GLU H H 60 7.960 7.960 8.823 -0.863 26060 3232 1 5 . 1 1 61 61 SER N N 61 116.940 116.940 114.135 2.805 26060 3233 1 5 . 1 1 61 61 SER HA H 61 4.200 4.200 4.315 -0.115 26060 3234 1 5 . 1 1 61 61 SER CA C 61 60.010 60.010 59.916 0.094 26060 3235 1 5 . 1 1 61 61 SER CB C 61 63.140 63.140 63.292 -0.152 26060 3236 1 5 . 1 1 61 61 SER H H 61 8.540 8.540 8.434 0.106 26060 3237 1 5 . 1 1 62 62 PHE N N 62 123.700 123.700 121.188 2.512 26060 3238 1 5 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.593 -0.043 26060 3239 1 5 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.560 2.380 26060 3240 1 5 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.852 -0.452 26060 3241 1 5 . 1 1 62 62 PHE H H 62 8.640 8.640 8.116 0.524 26060 3242 1 5 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.494 -0.084 26060 3243 1 5 . 1 1 63 63 PRO C C 63 176.400 176.400 176.484 -0.084 26060 3244 1 5 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.020 -0.420 26060 3245 1 5 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.043 -0.183 26060 3246 1 5 . 1 1 64 64 ARG N N 64 116.840 116.840 120.127 -3.287 26060 3247 1 5 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.104 -0.004 26060 3248 1 5 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.113 -0.503 26060 3249 1 5 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.817 0.013 26060 3250 1 5 . 1 1 64 64 ARG H H 64 8.890 8.890 8.728 0.162 26060 3251 1 5 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.380 -0.390 26060 3252 1 5 . 1 1 65 65 PRO C C 65 175.800 175.800 177.049 -1.249 26060 3253 1 5 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.103 1.706 26060 3254 1 5 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.989 -0.109 26060 3255 1 5 . 1 1 66 66 LYS N N 66 119.035 119.035 119.874 -0.839 26060 3256 1 5 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.142 -0.532 26060 3257 1 5 . 1 1 66 66 LYS C C 66 175.400 175.400 175.858 -0.458 26060 3258 1 5 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.065 0.388 26060 3259 1 5 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.189 -0.459 26060 3260 1 5 . 1 1 66 66 LYS H H 66 7.630 7.630 7.832 -0.202 26060 3261 1 5 . 1 1 67 67 ARG N N 67 127.394 127.394 127.272 0.122 26060 3262 1 5 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.627 0.113 26060 3263 1 5 . 1 1 67 67 ARG C C 67 174.500 174.500 174.858 -0.358 26060 3264 1 5 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.988 -0.188 26060 3265 1 5 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.546 -1.832 26060 3266 1 5 . 1 1 67 67 ARG H H 67 8.855 8.855 8.618 0.237 26060 3267 1 5 . 1 1 68 68 VAL N N 68 124.388 124.388 120.004 4.384 26060 3268 1 5 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.179 -0.599 26060 3269 1 5 . 1 1 68 68 VAL C C 68 176.850 176.850 175.404 1.446 26060 3270 1 5 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.763 2.310 26060 3271 1 5 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.732 -0.128 26060 3272 1 5 . 1 1 68 68 VAL H H 68 8.681 8.681 8.396 0.285 26060 3273 1 5 . 1 1 69 69 CYS N N 69 127.080 127.080 126.219 0.861 26060 3274 1 5 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.752 0.318 26060 3275 1 5 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.614 0.732 26060 3276 1 5 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.043 0.727 26060 3277 1 5 . 1 1 69 69 CYS H H 69 9.455 9.455 9.066 0.389 26060 3278 1 5 . 1 1 70 70 LYS N N 70 125.480 125.480 122.723 2.757 26060 3279 1 5 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.509 -0.019 26060 3280 1 5 . 1 1 70 70 LYS C C 70 174.300 174.300 175.587 -1.287 26060 3281 1 5 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.604 1.156 26060 3282 1 5 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.557 -0.388 26060 3283 1 5 . 1 1 70 70 LYS H H 70 9.050 9.050 8.708 0.342 26060 3284 1 5 . 1 1 71 71 ASP N N 71 116.940 116.940 120.102 -3.162 26060 3285 1 5 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.875 0.225 26060 3286 1 5 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.792 -0.712 26060 3287 1 5 . 1 1 71 71 ASP CB C 71 43.380 43.380 40.878 2.502 26060 3288 1 5 . 1 1 71 71 ASP H H 71 7.620 7.620 7.534 0.086 26060 3289 1 5 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.131 -0.871 26060 3290 1 5 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.883 -2.233 26060 3291 1 5 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.155 -1.115 26060 3292 1 5 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.148 -0.048 26060 3293 1 5 . 1 1 73 73 PRO C C 73 174.700 174.700 175.869 -1.169 26060 3294 1 5 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.329 -2.639 26060 3295 1 5 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.280 2.760 26060 3296 1 5 . 1 1 74 74 TYR N N 74 125.400 125.400 124.704 0.696 26060 3297 1 5 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.469 0.381 26060 3298 1 5 . 1 1 74 74 TYR C C 74 172.900 172.900 175.385 -2.485 26060 3299 1 5 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.917 -2.247 26060 3300 1 5 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.188 -3.788 26060 3301 1 5 . 1 1 74 74 TYR H H 74 8.960 8.960 8.329 0.631 26060 3302 1 5 . 1 1 75 75 LYS N N 75 121.400 121.400 119.800 1.600 26060 3303 1 5 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.100 0.490 26060 3304 1 5 . 1 1 75 75 LYS C C 75 173.800 173.800 174.497 -0.697 26060 3305 1 5 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.716 -0.066 26060 3306 1 5 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.658 -0.768 26060 3307 1 5 . 1 1 75 75 LYS H H 75 7.670 7.670 7.941 -0.271 26060 3308 1 5 . 1 1 76 76 VAL N N 76 119.800 119.800 121.745 -1.945 26060 3309 1 5 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.142 -0.252 26060 3310 1 5 . 1 1 76 76 VAL C C 76 173.900 173.900 174.577 -0.677 26060 3311 1 5 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.325 1.405 26060 3312 1 5 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.705 0.835 26060 3313 1 5 . 1 1 76 76 VAL H H 76 8.180 8.180 7.807 0.373 26060 3314 1 5 . 1 1 77 77 GLU N N 77 126.190 126.190 127.920 -1.730 26060 3315 1 5 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.885 0.065 26060 3316 1 5 . 1 1 77 77 GLU C C 77 174.700 174.700 175.330 -0.630 26060 3317 1 5 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.225 -0.285 26060 3318 1 5 . 1 1 77 77 GLU CB C 77 31.550 31.550 30.962 0.588 26060 3319 1 5 . 1 1 77 77 GLU H H 77 8.270 8.270 8.678 -0.408 26060 3320 1 5 . 1 1 78 78 GLU N N 78 126.180 126.180 123.652 2.528 26060 3321 1 5 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.595 -0.145 26060 3322 1 5 . 1 1 78 78 GLU C C 78 175.400 175.400 174.016 1.384 26060 3323 1 5 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.208 -0.166 26060 3324 1 5 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.074 3.026 26060 3325 1 5 . 1 1 78 78 GLU H H 78 7.870 7.870 8.601 -0.731 26060 3326 1 5 . 1 1 79 79 SER N N 79 112.109 112.109 113.345 -1.236 26060 3327 1 5 . 1 1 79 79 SER HA H 79 5.560 5.560 5.302 0.258 26060 3328 1 5 . 1 1 79 79 SER C C 79 172.490 172.490 173.137 -0.647 26060 3329 1 5 . 1 1 79 79 SER CA C 79 57.754 57.754 56.697 1.057 26060 3330 1 5 . 1 1 79 79 SER CB C 79 65.861 65.861 65.219 0.642 26060 3331 1 5 . 1 1 79 79 SER H H 79 7.714 7.714 8.291 -0.577 26060 3332 1 5 . 1 1 80 80 GLY N N 80 106.048 106.048 111.162 -5.114 26060 3333 1 5 . 1 1 80 80 GLY C C 80 172.630 172.630 172.030 0.600 26060 3334 1 5 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.496 1.074 26060 3335 1 5 . 1 1 80 80 GLY H H 80 8.828 8.828 9.028 -0.200 26060 3336 1 5 . 1 1 81 81 TYR N N 81 115.280 115.280 113.998 1.282 26060 3337 1 5 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.373 0.307 26060 3338 1 5 . 1 1 81 81 TYR C C 81 174.100 174.100 174.312 -0.212 26060 3339 1 5 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.039 -1.539 26060 3340 1 5 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.851 1.489 26060 3341 1 5 . 1 1 81 81 TYR H H 81 8.770 8.770 8.089 0.681 26060 3342 1 5 . 1 1 82 82 ALA N N 82 122.350 122.350 122.323 0.027 26060 3343 1 5 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.507 -0.107 26060 3344 1 5 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.676 0.364 26060 3345 1 5 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.020 1.380 26060 3346 1 5 . 1 1 82 82 ALA H H 82 7.160 7.160 7.286 -0.126 26060 3347 1 5 . 1 1 83 83 GLY N N 83 107.100 107.100 106.449 0.651 26060 3348 1 5 . 1 1 83 83 GLY C C 83 172.500 172.500 173.710 -1.210 26060 3349 1 5 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.129 0.481 26060 3350 1 5 . 1 1 83 83 GLY H H 83 8.220 8.220 8.289 -0.069 26060 3351 1 5 . 1 1 84 84 PHE N N 84 111.660 111.660 114.745 -3.085 26060 3352 1 5 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.578 0.112 26060 3353 1 5 . 1 1 84 84 PHE C C 84 172.460 172.460 173.532 -1.072 26060 3354 1 5 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.898 -0.398 26060 3355 1 5 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.551 -0.971 26060 3356 1 5 . 1 1 84 84 PHE H H 84 7.700 7.700 8.401 -0.701 26060 3357 1 5 . 1 1 85 85 ILE N N 85 117.810 117.810 122.112 -4.302 26060 3358 1 5 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.101 0.209 26060 3359 1 5 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.833 -1.493 26060 3360 1 5 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.149 -1.889 26060 3361 1 5 . 1 1 85 85 ILE H H 85 8.340 8.340 8.525 -0.185 26060 3362 1 5 . 1 1 86 86 LEU N N 86 108.130 108.130 129.433 -21.303 26060 3363 1 5 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.024 -0.044 26060 3364 1 5 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.818 2.382 26060 3365 1 5 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.497 -0.197 26060 3366 1 5 . 1 1 86 86 LEU H H 86 9.900 9.900 8.811 1.089 26060 3367 1 5 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.475 0.625 26060 3368 1 5 . 1 1 87 87 PRO C C 87 175.340 175.340 175.844 -0.504 26060 3369 1 5 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.885 0.225 26060 3370 1 5 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.520 1.040 26060 3371 1 5 . 1 1 88 88 ILE N N 88 126.000 126.000 126.054 -0.054 26060 3372 1 5 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.310 0.480 26060 3373 1 5 . 1 1 88 88 ILE C C 88 176.100 176.100 175.132 0.968 26060 3374 1 5 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.532 0.028 26060 3375 1 5 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.848 2.152 26060 3376 1 5 . 1 1 88 88 ILE H H 88 9.380 9.380 8.724 0.656 26060 3377 1 5 . 1 1 89 89 GLU N N 89 123.900 123.900 124.916 -1.016 26060 3378 1 5 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.299 -0.099 26060 3379 1 5 . 1 1 89 89 GLU C C 89 173.800 173.800 175.569 -1.769 26060 3380 1 5 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.359 -0.389 26060 3381 1 5 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.586 0.794 26060 3382 1 5 . 1 1 89 89 GLU H H 89 9.320 9.320 8.916 0.404 26060 3383 1 5 . 1 1 90 90 VAL N N 90 123.980 123.980 123.268 0.712 26060 3384 1 5 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.141 0.019 26060 3385 1 5 . 1 1 90 90 VAL C C 90 174.800 174.800 174.534 0.266 26060 3386 1 5 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.136 0.854 26060 3387 1 5 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.185 -0.695 26060 3388 1 5 . 1 1 90 90 VAL H H 90 8.630 8.630 8.654 -0.024 26060 3389 1 5 . 1 1 91 91 TYR N N 91 124.230 124.230 126.538 -2.308 26060 3390 1 5 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.608 0.052 26060 3391 1 5 . 1 1 91 91 TYR C C 91 176.800 176.800 175.592 1.208 26060 3392 1 5 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.241 -0.541 26060 3393 1 5 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.867 1.373 26060 3394 1 5 . 1 1 91 91 TYR H H 91 8.640 8.640 9.044 -0.404 26060 3395 1 5 . 1 1 92 92 PHE N N 92 121.200 121.200 122.417 -1.217 26060 3396 1 5 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.231 0.429 26060 3397 1 5 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.101 1.409 26060 3398 1 5 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.950 0.750 26060 3399 1 5 . 1 1 92 92 PHE H H 92 8.750 8.750 8.850 -0.100 26060 3400 1 5 . 1 1 93 93 LYS N N 93 123.450 123.450 123.317 0.133 26060 3401 1 5 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.598 0.002 26060 3402 1 5 . 1 1 93 93 LYS C C 93 174.200 174.200 174.623 -0.423 26060 3403 1 5 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.791 -0.611 26060 3404 1 5 . 1 1 93 93 LYS CB C 93 31.680 31.680 31.966 -0.286 26060 3405 1 5 . 1 1 93 93 LYS H H 93 8.560 8.560 8.897 -0.337 26060 3406 1 5 . 1 1 94 94 ASN N N 94 118.800 118.800 120.035 -1.235 26060 3407 1 5 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.739 -0.299 26060 3408 1 5 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.161 -0.951 26060 3409 1 5 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.311 -0.511 26060 3410 1 5 . 1 1 94 94 ASN H H 94 7.820 7.820 7.848 -0.028 26060 3411 1 5 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.371 -0.041 26060 3412 1 5 . 1 1 95 95 LYS C C 95 175.800 175.800 175.922 -0.122 26060 3413 1 5 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.086 0.124 26060 3414 1 5 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.188 -0.178 26060 3415 1 5 . 1 1 96 96 GLU N N 96 118.330 118.330 120.840 -2.510 26060 3416 1 5 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.293 0.217 26060 3417 1 5 . 1 1 96 96 GLU C C 96 173.200 173.200 175.707 -2.507 26060 3418 1 5 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.301 -1.201 26060 3419 1 5 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.128 2.342 26060 3420 1 5 . 1 1 96 96 GLU H H 96 7.120 7.120 7.630 -0.510 26060 3421 1 5 . 1 1 97 97 GLU N N 97 115.630 115.630 119.964 -4.334 26060 3422 1 5 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.178 0.252 26060 3423 1 5 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.751 -0.891 26060 3424 1 5 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.517 0.753 26060 3425 1 5 . 1 1 97 97 GLU H H 97 8.060 8.060 8.269 -0.209 26060 3426 1 5 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.231 0.769 26060 3427 1 5 . 1 1 98 98 PRO C C 98 175.900 175.900 176.290 -0.390 26060 3428 1 5 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.037 -1.877 26060 3429 1 5 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.139 1.861 26060 3430 1 5 . 1 1 99 99 ARG N N 99 122.800 122.800 119.280 3.520 26060 3431 1 5 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.432 0.198 26060 3432 1 5 . 1 1 99 99 ARG C C 99 175.800 175.800 176.141 -0.341 26060 3433 1 5 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.658 -0.168 26060 3434 1 5 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.617 -0.207 26060 3435 1 5 . 1 1 99 99 ARG H H 99 8.602 8.602 8.650 -0.048 26060 3436 1 5 . 1 1 100 100 LYS N N 100 113.220 113.220 116.913 -3.693 26060 3437 1 5 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.721 0.219 26060 3438 1 5 . 1 1 100 100 LYS C C 100 174.100 174.100 174.467 -0.367 26060 3439 1 5 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.167 -0.257 26060 3440 1 5 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.893 -1.173 26060 3441 1 5 . 1 1 100 100 LYS H H 100 7.650 7.650 7.285 0.365 26060 3442 1 5 . 1 1 101 101 VAL N N 101 116.230 116.230 121.697 -5.467 26060 3443 1 5 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.162 0.108 26060 3444 1 5 . 1 1 101 101 VAL C C 101 171.600 171.600 173.574 -1.974 26060 3445 1 5 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.303 0.957 26060 3446 1 5 . 1 1 101 101 VAL CB C 101 35.180 35.180 34.998 0.182 26060 3447 1 5 . 1 1 101 101 VAL H H 101 8.120 8.120 8.328 -0.208 26060 3448 1 5 . 1 1 102 102 ARG N N 102 124.980 124.980 128.464 -3.484 26060 3449 1 5 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.893 0.267 26060 3450 1 5 . 1 1 102 102 ARG C C 102 174.340 174.340 175.259 -0.919 26060 3451 1 5 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.775 -1.025 26060 3452 1 5 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.401 1.948 26060 3453 1 5 . 1 1 102 102 ARG H H 102 7.930 7.930 8.317 -0.387 26060 3454 1 5 . 1 1 103 103 PHE N N 103 124.590 124.590 127.107 -2.517 26060 3455 1 5 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.766 0.026 26060 3456 1 5 . 1 1 103 103 PHE C C 103 174.280 174.280 174.930 -0.650 26060 3457 1 5 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.715 1.265 26060 3458 1 5 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.960 2.290 26060 3459 1 5 . 1 1 103 103 PHE H H 103 9.390 9.390 9.172 0.218 26060 3460 1 5 . 1 1 104 104 ASP N N 104 124.700 124.700 126.921 -2.221 26060 3461 1 5 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.724 0.075 26060 3462 1 5 . 1 1 104 104 ASP C C 104 174.500 174.500 175.200 -0.700 26060 3463 1 5 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.867 -0.477 26060 3464 1 5 . 1 1 104 104 ASP CB C 104 40.230 40.230 40.063 0.167 26060 3465 1 5 . 1 1 104 104 ASP H H 104 9.010 9.010 9.074 -0.064 26060 3466 1 5 . 1 1 105 105 TYR N N 105 129.840 129.840 124.904 4.936 26060 3467 1 5 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.507 -0.407 26060 3468 1 5 . 1 1 105 105 TYR C C 105 173.100 173.100 173.495 -0.395 26060 3469 1 5 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.541 1.139 26060 3470 1 5 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.634 1.216 26060 3471 1 5 . 1 1 105 105 TYR H H 105 8.140 8.140 8.247 -0.107 26060 3472 1 5 . 1 1 106 106 ASP N N 106 126.800 126.800 127.713 -0.913 26060 3473 1 5 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.345 -0.125 26060 3474 1 5 . 1 1 106 106 ASP C C 106 172.900 172.900 174.497 -1.597 26060 3475 1 5 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.781 -0.271 26060 3476 1 5 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.221 -1.721 26060 3477 1 5 . 1 1 106 106 ASP H H 106 7.730 7.730 8.262 -0.532 26060 3478 1 5 . 1 1 107 107 LEU N N 107 132.150 132.150 128.251 3.899 26060 3479 1 5 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.494 -0.654 26060 3480 1 5 . 1 1 107 107 LEU C C 107 172.100 172.100 174.789 -2.689 26060 3481 1 5 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.690 0.010 26060 3482 1 5 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.944 -1.704 26060 3483 1 5 . 1 1 107 107 LEU H H 107 7.770 7.770 7.769 0.001 26060 3484 1 5 . 1 1 108 108 PHE N N 108 118.960 118.960 121.935 -2.975 26060 3485 1 5 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.941 -0.251 26060 3486 1 5 . 1 1 108 108 PHE C C 108 174.300 174.300 173.556 0.744 26060 3487 1 5 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.275 -0.585 26060 3488 1 5 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.179 -0.889 26060 3489 1 5 . 1 1 108 108 PHE H H 108 6.060 6.060 7.212 -1.152 26060 3490 1 5 . 1 1 109 109 LEU N N 109 118.900 118.900 122.151 -3.251 26060 3491 1 5 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.812 -0.412 26060 3492 1 5 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.180 -1.020 26060 3493 1 5 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.730 -1.650 26060 3494 1 5 . 1 1 109 109 LEU H H 109 8.388 8.388 8.321 0.067 26060 3495 1 5 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.447 -0.007 26060 3496 1 5 . 1 1 111 111 LEU C C 111 177.300 177.300 176.953 0.347 26060 3497 1 5 . 1 1 111 111 LEU CA C 111 54.220 54.220 54.771 -0.551 26060 3498 1 5 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.797 1.073 26060 3499 1 5 . 1 1 112 112 GLU N N 112 120.660 120.660 123.213 -2.553 26060 3500 1 5 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.073 0.097 26060 3501 1 5 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.462 -0.002 26060 3502 1 5 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.973 -0.283 26060 3503 1 5 . 1 1 112 112 GLU H H 112 8.780 8.780 8.740 0.040 26060 3504 1 5 . 1 1 113 113 GLY C C 113 173.900 173.900 173.594 0.306 26060 3505 1 5 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.758 0.192 26060 3506 1 5 . 1 1 114 114 HIS N N 114 120.890 120.890 120.548 0.342 26060 3507 1 5 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.018 -0.112 26060 3508 1 5 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.068 0.702 26060 3509 1 5 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.493 -0.903 26060 3510 1 5 . 1 1 114 114 HIS H H 114 7.934 7.934 7.857 0.076 26060 3511 1 5 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.113 -0.313 26060 3512 1 5 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.839 1.251 26060 3513 1 5 . 1 1 115 115 PRO CB C 115 30.680 30.680 32.115 -1.435 26060 3514 1 5 . 1 1 116 116 PRO C C 116 176.600 176.600 175.505 1.095 26060 3515 1 5 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.210 0.090 26060 3516 1 5 . 1 1 117 117 VAL N N 117 127.480 127.480 125.745 1.735 26060 3517 1 5 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.297 -0.507 26060 3518 1 5 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.932 0.768 26060 3519 1 5 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.400 -0.200 26060 3520 1 5 . 1 1 117 117 VAL H H 117 8.890 8.890 7.896 0.994 26060 3521 1 5 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.984 0.006 26060 3522 1 5 . 1 1 118 118 ASN C C 118 172.700 172.700 173.594 -0.894 26060 3523 1 5 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.400 -0.040 26060 3524 1 5 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.986 -0.786 26060 3525 1 5 . 1 1 119 119 HIS N N 119 124.930 124.930 125.928 -0.998 26060 3526 1 5 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.072 -0.252 26060 3527 1 5 . 1 1 119 119 HIS C C 119 173.500 173.500 172.808 0.692 26060 3528 1 5 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.113 1.857 26060 3529 1 5 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.058 0.612 26060 3530 1 5 . 1 1 119 119 HIS H H 119 8.790 8.790 9.027 -0.237 26060 3531 1 5 . 1 1 120 120 LEU N N 120 128.280 128.280 124.002 4.278 26060 3532 1 5 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.089 -0.139 26060 3533 1 5 . 1 1 120 120 LEU C C 120 174.030 174.030 175.007 -0.977 26060 3534 1 5 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.730 0.710 26060 3535 1 5 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.370 0.230 26060 3536 1 5 . 1 1 120 120 LEU H H 120 7.460 7.460 8.182 -0.722 26060 3537 1 5 . 1 1 121 121 ARG N N 121 128.060 128.060 121.298 6.762 26060 3538 1 5 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.662 -0.022 26060 3539 1 5 . 1 1 121 121 ARG C C 121 173.400 173.400 173.410 -0.010 26060 3540 1 5 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.620 -0.260 26060 3541 1 5 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.074 2.186 26060 3542 1 5 . 1 1 121 121 ARG H H 121 9.860 9.860 9.130 0.730 26060 3543 1 5 . 1 1 122 122 CYS N N 122 125.290 125.290 122.207 3.083 26060 3544 1 5 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.119 -0.099 26060 3545 1 5 . 1 1 122 122 CYS C C 122 174.600 174.600 174.632 -0.032 26060 3546 1 5 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.107 1.183 26060 3547 1 5 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.756 -1.726 26060 3548 1 5 . 1 1 122 122 CYS H H 122 8.835 8.835 8.663 0.172 26060 3549 1 5 . 1 1 123 123 GLU N N 123 125.920 125.920 126.300 -0.380 26060 3550 1 5 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.545 0.135 26060 3551 1 5 . 1 1 123 123 GLU C C 123 174.500 174.500 174.608 -0.108 26060 3552 1 5 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.720 -0.300 26060 3553 1 5 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.332 0.251 26060 3554 1 5 . 1 1 123 123 GLU H H 123 8.970 8.970 9.086 -0.116 26060 3555 1 5 . 1 1 124 124 LYS N N 124 121.837 121.837 123.281 -1.444 26060 3556 1 5 . 1 1 124 124 LYS HA H 124 4.960 4.960 5.058 -0.098 26060 3557 1 5 . 1 1 124 124 LYS C C 124 175.700 175.700 175.557 0.143 26060 3558 1 5 . 1 1 124 124 LYS CA C 124 55.357 55.357 54.855 0.502 26060 3559 1 5 . 1 1 124 124 LYS CB C 124 34.189 34.189 35.046 -0.857 26060 3560 1 5 . 1 1 124 124 LYS H H 124 8.652 8.652 8.408 0.244 26060 3561 1 5 . 1 1 125 125 LEU N N 125 127.000 127.000 128.576 -1.576 26060 3562 1 5 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.630 0.020 26060 3563 1 5 . 1 1 125 125 LEU C C 125 175.110 175.110 175.286 -0.176 26060 3564 1 5 . 1 1 125 125 LEU CA C 125 53.854 53.854 54.038 -0.184 26060 3565 1 5 . 1 1 125 125 LEU CB C 125 44.267 44.267 44.328 -0.061 26060 3566 1 5 . 1 1 125 125 LEU H H 125 9.175 9.175 9.293 -0.118 26060 3567 1 5 . 1 1 126 126 THR N N 126 117.779 117.779 119.448 -1.669 26060 3568 1 5 . 1 1 126 126 THR HA H 126 4.650 4.650 4.674 -0.024 26060 3569 1 5 . 1 1 126 126 THR C C 126 173.200 173.200 173.518 -0.318 26060 3570 1 5 . 1 1 126 126 THR CA C 126 62.036 62.036 61.346 0.690 26060 3571 1 5 . 1 1 126 126 THR CB C 126 70.284 70.284 69.430 0.854 26060 3572 1 5 . 1 1 126 126 THR H H 126 8.331 8.331 8.353 -0.022 26060 3573 1 5 . 1 1 127 127 PHE N N 127 126.576 126.576 126.812 -0.236 26060 3574 1 5 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.652 -0.062 26060 3575 1 5 . 1 1 127 127 PHE C C 127 174.860 174.860 174.676 0.184 26060 3576 1 5 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.755 0.109 26060 3577 1 5 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.751 -0.751 26060 3578 1 5 . 1 1 127 127 PHE H H 127 9.051 9.051 9.035 0.016 26060 3579 1 5 . 1 1 128 128 ASN N N 128 123.040 123.040 124.156 -1.116 26060 3580 1 5 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.611 0.009 26060 3581 1 5 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.954 0.526 26060 3582 1 5 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.938 0.522 26060 3583 1 5 . 1 1 128 128 ASN H H 128 8.880 8.880 8.751 0.129 26060 3584 1 5 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.590 0.170 26060 3585 1 5 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.227 -0.327 26060 3586 1 5 . 1 1 129 129 ASN CB C 129 38.730 38.730 38.313 0.417 26060 3587 1 5 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.669 0.121 26060 3588 1 5 . 1 1 130 130 PRO C C 130 177.470 177.470 176.163 1.307 26060 3589 1 5 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.332 0.242 26060 3590 1 5 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.006 -0.696 26060 3591 1 5 . 1 1 131 131 THR N N 131 113.400 113.400 113.743 -0.343 26060 3592 1 5 . 1 1 131 131 THR HA H 131 4.300 4.300 4.211 0.089 26060 3593 1 5 . 1 1 131 131 THR C C 131 175.200 175.200 175.939 -0.739 26060 3594 1 5 . 1 1 131 131 THR CA C 131 62.200 62.200 62.627 -0.427 26060 3595 1 5 . 1 1 131 131 THR CB C 131 70.600 70.600 70.309 0.291 26060 3596 1 5 . 1 1 131 131 THR H H 131 8.950 8.950 8.223 0.727 26060 3597 1 5 . 1 1 132 132 GLU N N 132 122.199 122.199 125.982 -3.783 26060 3598 1 5 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.030 -0.020 26060 3599 1 5 . 1 1 132 132 GLU C C 132 178.700 178.700 178.325 0.375 26060 3600 1 5 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.117 0.176 26060 3601 1 5 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.724 -0.563 26060 3602 1 5 . 1 1 132 132 GLU H H 132 8.932 8.932 9.023 -0.091 26060 3603 1 5 . 1 1 133 133 ASP N N 133 116.324 116.324 119.910 -3.586 26060 3604 1 5 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.352 -0.022 26060 3605 1 5 . 1 1 133 133 ASP C C 133 177.800 177.800 178.965 -1.165 26060 3606 1 5 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.749 -0.203 26060 3607 1 5 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.560 1.263 26060 3608 1 5 . 1 1 133 133 ASP H H 133 8.490 8.490 8.184 0.306 26060 3609 1 5 . 1 1 134 134 PHE N N 134 119.914 119.914 121.399 -1.485 26060 3610 1 5 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.313 0.297 26060 3611 1 5 . 1 1 134 134 PHE C C 134 177.300 177.300 177.113 0.187 26060 3612 1 5 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.472 0.066 26060 3613 1 5 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.983 0.218 26060 3614 1 5 . 1 1 134 134 PHE H H 134 7.787 7.787 7.477 0.310 26060 3615 1 5 . 1 1 135 135 ARG N N 135 119.794 119.794 120.191 -0.397 26060 3616 1 5 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.577 -0.227 26060 3617 1 5 . 1 1 135 135 ARG C C 135 177.370 177.370 178.169 -0.799 26060 3618 1 5 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.880 0.496 26060 3619 1 5 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.001 0.395 26060 3620 1 5 . 1 1 135 135 ARG H H 135 9.087 9.087 8.307 0.780 26060 3621 1 5 . 1 1 136 136 ARG N N 136 114.554 114.554 118.716 -4.162 26060 3622 1 5 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.919 -0.099 26060 3623 1 5 . 1 1 136 136 ARG C C 136 178.950 178.950 178.644 0.306 26060 3624 1 5 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.764 0.036 26060 3625 1 5 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.056 0.161 26060 3626 1 5 . 1 1 136 136 ARG H H 136 7.747 7.747 8.637 -0.890 26060 3627 1 5 . 1 1 137 137 LYS N N 137 118.298 118.298 118.826 -0.528 26060 3628 1 5 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.042 -0.142 26060 3629 1 5 . 1 1 137 137 LYS C C 137 177.980 177.980 179.026 -1.046 26060 3630 1 5 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.431 0.964 26060 3631 1 5 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.518 -0.071 26060 3632 1 5 . 1 1 137 137 LYS H H 137 7.154 7.154 7.385 -0.231 26060 3633 1 5 . 1 1 138 138 LEU N N 138 117.159 117.159 119.377 -2.218 26060 3634 1 5 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.794 -0.374 26060 3635 1 5 . 1 1 138 138 LEU C C 138 179.100 179.100 178.639 0.461 26060 3636 1 5 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.319 -0.088 26060 3637 1 5 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.448 0.880 26060 3638 1 5 . 1 1 138 138 LEU H H 138 7.709 7.709 7.823 -0.114 26060 3639 1 5 . 1 1 139 139 LEU N N 139 115.158 115.158 116.631 -1.473 26060 3640 1 5 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.080 0.070 26060 3641 1 5 . 1 1 139 139 LEU C C 139 177.600 177.600 178.751 -1.151 26060 3642 1 5 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.592 -1.063 26060 3643 1 5 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.925 -0.181 26060 3644 1 5 . 1 1 139 139 LEU H H 139 7.507 7.507 8.226 -0.719 26060 3645 1 5 . 1 1 140 140 LYS N N 140 120.256 120.256 118.111 2.145 26060 3646 1 5 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.009 0.101 26060 3647 1 5 . 1 1 140 140 LYS C C 140 175.800 175.800 176.851 -1.051 26060 3648 1 5 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.639 -0.588 26060 3649 1 5 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.411 0.235 26060 3650 1 5 . 1 1 140 140 LYS H H 140 7.304 7.304 7.538 -0.234 26060 3651 1 6 . 1 1 4 4 MET C C 4 175.800 175.800 175.760 0.040 26060 3652 1 6 . 1 1 4 4 MET CA C 4 55.350 55.350 54.708 0.642 26060 3653 1 6 . 1 1 4 4 MET CB C 4 32.880 32.880 33.481 -0.601 26060 3654 1 6 . 1 1 5 5 ALA N N 5 125.230 125.230 126.677 -1.447 26060 3655 1 6 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.528 -0.178 26060 3656 1 6 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.688 0.742 26060 3657 1 6 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.758 -0.388 26060 3658 1 6 . 1 1 5 5 ALA H H 5 8.320 8.320 8.513 -0.193 26060 3659 1 6 . 1 1 6 6 SER HA H 6 4.490 4.490 4.559 -0.069 26060 3660 1 6 . 1 1 6 6 SER CA C 6 58.200 58.200 57.684 0.516 26060 3661 1 6 . 1 1 6 6 SER CB C 6 63.700 63.700 64.334 -0.634 26060 3662 1 6 . 1 1 7 7 SER HA H 7 4.530 4.530 4.537 -0.007 26060 3663 1 6 . 1 1 7 7 SER CA C 7 58.200 58.200 58.608 -0.408 26060 3664 1 6 . 1 1 7 7 SER CB C 7 63.700 63.700 63.333 0.367 26060 3665 1 6 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.632 -0.022 26060 3666 1 6 . 1 1 8 8 CYS C C 8 173.500 173.500 173.435 0.065 26060 3667 1 6 . 1 1 8 8 CYS CA C 8 58.340 58.340 58.006 0.334 26060 3668 1 6 . 1 1 8 8 CYS CB C 8 28.490 28.490 27.978 0.512 26060 3669 1 6 . 1 1 9 9 ALA N N 9 124.700 124.700 129.339 -4.639 26060 3670 1 6 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.996 -0.206 26060 3671 1 6 . 1 1 9 9 ALA C C 9 177.400 177.400 176.649 0.751 26060 3672 1 6 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.735 1.335 26060 3673 1 6 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.039 0.590 26060 3674 1 6 . 1 1 9 9 ALA H H 9 7.960 7.960 8.669 -0.709 26060 3675 1 6 . 1 1 10 10 VAL N N 10 120.124 120.124 124.604 -4.480 26060 3676 1 6 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.124 0.166 26060 3677 1 6 . 1 1 10 10 VAL C C 10 173.900 173.900 175.124 -1.224 26060 3678 1 6 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.629 -0.079 26060 3679 1 6 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.468 2.432 26060 3680 1 6 . 1 1 10 10 VAL H H 10 8.424 8.424 8.502 -0.078 26060 3681 1 6 . 1 1 11 11 GLN N N 11 125.818 125.818 126.762 -0.944 26060 3682 1 6 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.402 0.158 26060 3683 1 6 . 1 1 11 11 GLN C C 11 175.400 175.400 175.177 0.223 26060 3684 1 6 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.495 -0.372 26060 3685 1 6 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.575 1.454 26060 3686 1 6 . 1 1 11 11 GLN H H 11 8.636 8.636 8.550 0.086 26060 3687 1 6 . 1 1 12 12 VAL N N 12 119.106 119.106 119.109 -0.003 26060 3688 1 6 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.352 0.278 26060 3689 1 6 . 1 1 12 12 VAL C C 12 173.800 173.800 174.557 -0.757 26060 3690 1 6 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.177 0.623 26060 3691 1 6 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.780 1.931 26060 3692 1 6 . 1 1 12 12 VAL H H 12 8.827 8.827 8.975 -0.148 26060 3693 1 6 . 1 1 13 13 LYS N N 13 121.700 121.700 126.149 -4.449 26060 3694 1 6 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.154 0.046 26060 3695 1 6 . 1 1 13 13 LYS C C 13 175.030 175.030 175.533 -0.503 26060 3696 1 6 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.020 0.410 26060 3697 1 6 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.190 1.730 26060 3698 1 6 . 1 1 13 13 LYS H H 13 8.234 8.234 8.596 -0.362 26060 3699 1 6 . 1 1 14 14 LEU N N 14 119.100 119.100 126.701 -7.601 26060 3700 1 6 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.476 -0.526 26060 3701 1 6 . 1 1 14 14 LEU C C 14 175.110 175.110 175.239 -0.129 26060 3702 1 6 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.463 -0.106 26060 3703 1 6 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.774 1.147 26060 3704 1 6 . 1 1 14 14 LEU H H 14 8.840 8.840 8.416 0.424 26060 3705 1 6 . 1 1 15 15 GLU N N 15 120.978 120.978 122.190 -1.212 26060 3706 1 6 . 1 1 15 15 GLU HA H 15 4.990 4.990 4.925 0.065 26060 3707 1 6 . 1 1 15 15 GLU C C 15 173.800 173.800 174.576 -0.776 26060 3708 1 6 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.678 0.750 26060 3709 1 6 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.378 -1.552 26060 3710 1 6 . 1 1 15 15 GLU H H 15 9.181 9.181 9.230 -0.049 26060 3711 1 6 . 1 1 16 16 LEU N N 16 124.438 124.438 125.842 -1.404 26060 3712 1 6 . 1 1 16 16 LEU HA H 16 5.110 5.110 4.461 0.649 26060 3713 1 6 . 1 1 16 16 LEU C C 16 174.700 174.700 175.404 -0.704 26060 3714 1 6 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.957 0.119 26060 3715 1 6 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.119 2.773 26060 3716 1 6 . 1 1 16 16 LEU H H 16 8.891 8.891 8.790 0.101 26060 3717 1 6 . 1 1 17 17 GLY N N 17 108.067 108.067 109.532 -1.465 26060 3718 1 6 . 1 1 17 17 GLY C C 17 170.350 170.350 171.606 -1.256 26060 3719 1 6 . 1 1 17 17 GLY CA C 17 46.984 46.984 44.620 2.364 26060 3720 1 6 . 1 1 17 17 GLY H H 17 7.227 7.227 7.880 -0.653 26060 3721 1 6 . 1 1 18 18 HIS N N 18 111.200 111.200 121.436 -10.236 26060 3722 1 6 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.840 -0.220 26060 3723 1 6 . 1 1 18 18 HIS C C 18 172.400 172.400 172.778 -0.378 26060 3724 1 6 . 1 1 18 18 HIS CA C 18 54.940 54.940 54.952 -0.012 26060 3725 1 6 . 1 1 18 18 HIS CB C 18 34.160 34.160 33.259 0.901 26060 3726 1 6 . 1 1 18 18 HIS H H 18 8.150 8.150 9.047 -0.897 26060 3727 1 6 . 1 1 19 19 ARG N N 19 117.800 117.800 121.840 -4.040 26060 3728 1 6 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.816 0.284 26060 3729 1 6 . 1 1 19 19 ARG C C 19 175.800 175.800 174.124 1.676 26060 3730 1 6 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.969 -0.469 26060 3731 1 6 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.199 -0.549 26060 3732 1 6 . 1 1 19 19 ARG H H 19 9.010 9.010 9.015 -0.005 26060 3733 1 6 . 1 1 20 20 ALA N N 20 120.390 120.390 122.141 -1.751 26060 3734 1 6 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.477 0.053 26060 3735 1 6 . 1 1 20 20 ALA C C 20 175.800 175.800 175.056 0.744 26060 3736 1 6 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.929 1.261 26060 3737 1 6 . 1 1 20 20 ALA CB C 20 23.750 23.750 22.925 0.825 26060 3738 1 6 . 1 1 20 20 ALA H H 20 8.070 8.070 8.295 -0.225 26060 3739 1 6 . 1 1 21 21 GLN N N 21 121.790 121.790 121.091 0.699 26060 3740 1 6 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.175 0.055 26060 3741 1 6 . 1 1 21 21 GLN CA C 21 54.330 54.330 53.889 0.441 26060 3742 1 6 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.290 -0.390 26060 3743 1 6 . 1 1 21 21 GLN H H 21 9.240 9.240 9.299 -0.059 26060 3744 1 6 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.450 -0.820 26060 3745 1 6 . 1 1 22 22 VAL C C 22 176.500 176.500 175.407 1.093 26060 3746 1 6 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.945 3.085 26060 3747 1 6 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.632 -2.032 26060 3748 1 6 . 1 1 23 23 ARG N N 23 127.840 127.840 127.198 0.642 26060 3749 1 6 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.469 -0.339 26060 3750 1 6 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.497 1.103 26060 3751 1 6 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.860 1.290 26060 3752 1 6 . 1 1 23 23 ARG H H 23 8.720 8.720 8.148 0.572 26060 3753 1 6 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.097 -0.057 26060 3754 1 6 . 1 1 24 24 LYS C C 24 176.960 176.960 176.144 0.816 26060 3755 1 6 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.778 1.022 26060 3756 1 6 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.485 -0.425 26060 3757 1 6 . 1 1 25 25 LYS N N 25 115.870 115.870 118.009 -2.139 26060 3758 1 6 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.578 0.252 26060 3759 1 6 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.547 -0.587 26060 3760 1 6 . 1 1 25 25 LYS CB C 25 35.080 35.080 34.449 0.631 26060 3761 1 6 . 1 1 25 25 LYS H H 25 7.720 7.720 7.540 0.180 26060 3762 1 6 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.722 0.108 26060 3763 1 6 . 1 1 26 26 PRO C C 26 177.400 177.400 177.007 0.393 26060 3764 1 6 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.669 -0.019 26060 3765 1 6 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.352 0.038 26060 3766 1 6 . 1 1 27 27 THR N N 27 111.270 111.270 114.739 -3.469 26060 3767 1 6 . 1 1 27 27 THR HA H 27 4.530 4.530 4.230 0.300 26060 3768 1 6 . 1 1 27 27 THR C C 27 177.300 177.300 176.900 0.400 26060 3769 1 6 . 1 1 27 27 THR CA C 27 61.300 61.300 61.039 0.261 26060 3770 1 6 . 1 1 27 27 THR CB C 27 71.460 71.460 69.989 1.471 26060 3771 1 6 . 1 1 27 27 THR H H 27 8.380 8.380 8.069 0.311 26060 3772 1 6 . 1 1 28 28 VAL N N 28 121.170 121.170 122.563 -1.393 26060 3773 1 6 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.813 0.070 26060 3774 1 6 . 1 1 28 28 VAL C C 28 177.030 177.030 176.019 1.011 26060 3775 1 6 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.094 0.106 26060 3776 1 6 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.655 -0.255 26060 3777 1 6 . 1 1 28 28 VAL H H 28 8.910 8.910 8.532 0.378 26060 3778 1 6 . 1 1 29 29 GLU N N 29 116.800 116.800 116.933 -0.133 26060 3779 1 6 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.189 -0.269 26060 3780 1 6 . 1 1 29 29 GLU C C 29 176.200 176.200 175.854 0.346 26060 3781 1 6 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.324 1.926 26060 3782 1 6 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.378 -1.208 26060 3783 1 6 . 1 1 29 29 GLU H H 29 7.990 7.990 7.926 0.064 26060 3784 1 6 . 1 1 30 30 GLY N N 30 105.500 105.500 107.831 -2.331 26060 3785 1 6 . 1 1 30 30 GLY C C 30 174.900 174.900 173.967 0.933 26060 3786 1 6 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.231 -0.771 26060 3787 1 6 . 1 1 30 30 GLY H H 30 7.950 7.950 7.855 0.095 26060 3788 1 6 . 1 1 31 31 PHE N N 31 119.300 119.300 118.989 0.311 26060 3789 1 6 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.904 -0.144 26060 3790 1 6 . 1 1 31 31 PHE C C 31 176.400 176.400 175.902 0.498 26060 3791 1 6 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.609 1.291 26060 3792 1 6 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.167 -3.667 26060 3793 1 6 . 1 1 31 31 PHE H H 31 7.520 7.520 7.387 0.133 26060 3794 1 6 . 1 1 32 32 THR N N 32 112.300 112.300 116.323 -4.023 26060 3795 1 6 . 1 1 32 32 THR HA H 32 4.330 4.330 4.431 -0.101 26060 3796 1 6 . 1 1 32 32 THR C C 32 175.200 175.200 174.410 0.790 26060 3797 1 6 . 1 1 32 32 THR CA C 32 62.780 62.780 62.907 -0.127 26060 3798 1 6 . 1 1 32 32 THR CB C 32 70.350 70.350 69.921 0.429 26060 3799 1 6 . 1 1 32 32 THR H H 32 7.770 7.770 9.112 -1.342 26060 3800 1 6 . 1 1 33 33 HIS N N 33 121.900 121.900 121.997 -0.097 26060 3801 1 6 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.275 0.225 26060 3802 1 6 . 1 1 33 33 HIS C C 33 173.880 173.880 173.635 0.245 26060 3803 1 6 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.756 0.024 26060 3804 1 6 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.101 3.539 26060 3805 1 6 . 1 1 33 33 HIS H H 33 9.110 9.110 8.803 0.307 26060 3806 1 6 . 1 1 34 34 ASP N N 34 120.300 120.300 124.688 -4.388 26060 3807 1 6 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.526 -0.126 26060 3808 1 6 . 1 1 34 34 ASP C C 34 175.100 175.100 175.029 0.071 26060 3809 1 6 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.763 -0.453 26060 3810 1 6 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.634 -0.534 26060 3811 1 6 . 1 1 34 34 ASP H H 34 8.810 8.810 9.087 -0.277 26060 3812 1 6 . 1 1 35 35 TRP N N 35 119.800 119.800 121.036 -1.236 26060 3813 1 6 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.495 0.235 26060 3814 1 6 . 1 1 35 35 TRP C C 35 174.900 174.900 173.380 1.520 26060 3815 1 6 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.909 -0.009 26060 3816 1 6 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.056 2.014 26060 3817 1 6 . 1 1 35 35 TRP H H 35 9.250 9.250 8.841 0.409 26060 3818 1 6 . 1 1 36 36 MET N N 36 120.980 120.980 121.545 -0.565 26060 3819 1 6 . 1 1 36 36 MET HA H 36 5.750 5.750 5.847 -0.097 26060 3820 1 6 . 1 1 36 36 MET C C 36 173.700 173.700 174.232 -0.532 26060 3821 1 6 . 1 1 36 36 MET CA C 36 54.830 54.830 54.361 0.469 26060 3822 1 6 . 1 1 36 36 MET CB C 36 35.220 35.220 36.839 -1.619 26060 3823 1 6 . 1 1 36 36 MET H H 36 9.080 9.080 9.182 -0.102 26060 3824 1 6 . 1 1 37 37 VAL N N 37 126.220 126.220 121.820 4.400 26060 3825 1 6 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.392 -0.082 26060 3826 1 6 . 1 1 37 37 VAL C C 37 172.300 172.300 174.516 -2.216 26060 3827 1 6 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.952 -1.412 26060 3828 1 6 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.684 1.386 26060 3829 1 6 . 1 1 37 37 VAL H H 37 9.080 9.080 8.985 0.095 26060 3830 1 6 . 1 1 38 38 PHE N N 38 120.640 120.640 121.963 -1.323 26060 3831 1 6 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.942 0.028 26060 3832 1 6 . 1 1 38 38 PHE C C 38 172.960 172.960 173.991 -1.031 26060 3833 1 6 . 1 1 38 38 PHE CA C 38 56.130 56.130 55.375 0.755 26060 3834 1 6 . 1 1 38 38 PHE CB C 38 43.000 43.000 42.548 0.452 26060 3835 1 6 . 1 1 38 38 PHE H H 38 8.320 8.320 8.961 -0.641 26060 3836 1 6 . 1 1 39 39 VAL N N 39 116.500 116.500 119.484 -2.984 26060 3837 1 6 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.565 -0.555 26060 3838 1 6 . 1 1 39 39 VAL C C 39 174.700 174.700 175.044 -0.344 26060 3839 1 6 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.888 1.752 26060 3840 1 6 . 1 1 39 39 VAL CB C 39 35.400 35.400 34.031 1.369 26060 3841 1 6 . 1 1 39 39 VAL H H 39 8.580 8.580 8.597 -0.017 26060 3842 1 6 . 1 1 40 40 ARG N N 40 124.100 124.100 122.784 1.316 26060 3843 1 6 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.910 0.170 26060 3844 1 6 . 1 1 40 40 ARG C C 40 173.800 173.800 174.286 -0.486 26060 3845 1 6 . 1 1 40 40 ARG CA C 40 54.930 54.930 56.026 -1.096 26060 3846 1 6 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.420 1.160 26060 3847 1 6 . 1 1 40 40 ARG H H 40 9.880 9.880 8.535 1.345 26060 3848 1 6 . 1 1 41 41 GLY N N 41 107.640 107.640 106.575 1.065 26060 3849 1 6 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.673 1.297 26060 3850 1 6 . 1 1 41 41 GLY H H 41 8.910 8.910 8.627 0.283 26060 3851 1 6 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.408 0.082 26060 3852 1 6 . 1 1 42 42 PRO C C 42 177.300 177.300 176.823 0.477 26060 3853 1 6 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.652 -0.212 26060 3854 1 6 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.435 -0.325 26060 3855 1 6 . 1 1 43 43 GLU N N 43 121.050 121.050 122.191 -1.141 26060 3856 1 6 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.939 -0.149 26060 3857 1 6 . 1 1 43 43 GLU C C 43 176.110 176.110 176.120 -0.010 26060 3858 1 6 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.316 -0.466 26060 3859 1 6 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.326 -0.476 26060 3860 1 6 . 1 1 43 43 GLU H H 43 9.060 9.060 8.729 0.331 26060 3861 1 6 . 1 1 44 44 HIS N N 44 114.100 114.100 115.713 -1.613 26060 3862 1 6 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.292 0.059 26060 3863 1 6 . 1 1 44 44 HIS C C 44 175.170 175.170 175.065 0.105 26060 3864 1 6 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.237 0.413 26060 3865 1 6 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.840 -0.469 26060 3866 1 6 . 1 1 44 44 HIS H H 44 8.420 8.420 8.636 -0.216 26060 3867 1 6 . 1 1 45 45 SER N N 45 115.540 115.540 118.201 -2.661 26060 3868 1 6 . 1 1 45 45 SER HA H 45 4.560 4.560 4.607 -0.047 26060 3869 1 6 . 1 1 45 45 SER C C 45 173.700 173.700 173.939 -0.239 26060 3870 1 6 . 1 1 45 45 SER CA C 45 58.710 58.710 57.808 0.902 26060 3871 1 6 . 1 1 45 45 SER CB C 45 65.040 65.040 63.395 1.645 26060 3872 1 6 . 1 1 45 45 SER H H 45 7.870 7.870 7.873 -0.003 26060 3873 1 6 . 1 1 46 46 ASN N N 46 123.900 123.900 124.359 -0.459 26060 3874 1 6 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.910 0.210 26060 3875 1 6 . 1 1 46 46 ASN C C 46 176.300 176.300 176.004 0.296 26060 3876 1 6 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.771 -0.081 26060 3877 1 6 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.419 -1.689 26060 3878 1 6 . 1 1 46 46 ASN H H 46 9.480 9.480 8.402 1.078 26060 3879 1 6 . 1 1 47 47 ILE N N 47 115.240 115.240 121.905 -6.665 26060 3880 1 6 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.166 0.774 26060 3881 1 6 . 1 1 47 47 ILE C C 47 176.000 176.000 176.770 -0.770 26060 3882 1 6 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.150 0.050 26060 3883 1 6 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.107 -1.407 26060 3884 1 6 . 1 1 47 47 ILE H H 47 8.170 8.170 8.623 -0.453 26060 3885 1 6 . 1 1 48 48 GLN N N 48 123.200 123.200 119.666 3.534 26060 3886 1 6 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.144 0.136 26060 3887 1 6 . 1 1 48 48 GLN C C 48 175.670 175.670 176.198 -0.528 26060 3888 1 6 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.875 0.025 26060 3889 1 6 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.482 -0.492 26060 3890 1 6 . 1 1 48 48 GLN H H 48 8.850 8.850 8.592 0.258 26060 3891 1 6 . 1 1 49 49 HIS N N 49 115.400 115.400 115.811 -0.411 26060 3892 1 6 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.437 0.133 26060 3893 1 6 . 1 1 49 49 HIS C C 49 176.380 176.380 176.815 -0.435 26060 3894 1 6 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.395 0.355 26060 3895 1 6 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.807 0.813 26060 3896 1 6 . 1 1 49 49 HIS H H 49 7.400 7.400 7.462 -0.062 26060 3897 1 6 . 1 1 50 50 PHE N N 50 109.800 109.800 112.694 -2.894 26060 3898 1 6 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.902 0.328 26060 3899 1 6 . 1 1 50 50 PHE C C 50 173.800 173.800 174.346 -0.546 26060 3900 1 6 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.832 -0.172 26060 3901 1 6 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.539 1.461 26060 3902 1 6 . 1 1 50 50 PHE H H 50 7.570 7.570 7.448 0.122 26060 3903 1 6 . 1 1 51 51 VAL N N 51 127.810 127.810 120.008 7.802 26060 3904 1 6 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.890 -0.520 26060 3905 1 6 . 1 1 51 51 VAL C C 51 174.500 174.500 174.490 0.010 26060 3906 1 6 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.383 1.617 26060 3907 1 6 . 1 1 51 51 VAL CB C 51 33.280 33.280 35.199 -1.919 26060 3908 1 6 . 1 1 51 51 VAL H H 51 7.810 7.810 8.045 -0.235 26060 3909 1 6 . 1 1 52 52 GLU N N 52 130.700 130.700 126.459 4.241 26060 3910 1 6 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.598 -0.618 26060 3911 1 6 . 1 1 52 52 GLU C C 52 175.400 175.400 175.316 0.084 26060 3912 1 6 . 1 1 52 52 GLU CA C 52 58.100 58.100 56.832 1.268 26060 3913 1 6 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.833 -1.253 26060 3914 1 6 . 1 1 52 52 GLU H H 52 9.380 9.380 9.082 0.298 26060 3915 1 6 . 1 1 53 53 LYS N N 53 109.200 109.200 115.003 -5.803 26060 3916 1 6 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.147 -0.347 26060 3917 1 6 . 1 1 53 53 LYS C C 53 172.300 172.300 174.511 -2.211 26060 3918 1 6 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.408 0.432 26060 3919 1 6 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.298 -2.049 26060 3920 1 6 . 1 1 53 53 LYS H H 53 7.190 7.190 7.391 -0.201 26060 3921 1 6 . 1 1 54 54 VAL N N 54 120.380 120.380 118.486 1.894 26060 3922 1 6 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.864 -0.094 26060 3923 1 6 . 1 1 54 54 VAL C C 54 173.600 173.600 173.973 -0.373 26060 3924 1 6 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.181 -0.141 26060 3925 1 6 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.644 -1.944 26060 3926 1 6 . 1 1 54 54 VAL H H 54 8.450 8.450 8.854 -0.404 26060 3927 1 6 . 1 1 55 55 VAL N N 55 126.920 126.920 123.058 3.862 26060 3928 1 6 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.971 -0.271 26060 3929 1 6 . 1 1 55 55 VAL C C 55 173.800 173.800 173.824 -0.024 26060 3930 1 6 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.779 0.091 26060 3931 1 6 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.951 -2.851 26060 3932 1 6 . 1 1 55 55 VAL H H 55 9.260 9.260 9.075 0.185 26060 3933 1 6 . 1 1 56 56 PHE N N 56 126.130 126.130 124.131 1.999 26060 3934 1 6 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.003 -0.313 26060 3935 1 6 . 1 1 56 56 PHE C C 56 174.000 174.000 174.439 -0.439 26060 3936 1 6 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.781 -0.201 26060 3937 1 6 . 1 1 56 56 PHE CB C 56 40.890 40.890 41.943 -1.053 26060 3938 1 6 . 1 1 56 56 PHE H H 56 9.290 9.290 8.758 0.532 26060 3939 1 6 . 1 1 57 57 HIS N N 57 124.180 124.180 124.816 -0.636 26060 3940 1 6 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.870 -0.070 26060 3941 1 6 . 1 1 57 57 HIS C C 57 174.700 174.700 175.217 -0.517 26060 3942 1 6 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.315 0.005 26060 3943 1 6 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.305 1.795 26060 3944 1 6 . 1 1 57 57 HIS H H 57 8.690 8.690 8.550 0.140 26060 3945 1 6 . 1 1 58 58 LEU N N 58 122.050 122.050 123.202 -1.152 26060 3946 1 6 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.369 -0.129 26060 3947 1 6 . 1 1 58 58 LEU C C 58 174.400 174.400 177.026 -2.626 26060 3948 1 6 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.804 0.606 26060 3949 1 6 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.373 -1.213 26060 3950 1 6 . 1 1 58 58 LEU H H 58 9.050 9.050 7.878 1.171 26060 3951 1 6 . 1 1 59 59 HIS N N 59 118.510 118.510 117.883 0.627 26060 3952 1 6 . 1 1 59 59 HIS C C 59 175.300 175.300 176.579 -1.279 26060 3953 1 6 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.443 2.667 26060 3954 1 6 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.419 0.511 26060 3955 1 6 . 1 1 59 59 HIS H H 59 5.160 5.160 7.797 -2.637 26060 3956 1 6 . 1 1 60 60 GLU N N 60 122.190 122.190 126.285 -4.095 26060 3957 1 6 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.008 -0.048 26060 3958 1 6 . 1 1 60 60 GLU C C 60 175.130 175.130 176.614 -1.484 26060 3959 1 6 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.249 -0.239 26060 3960 1 6 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.038 -0.218 26060 3961 1 6 . 1 1 60 60 GLU H H 60 7.960 7.960 8.543 -0.583 26060 3962 1 6 . 1 1 61 61 SER N N 61 116.940 116.940 113.187 3.753 26060 3963 1 6 . 1 1 61 61 SER HA H 61 4.200 4.200 4.353 -0.152 26060 3964 1 6 . 1 1 61 61 SER CA C 61 60.010 60.010 59.905 0.105 26060 3965 1 6 . 1 1 61 61 SER CB C 61 63.140 63.140 63.345 -0.205 26060 3966 1 6 . 1 1 61 61 SER H H 61 8.540 8.540 8.289 0.251 26060 3967 1 6 . 1 1 62 62 PHE N N 62 123.700 123.700 122.420 1.280 26060 3968 1 6 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.639 -0.089 26060 3969 1 6 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.442 2.498 26060 3970 1 6 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.148 -0.748 26060 3971 1 6 . 1 1 62 62 PHE H H 62 8.640 8.640 8.161 0.479 26060 3972 1 6 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.514 -0.104 26060 3973 1 6 . 1 1 63 63 PRO C C 63 176.400 176.400 176.441 -0.041 26060 3974 1 6 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.148 -0.548 26060 3975 1 6 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.057 -0.197 26060 3976 1 6 . 1 1 64 64 ARG N N 64 116.840 116.840 120.130 -3.290 26060 3977 1 6 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.079 0.021 26060 3978 1 6 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.215 -0.605 26060 3979 1 6 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.369 0.461 26060 3980 1 6 . 1 1 64 64 ARG H H 64 8.890 8.890 8.794 0.096 26060 3981 1 6 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.366 -0.376 26060 3982 1 6 . 1 1 65 65 PRO C C 65 175.800 175.800 177.305 -1.505 26060 3983 1 6 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.001 1.808 26060 3984 1 6 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.925 -0.045 26060 3985 1 6 . 1 1 66 66 LYS N N 66 119.035 119.035 120.279 -1.244 26060 3986 1 6 . 1 1 66 66 LYS HA H 66 4.610 4.610 4.919 -0.309 26060 3987 1 6 . 1 1 66 66 LYS C C 66 175.400 175.400 175.820 -0.420 26060 3988 1 6 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.764 -0.311 26060 3989 1 6 . 1 1 66 66 LYS CB C 66 31.730 31.730 31.896 -0.167 26060 3990 1 6 . 1 1 66 66 LYS H H 66 7.630 7.630 7.887 -0.257 26060 3991 1 6 . 1 1 67 67 ARG N N 67 127.394 127.394 128.002 -0.608 26060 3992 1 6 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.621 0.119 26060 3993 1 6 . 1 1 67 67 ARG C C 67 174.500 174.500 174.918 -0.418 26060 3994 1 6 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.638 0.162 26060 3995 1 6 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.429 -0.715 26060 3996 1 6 . 1 1 67 67 ARG H H 67 8.855 8.855 8.737 0.118 26060 3997 1 6 . 1 1 68 68 VAL N N 68 124.388 124.388 121.088 3.300 26060 3998 1 6 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.093 -0.513 26060 3999 1 6 . 1 1 68 68 VAL C C 68 176.850 176.850 175.522 1.328 26060 4000 1 6 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.410 2.663 26060 4001 1 6 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.619 -0.015 26060 4002 1 6 . 1 1 68 68 VAL H H 68 8.681 8.681 8.411 0.270 26060 4003 1 6 . 1 1 69 69 CYS N N 69 127.080 127.080 125.341 1.739 26060 4004 1 6 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.822 0.248 26060 4005 1 6 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.468 0.878 26060 4006 1 6 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.754 0.016 26060 4007 1 6 . 1 1 69 69 CYS H H 69 9.455 9.455 9.171 0.284 26060 4008 1 6 . 1 1 70 70 LYS N N 70 125.480 125.480 127.920 -2.440 26060 4009 1 6 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.580 -0.090 26060 4010 1 6 . 1 1 70 70 LYS C C 70 174.300 174.300 175.530 -1.230 26060 4011 1 6 . 1 1 70 70 LYS CA C 70 57.760 57.760 55.616 2.144 26060 4012 1 6 . 1 1 70 70 LYS CB C 70 33.170 33.170 32.649 0.521 26060 4013 1 6 . 1 1 70 70 LYS H H 70 9.050 9.050 8.699 0.351 26060 4014 1 6 . 1 1 71 71 ASP N N 71 116.940 116.940 120.050 -3.110 26060 4015 1 6 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.859 0.241 26060 4016 1 6 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.373 -0.293 26060 4017 1 6 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.086 2.294 26060 4018 1 6 . 1 1 71 71 ASP H H 71 7.620 7.620 7.614 0.006 26060 4019 1 6 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.150 -0.890 26060 4020 1 6 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.990 -2.340 26060 4021 1 6 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.611 -0.571 26060 4022 1 6 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.081 0.019 26060 4023 1 6 . 1 1 73 73 PRO C C 73 174.700 174.700 175.965 -1.265 26060 4024 1 6 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.355 -2.665 26060 4025 1 6 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.347 2.693 26060 4026 1 6 . 1 1 74 74 TYR N N 74 125.400 125.400 125.197 0.203 26060 4027 1 6 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.620 0.230 26060 4028 1 6 . 1 1 74 74 TYR C C 74 172.900 172.900 175.388 -2.488 26060 4029 1 6 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.132 -2.462 26060 4030 1 6 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.284 -3.884 26060 4031 1 6 . 1 1 74 74 TYR H H 74 8.960 8.960 8.299 0.661 26060 4032 1 6 . 1 1 75 75 LYS N N 75 121.400 121.400 119.369 2.031 26060 4033 1 6 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.311 0.279 26060 4034 1 6 . 1 1 75 75 LYS C C 75 173.800 173.800 174.518 -0.718 26060 4035 1 6 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.797 -0.147 26060 4036 1 6 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.836 -0.946 26060 4037 1 6 . 1 1 75 75 LYS H H 75 7.670 7.670 8.278 -0.608 26060 4038 1 6 . 1 1 76 76 VAL N N 76 119.800 119.800 121.468 -1.668 26060 4039 1 6 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.211 -0.321 26060 4040 1 6 . 1 1 76 76 VAL C C 76 173.900 173.900 174.296 -0.396 26060 4041 1 6 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.781 0.949 26060 4042 1 6 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.988 0.552 26060 4043 1 6 . 1 1 76 76 VAL H H 76 8.180 8.180 8.037 0.143 26060 4044 1 6 . 1 1 77 77 GLU N N 77 126.190 126.190 127.779 -1.589 26060 4045 1 6 . 1 1 77 77 GLU HA H 77 4.950 4.950 5.056 -0.106 26060 4046 1 6 . 1 1 77 77 GLU C C 77 174.700 174.700 175.359 -0.659 26060 4047 1 6 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.061 -0.121 26060 4048 1 6 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.539 0.011 26060 4049 1 6 . 1 1 77 77 GLU H H 77 8.270 8.270 8.671 -0.401 26060 4050 1 6 . 1 1 78 78 GLU N N 78 126.180 126.180 123.686 2.494 26060 4051 1 6 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.619 -0.169 26060 4052 1 6 . 1 1 78 78 GLU C C 78 175.400 175.400 174.035 1.365 26060 4053 1 6 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.970 0.072 26060 4054 1 6 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.829 3.271 26060 4055 1 6 . 1 1 78 78 GLU H H 78 7.870 7.870 8.246 -0.376 26060 4056 1 6 . 1 1 79 79 SER N N 79 112.109 112.109 113.162 -1.053 26060 4057 1 6 . 1 1 79 79 SER HA H 79 5.560 5.560 5.361 0.199 26060 4058 1 6 . 1 1 79 79 SER C C 79 172.490 172.490 173.187 -0.697 26060 4059 1 6 . 1 1 79 79 SER CA C 79 57.754 57.754 56.585 1.169 26060 4060 1 6 . 1 1 79 79 SER CB C 79 65.861 65.861 65.327 0.534 26060 4061 1 6 . 1 1 79 79 SER H H 79 7.714 7.714 8.317 -0.603 26060 4062 1 6 . 1 1 80 80 GLY N N 80 106.048 106.048 110.901 -4.853 26060 4063 1 6 . 1 1 80 80 GLY C C 80 172.630 172.630 171.834 0.796 26060 4064 1 6 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.717 0.853 26060 4065 1 6 . 1 1 80 80 GLY H H 80 8.828 8.828 8.948 -0.120 26060 4066 1 6 . 1 1 81 81 TYR N N 81 115.280 115.280 114.415 0.865 26060 4067 1 6 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.288 0.392 26060 4068 1 6 . 1 1 81 81 TYR C C 81 174.100 174.100 173.982 0.118 26060 4069 1 6 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.029 -1.530 26060 4070 1 6 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.436 1.904 26060 4071 1 6 . 1 1 81 81 TYR H H 81 8.770 8.770 8.123 0.647 26060 4072 1 6 . 1 1 82 82 ALA N N 82 122.350 122.350 122.535 -0.185 26060 4073 1 6 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.541 -0.141 26060 4074 1 6 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.650 0.390 26060 4075 1 6 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.086 1.314 26060 4076 1 6 . 1 1 82 82 ALA H H 82 7.160 7.160 7.341 -0.181 26060 4077 1 6 . 1 1 83 83 GLY N N 83 107.100 107.100 106.447 0.653 26060 4078 1 6 . 1 1 83 83 GLY C C 83 172.500 172.500 173.557 -1.057 26060 4079 1 6 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.027 0.583 26060 4080 1 6 . 1 1 83 83 GLY H H 83 8.220 8.220 8.227 -0.007 26060 4081 1 6 . 1 1 84 84 PHE N N 84 111.660 111.660 115.013 -3.353 26060 4082 1 6 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.552 0.138 26060 4083 1 6 . 1 1 84 84 PHE C C 84 172.460 172.460 173.525 -1.065 26060 4084 1 6 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.653 -0.152 26060 4085 1 6 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.580 -1.000 26060 4086 1 6 . 1 1 84 84 PHE H H 84 7.700 7.700 8.178 -0.478 26060 4087 1 6 . 1 1 85 85 ILE N N 85 117.810 117.810 121.561 -3.751 26060 4088 1 6 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.044 0.266 26060 4089 1 6 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.074 -1.734 26060 4090 1 6 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.011 -1.751 26060 4091 1 6 . 1 1 85 85 ILE H H 85 8.340 8.340 8.645 -0.305 26060 4092 1 6 . 1 1 86 86 LEU N N 86 108.130 108.130 129.779 -21.649 26060 4093 1 6 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.036 -0.056 26060 4094 1 6 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.158 2.042 26060 4095 1 6 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.472 -0.172 26060 4096 1 6 . 1 1 86 86 LEU H H 86 9.900 9.900 8.699 1.201 26060 4097 1 6 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.525 0.575 26060 4098 1 6 . 1 1 87 87 PRO C C 87 175.340 175.340 175.785 -0.445 26060 4099 1 6 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.649 0.461 26060 4100 1 6 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.431 1.129 26060 4101 1 6 . 1 1 88 88 ILE N N 88 126.000 126.000 126.381 -0.381 26060 4102 1 6 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.234 0.556 26060 4103 1 6 . 1 1 88 88 ILE C C 88 176.100 176.100 175.103 0.997 26060 4104 1 6 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.775 -0.215 26060 4105 1 6 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.395 2.605 26060 4106 1 6 . 1 1 88 88 ILE H H 88 9.380 9.380 8.479 0.901 26060 4107 1 6 . 1 1 89 89 GLU N N 89 123.900 123.900 126.261 -2.361 26060 4108 1 6 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.168 0.032 26060 4109 1 6 . 1 1 89 89 GLU C C 89 173.800 173.800 175.423 -1.623 26060 4110 1 6 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.496 -0.526 26060 4111 1 6 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.308 1.072 26060 4112 1 6 . 1 1 89 89 GLU H H 89 9.320 9.320 8.995 0.325 26060 4113 1 6 . 1 1 90 90 VAL N N 90 123.980 123.980 123.698 0.282 26060 4114 1 6 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.190 -0.030 26060 4115 1 6 . 1 1 90 90 VAL C C 90 174.800 174.800 174.714 0.086 26060 4116 1 6 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.299 0.691 26060 4117 1 6 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.914 0.576 26060 4118 1 6 . 1 1 90 90 VAL H H 90 8.630 8.630 8.421 0.209 26060 4119 1 6 . 1 1 91 91 TYR N N 91 124.230 124.230 127.465 -3.235 26060 4120 1 6 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.252 0.408 26060 4121 1 6 . 1 1 91 91 TYR C C 91 176.800 176.800 175.505 1.295 26060 4122 1 6 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.194 -1.494 26060 4123 1 6 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.656 1.584 26060 4124 1 6 . 1 1 91 91 TYR H H 91 8.640 8.640 9.131 -0.491 26060 4125 1 6 . 1 1 92 92 PHE N N 92 121.200 121.200 122.249 -1.049 26060 4126 1 6 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.234 0.426 26060 4127 1 6 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.113 1.397 26060 4128 1 6 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.702 0.998 26060 4129 1 6 . 1 1 92 92 PHE H H 92 8.750 8.750 8.852 -0.102 26060 4130 1 6 . 1 1 93 93 LYS N N 93 123.450 123.450 122.304 1.146 26060 4131 1 6 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.555 0.045 26060 4132 1 6 . 1 1 93 93 LYS C C 93 174.200 174.200 174.734 -0.534 26060 4133 1 6 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.935 -0.755 26060 4134 1 6 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.381 -0.701 26060 4135 1 6 . 1 1 93 93 LYS H H 93 8.560 8.560 8.876 -0.316 26060 4136 1 6 . 1 1 94 94 ASN N N 94 118.800 118.800 120.199 -1.399 26060 4137 1 6 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.679 -0.239 26060 4138 1 6 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.471 -1.261 26060 4139 1 6 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.147 -1.347 26060 4140 1 6 . 1 1 94 94 ASN H H 94 7.820 7.820 7.983 -0.163 26060 4141 1 6 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.351 -0.021 26060 4142 1 6 . 1 1 95 95 LYS C C 95 175.800 175.800 175.998 -0.198 26060 4143 1 6 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.308 -0.098 26060 4144 1 6 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.520 -0.510 26060 4145 1 6 . 1 1 96 96 GLU N N 96 118.330 118.330 120.407 -2.077 26060 4146 1 6 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.384 0.126 26060 4147 1 6 . 1 1 96 96 GLU C C 96 173.200 173.200 176.486 -3.286 26060 4148 1 6 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.026 -0.926 26060 4149 1 6 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.195 2.275 26060 4150 1 6 . 1 1 96 96 GLU H H 96 7.120 7.120 8.016 -0.896 26060 4151 1 6 . 1 1 97 97 GLU N N 97 115.630 115.630 119.718 -4.088 26060 4152 1 6 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.156 0.274 26060 4153 1 6 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.383 -1.523 26060 4154 1 6 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.449 0.821 26060 4155 1 6 . 1 1 97 97 GLU H H 97 8.060 8.060 8.486 -0.426 26060 4156 1 6 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.265 0.735 26060 4157 1 6 . 1 1 98 98 PRO C C 98 175.900 175.900 176.164 -0.264 26060 4158 1 6 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.024 -1.864 26060 4159 1 6 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.007 1.993 26060 4160 1 6 . 1 1 99 99 ARG N N 99 122.800 122.800 120.303 2.497 26060 4161 1 6 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.378 0.252 26060 4162 1 6 . 1 1 99 99 ARG C C 99 175.800 175.800 175.693 0.107 26060 4163 1 6 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.385 0.105 26060 4164 1 6 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.535 -0.125 26060 4165 1 6 . 1 1 99 99 ARG H H 99 8.602 8.602 8.729 -0.127 26060 4166 1 6 . 1 1 100 100 LYS N N 100 113.220 113.220 115.960 -2.740 26060 4167 1 6 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.272 0.668 26060 4168 1 6 . 1 1 100 100 LYS C C 100 174.100 174.100 174.296 -0.196 26060 4169 1 6 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.230 -0.320 26060 4170 1 6 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.729 -1.009 26060 4171 1 6 . 1 1 100 100 LYS H H 100 7.650 7.650 7.343 0.307 26060 4172 1 6 . 1 1 101 101 VAL N N 101 116.230 116.230 120.500 -4.270 26060 4173 1 6 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.119 0.151 26060 4174 1 6 . 1 1 101 101 VAL C C 101 171.600 171.600 173.567 -1.967 26060 4175 1 6 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.533 0.727 26060 4176 1 6 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.399 -0.219 26060 4177 1 6 . 1 1 101 101 VAL H H 101 8.120 8.120 7.749 0.371 26060 4178 1 6 . 1 1 102 102 ARG N N 102 124.980 124.980 127.630 -2.650 26060 4179 1 6 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.708 0.452 26060 4180 1 6 . 1 1 102 102 ARG C C 102 174.340 174.340 175.297 -0.957 26060 4181 1 6 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.781 -1.031 26060 4182 1 6 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.405 1.945 26060 4183 1 6 . 1 1 102 102 ARG H H 102 7.930 7.930 8.293 -0.363 26060 4184 1 6 . 1 1 103 103 PHE N N 103 124.590 124.590 126.148 -1.558 26060 4185 1 6 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.701 0.091 26060 4186 1 6 . 1 1 103 103 PHE C C 103 174.280 174.280 174.812 -0.532 26060 4187 1 6 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.347 1.633 26060 4188 1 6 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.262 2.988 26060 4189 1 6 . 1 1 103 103 PHE H H 103 9.390 9.390 9.115 0.275 26060 4190 1 6 . 1 1 104 104 ASP N N 104 124.700 124.700 124.462 0.238 26060 4191 1 6 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.427 0.372 26060 4192 1 6 . 1 1 104 104 ASP C C 104 174.500 174.500 175.236 -0.736 26060 4193 1 6 . 1 1 104 104 ASP CA C 104 54.390 54.390 53.827 0.563 26060 4194 1 6 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.294 0.936 26060 4195 1 6 . 1 1 104 104 ASP H H 104 9.010 9.010 8.737 0.273 26060 4196 1 6 . 1 1 105 105 TYR N N 105 129.840 129.840 124.325 5.515 26060 4197 1 6 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.482 -0.382 26060 4198 1 6 . 1 1 105 105 TYR C C 105 173.100 173.100 173.779 -0.679 26060 4199 1 6 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.254 1.426 26060 4200 1 6 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.821 1.029 26060 4201 1 6 . 1 1 105 105 TYR H H 105 8.140 8.140 8.356 -0.216 26060 4202 1 6 . 1 1 106 106 ASP N N 106 126.800 126.800 128.315 -1.515 26060 4203 1 6 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.291 -0.071 26060 4204 1 6 . 1 1 106 106 ASP C C 106 172.900 172.900 174.474 -1.574 26060 4205 1 6 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.991 -0.481 26060 4206 1 6 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.191 -1.691 26060 4207 1 6 . 1 1 106 106 ASP H H 106 7.730 7.730 8.391 -0.661 26060 4208 1 6 . 1 1 107 107 LEU N N 107 132.150 132.150 128.286 3.864 26060 4209 1 6 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.471 -0.631 26060 4210 1 6 . 1 1 107 107 LEU C C 107 172.100 172.100 174.727 -2.627 26060 4211 1 6 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.626 0.074 26060 4212 1 6 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.938 -1.698 26060 4213 1 6 . 1 1 107 107 LEU H H 107 7.770 7.770 7.769 0.001 26060 4214 1 6 . 1 1 108 108 PHE N N 108 118.960 118.960 121.908 -2.948 26060 4215 1 6 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.856 -0.166 26060 4216 1 6 . 1 1 108 108 PHE C C 108 174.300 174.300 173.540 0.760 26060 4217 1 6 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.286 -0.596 26060 4218 1 6 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.960 -0.670 26060 4219 1 6 . 1 1 108 108 PHE H H 108 6.060 6.060 7.144 -1.084 26060 4220 1 6 . 1 1 109 109 LEU N N 109 118.900 118.900 122.181 -3.281 26060 4221 1 6 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.600 -0.200 26060 4222 1 6 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.297 -1.137 26060 4223 1 6 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.609 -1.529 26060 4224 1 6 . 1 1 109 109 LEU H H 109 8.388 8.388 8.294 0.094 26060 4225 1 6 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.535 -0.095 26060 4226 1 6 . 1 1 111 111 LEU C C 111 177.300 177.300 176.756 0.544 26060 4227 1 6 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.014 -0.794 26060 4228 1 6 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.820 1.050 26060 4229 1 6 . 1 1 112 112 GLU N N 112 120.660 120.660 125.350 -4.690 26060 4230 1 6 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.054 0.116 26060 4231 1 6 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.341 0.119 26060 4232 1 6 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.892 -0.202 26060 4233 1 6 . 1 1 112 112 GLU H H 112 8.780 8.780 8.901 -0.121 26060 4234 1 6 . 1 1 113 113 GLY C C 113 173.900 173.900 173.695 0.205 26060 4235 1 6 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.922 0.028 26060 4236 1 6 . 1 1 114 114 HIS N N 114 120.890 120.890 120.205 0.685 26060 4237 1 6 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.141 -0.235 26060 4238 1 6 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.268 0.502 26060 4239 1 6 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.271 -0.681 26060 4240 1 6 . 1 1 114 114 HIS H H 114 7.934 7.934 7.835 0.099 26060 4241 1 6 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.128 -0.328 26060 4242 1 6 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.222 0.868 26060 4243 1 6 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.762 -1.081 26060 4244 1 6 . 1 1 116 116 PRO C C 116 176.600 176.600 175.864 0.736 26060 4245 1 6 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.225 0.075 26060 4246 1 6 . 1 1 117 117 VAL N N 117 127.480 127.480 127.326 0.154 26060 4247 1 6 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.276 -0.486 26060 4248 1 6 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.826 0.874 26060 4249 1 6 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.162 0.038 26060 4250 1 6 . 1 1 117 117 VAL H H 117 8.890 8.890 8.021 0.869 26060 4251 1 6 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.055 -0.065 26060 4252 1 6 . 1 1 118 118 ASN C C 118 172.700 172.700 173.654 -0.954 26060 4253 1 6 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.272 0.088 26060 4254 1 6 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.314 -1.114 26060 4255 1 6 . 1 1 119 119 HIS N N 119 124.930 124.930 126.249 -1.319 26060 4256 1 6 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.120 -0.300 26060 4257 1 6 . 1 1 119 119 HIS C C 119 173.500 173.500 172.879 0.621 26060 4258 1 6 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.152 1.818 26060 4259 1 6 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.163 0.507 26060 4260 1 6 . 1 1 119 119 HIS H H 119 8.790 8.790 9.081 -0.291 26060 4261 1 6 . 1 1 120 120 LEU N N 120 128.280 128.280 123.381 4.899 26060 4262 1 6 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.148 -0.198 26060 4263 1 6 . 1 1 120 120 LEU C C 120 174.030 174.030 175.030 -1.000 26060 4264 1 6 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.672 0.768 26060 4265 1 6 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.616 -0.016 26060 4266 1 6 . 1 1 120 120 LEU H H 120 7.460 7.460 8.087 -0.627 26060 4267 1 6 . 1 1 121 121 ARG N N 121 128.060 128.060 120.816 7.244 26060 4268 1 6 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.625 0.014 26060 4269 1 6 . 1 1 121 121 ARG C C 121 173.400 173.400 173.191 0.209 26060 4270 1 6 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.767 -0.407 26060 4271 1 6 . 1 1 121 121 ARG CB C 121 34.260 34.260 31.966 2.294 26060 4272 1 6 . 1 1 121 121 ARG H H 121 9.860 9.860 9.008 0.852 26060 4273 1 6 . 1 1 122 122 CYS N N 122 125.290 125.290 121.227 4.063 26060 4274 1 6 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.214 -0.194 26060 4275 1 6 . 1 1 122 122 CYS C C 122 174.600 174.600 174.513 0.087 26060 4276 1 6 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.847 1.443 26060 4277 1 6 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.862 -1.832 26060 4278 1 6 . 1 1 122 122 CYS H H 122 8.835 8.835 8.834 0.001 26060 4279 1 6 . 1 1 123 123 GLU N N 123 125.920 125.920 124.141 1.779 26060 4280 1 6 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.563 0.117 26060 4281 1 6 . 1 1 123 123 GLU C C 123 174.500 174.500 174.774 -0.274 26060 4282 1 6 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.273 0.147 26060 4283 1 6 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.684 0.899 26060 4284 1 6 . 1 1 123 123 GLU H H 123 8.970 8.970 9.101 -0.131 26060 4285 1 6 . 1 1 124 124 LYS N N 124 121.837 121.837 122.821 -0.984 26060 4286 1 6 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.957 0.003 26060 4287 1 6 . 1 1 124 124 LYS C C 124 175.700 175.700 175.647 0.053 26060 4288 1 6 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.083 0.274 26060 4289 1 6 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.593 -0.404 26060 4290 1 6 . 1 1 124 124 LYS H H 124 8.652 8.652 8.342 0.310 26060 4291 1 6 . 1 1 125 125 LEU N N 125 127.000 127.000 129.655 -2.655 26060 4292 1 6 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.618 0.032 26060 4293 1 6 . 1 1 125 125 LEU C C 125 175.110 175.110 175.419 -0.309 26060 4294 1 6 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.878 -0.024 26060 4295 1 6 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.608 0.659 26060 4296 1 6 . 1 1 125 125 LEU H H 125 9.175 9.175 9.135 0.040 26060 4297 1 6 . 1 1 126 126 THR N N 126 117.779 117.779 119.776 -1.997 26060 4298 1 6 . 1 1 126 126 THR HA H 126 4.650 4.650 4.543 0.107 26060 4299 1 6 . 1 1 126 126 THR C C 126 173.200 173.200 173.504 -0.304 26060 4300 1 6 . 1 1 126 126 THR CA C 126 62.036 62.036 61.596 0.440 26060 4301 1 6 . 1 1 126 126 THR CB C 126 70.284 70.284 69.335 0.948 26060 4302 1 6 . 1 1 126 126 THR H H 126 8.331 8.331 8.423 -0.092 26060 4303 1 6 . 1 1 127 127 PHE N N 127 126.576 126.576 126.060 0.516 26060 4304 1 6 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.656 -0.066 26060 4305 1 6 . 1 1 127 127 PHE C C 127 174.860 174.860 174.583 0.277 26060 4306 1 6 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.475 0.389 26060 4307 1 6 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.033 -1.034 26060 4308 1 6 . 1 1 127 127 PHE H H 127 9.051 9.051 8.771 0.280 26060 4309 1 6 . 1 1 128 128 ASN N N 128 123.040 123.040 124.078 -1.038 26060 4310 1 6 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.679 -0.059 26060 4311 1 6 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.104 0.376 26060 4312 1 6 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.746 0.714 26060 4313 1 6 . 1 1 128 128 ASN H H 128 8.880 8.880 8.841 0.039 26060 4314 1 6 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.524 0.236 26060 4315 1 6 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.651 -0.751 26060 4316 1 6 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.408 1.322 26060 4317 1 6 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.666 0.124 26060 4318 1 6 . 1 1 130 130 PRO C C 130 177.470 177.470 177.070 0.400 26060 4319 1 6 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.407 0.167 26060 4320 1 6 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.861 -0.551 26060 4321 1 6 . 1 1 131 131 THR N N 131 113.400 113.400 116.404 -3.004 26060 4322 1 6 . 1 1 131 131 THR HA H 131 4.300 4.300 4.087 0.213 26060 4323 1 6 . 1 1 131 131 THR C C 131 175.200 175.200 176.141 -0.941 26060 4324 1 6 . 1 1 131 131 THR CA C 131 62.200 62.200 62.435 -0.235 26060 4325 1 6 . 1 1 131 131 THR CB C 131 70.600 70.600 70.429 0.171 26060 4326 1 6 . 1 1 131 131 THR H H 131 8.950 8.950 8.435 0.515 26060 4327 1 6 . 1 1 132 132 GLU N N 132 122.199 122.199 125.843 -3.644 26060 4328 1 6 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.998 0.012 26060 4329 1 6 . 1 1 132 132 GLU C C 132 178.700 178.700 178.498 0.202 26060 4330 1 6 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.164 0.130 26060 4331 1 6 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.657 -0.496 26060 4332 1 6 . 1 1 132 132 GLU H H 132 8.932 8.932 8.996 -0.064 26060 4333 1 6 . 1 1 133 133 ASP N N 133 116.324 116.324 119.758 -3.434 26060 4334 1 6 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.371 -0.041 26060 4335 1 6 . 1 1 133 133 ASP C C 133 177.800 177.800 179.040 -1.240 26060 4336 1 6 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.763 -0.217 26060 4337 1 6 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.647 1.176 26060 4338 1 6 . 1 1 133 133 ASP H H 133 8.490 8.490 8.116 0.374 26060 4339 1 6 . 1 1 134 134 PHE N N 134 119.914 119.914 121.566 -1.652 26060 4340 1 6 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.301 0.309 26060 4341 1 6 . 1 1 134 134 PHE C C 134 177.300 177.300 177.087 0.213 26060 4342 1 6 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.618 -0.080 26060 4343 1 6 . 1 1 134 134 PHE CB C 134 39.200 39.200 39.002 0.198 26060 4344 1 6 . 1 1 134 134 PHE H H 134 7.787 7.787 7.604 0.183 26060 4345 1 6 . 1 1 135 135 ARG N N 135 119.794 119.794 120.634 -0.840 26060 4346 1 6 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.496 -0.146 26060 4347 1 6 . 1 1 135 135 ARG C C 135 177.370 177.370 178.275 -0.905 26060 4348 1 6 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.175 0.201 26060 4349 1 6 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.133 0.263 26060 4350 1 6 . 1 1 135 135 ARG H H 135 9.087 9.087 8.668 0.419 26060 4351 1 6 . 1 1 136 136 ARG N N 136 114.554 114.554 118.902 -4.348 26060 4352 1 6 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.919 -0.099 26060 4353 1 6 . 1 1 136 136 ARG C C 136 178.950 178.950 178.699 0.251 26060 4354 1 6 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.729 0.071 26060 4355 1 6 . 1 1 136 136 ARG CB C 136 30.217 30.217 29.988 0.228 26060 4356 1 6 . 1 1 136 136 ARG H H 136 7.747 7.747 8.552 -0.805 26060 4357 1 6 . 1 1 137 137 LYS N N 137 118.298 118.298 118.751 -0.453 26060 4358 1 6 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.025 -0.125 26060 4359 1 6 . 1 1 137 137 LYS C C 137 177.980 177.980 178.994 -1.014 26060 4360 1 6 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.407 0.988 26060 4361 1 6 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.518 -0.071 26060 4362 1 6 . 1 1 137 137 LYS H H 137 7.154 7.154 7.387 -0.233 26060 4363 1 6 . 1 1 138 138 LEU N N 138 117.159 117.159 119.259 -2.100 26060 4364 1 6 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.738 -0.318 26060 4365 1 6 . 1 1 138 138 LEU C C 138 179.100 179.100 178.585 0.515 26060 4366 1 6 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.273 -0.042 26060 4367 1 6 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.453 0.875 26060 4368 1 6 . 1 1 138 138 LEU H H 138 7.709 7.709 7.866 -0.157 26060 4369 1 6 . 1 1 139 139 LEU N N 139 115.158 115.158 116.699 -1.541 26060 4370 1 6 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.114 0.036 26060 4371 1 6 . 1 1 139 139 LEU C C 139 177.600 177.600 178.576 -0.976 26060 4372 1 6 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.485 -0.956 26060 4373 1 6 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.907 -0.163 26060 4374 1 6 . 1 1 139 139 LEU H H 139 7.507 7.507 8.218 -0.711 26060 4375 1 6 . 1 1 140 140 LYS N N 140 120.256 120.256 118.415 1.841 26060 4376 1 6 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.071 0.039 26060 4377 1 6 . 1 1 140 140 LYS C C 140 175.800 175.800 177.075 -1.275 26060 4378 1 6 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.050 0.002 26060 4379 1 6 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.468 0.178 26060 4380 1 6 . 1 1 140 140 LYS H H 140 7.304 7.304 7.493 -0.189 26060 4381 1 7 . 1 1 4 4 MET C C 4 175.800 175.800 174.403 1.397 26060 4382 1 7 . 1 1 4 4 MET CA C 4 55.350 55.350 55.090 0.260 26060 4383 1 7 . 1 1 4 4 MET CB C 4 32.880 32.880 32.752 0.128 26060 4384 1 7 . 1 1 5 5 ALA N N 5 125.230 125.230 127.477 -2.247 26060 4385 1 7 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.586 -0.236 26060 4386 1 7 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.636 0.794 26060 4387 1 7 . 1 1 5 5 ALA CB C 5 19.370 19.370 21.150 -1.780 26060 4388 1 7 . 1 1 5 5 ALA H H 5 8.320 8.320 8.231 0.089 26060 4389 1 7 . 1 1 6 6 SER HA H 6 4.490 4.490 4.321 0.169 26060 4390 1 7 . 1 1 6 6 SER CA C 6 58.200 58.200 58.514 -0.314 26060 4391 1 7 . 1 1 6 6 SER CB C 6 63.700 63.700 63.025 0.675 26060 4392 1 7 . 1 1 7 7 SER HA H 7 4.530 4.530 4.732 -0.202 26060 4393 1 7 . 1 1 7 7 SER CA C 7 58.200 58.200 58.198 0.002 26060 4394 1 7 . 1 1 7 7 SER CB C 7 63.700 63.700 63.551 0.149 26060 4395 1 7 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.810 -0.200 26060 4396 1 7 . 1 1 8 8 CYS C C 8 173.500 173.500 173.175 0.325 26060 4397 1 7 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.543 1.797 26060 4398 1 7 . 1 1 8 8 CYS CB C 8 28.490 28.490 29.856 -1.366 26060 4399 1 7 . 1 1 9 9 ALA N N 9 124.700 124.700 128.742 -4.042 26060 4400 1 7 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.825 -0.035 26060 4401 1 7 . 1 1 9 9 ALA C C 9 177.400 177.400 177.129 0.271 26060 4402 1 7 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.922 1.148 26060 4403 1 7 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.977 0.652 26060 4404 1 7 . 1 1 9 9 ALA H H 9 7.960 7.960 8.347 -0.387 26060 4405 1 7 . 1 1 10 10 VAL N N 10 120.124 120.124 124.096 -3.972 26060 4406 1 7 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.131 0.159 26060 4407 1 7 . 1 1 10 10 VAL C C 10 173.900 173.900 175.089 -1.189 26060 4408 1 7 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.596 -0.046 26060 4409 1 7 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.449 2.451 26060 4410 1 7 . 1 1 10 10 VAL H H 10 8.424 8.424 8.473 -0.049 26060 4411 1 7 . 1 1 11 11 GLN N N 11 125.818 125.818 126.791 -0.973 26060 4412 1 7 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.374 0.186 26060 4413 1 7 . 1 1 11 11 GLN C C 11 175.400 175.400 175.211 0.189 26060 4414 1 7 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.495 -0.371 26060 4415 1 7 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.335 1.694 26060 4416 1 7 . 1 1 11 11 GLN H H 11 8.636 8.636 8.580 0.056 26060 4417 1 7 . 1 1 12 12 VAL N N 12 119.106 119.106 118.968 0.138 26060 4418 1 7 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.423 0.207 26060 4419 1 7 . 1 1 12 12 VAL C C 12 173.800 173.800 174.617 -0.817 26060 4420 1 7 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.354 0.446 26060 4421 1 7 . 1 1 12 12 VAL CB C 12 35.711 35.711 34.041 1.670 26060 4422 1 7 . 1 1 12 12 VAL H H 12 8.827 8.827 9.082 -0.255 26060 4423 1 7 . 1 1 13 13 LYS N N 13 121.700 121.700 125.081 -3.381 26060 4424 1 7 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.304 -0.104 26060 4425 1 7 . 1 1 13 13 LYS C C 13 175.030 175.030 175.860 -0.830 26060 4426 1 7 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.990 0.440 26060 4427 1 7 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.595 1.325 26060 4428 1 7 . 1 1 13 13 LYS H H 13 8.234 8.234 8.546 -0.312 26060 4429 1 7 . 1 1 14 14 LEU N N 14 119.100 119.100 124.510 -5.410 26060 4430 1 7 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.172 -0.222 26060 4431 1 7 . 1 1 14 14 LEU C C 14 175.110 175.110 175.321 -0.211 26060 4432 1 7 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.515 -0.158 26060 4433 1 7 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.679 1.242 26060 4434 1 7 . 1 1 14 14 LEU H H 14 8.840 8.840 8.535 0.305 26060 4435 1 7 . 1 1 15 15 GLU N N 15 120.978 120.978 122.930 -1.952 26060 4436 1 7 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.171 -0.181 26060 4437 1 7 . 1 1 15 15 GLU C C 15 173.800 173.800 175.022 -1.222 26060 4438 1 7 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.598 0.830 26060 4439 1 7 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.686 -0.860 26060 4440 1 7 . 1 1 15 15 GLU H H 15 9.181 9.181 9.375 -0.194 26060 4441 1 7 . 1 1 16 16 LEU N N 16 124.438 124.438 126.717 -2.279 26060 4442 1 7 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.327 -0.217 26060 4443 1 7 . 1 1 16 16 LEU C C 16 174.700 174.700 176.212 -1.512 26060 4444 1 7 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.688 0.389 26060 4445 1 7 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.439 2.453 26060 4446 1 7 . 1 1 16 16 LEU H H 16 8.891 8.891 8.933 -0.042 26060 4447 1 7 . 1 1 17 17 GLY N N 17 108.067 108.067 108.421 -0.354 26060 4448 1 7 . 1 1 17 17 GLY C C 17 170.350 170.350 172.363 -2.013 26060 4449 1 7 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.271 1.713 26060 4450 1 7 . 1 1 17 17 GLY H H 17 7.227 7.227 8.470 -1.243 26060 4451 1 7 . 1 1 18 18 HIS N N 18 111.200 111.200 118.423 -7.223 26060 4452 1 7 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.889 -0.269 26060 4453 1 7 . 1 1 18 18 HIS C C 18 172.400 172.400 172.729 -0.329 26060 4454 1 7 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.733 -0.793 26060 4455 1 7 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.474 1.686 26060 4456 1 7 . 1 1 18 18 HIS H H 18 8.150 8.150 9.134 -0.984 26060 4457 1 7 . 1 1 19 19 ARG N N 19 117.800 117.800 121.884 -4.084 26060 4458 1 7 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.839 0.261 26060 4459 1 7 . 1 1 19 19 ARG C C 19 175.800 175.800 174.252 1.548 26060 4460 1 7 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.088 -0.588 26060 4461 1 7 . 1 1 19 19 ARG CB C 19 34.650 34.650 34.984 -0.334 26060 4462 1 7 . 1 1 19 19 ARG H H 19 9.010 9.010 8.891 0.119 26060 4463 1 7 . 1 1 20 20 ALA N N 20 120.390 120.390 122.345 -1.955 26060 4464 1 7 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.655 -0.125 26060 4465 1 7 . 1 1 20 20 ALA C C 20 175.800 175.800 175.154 0.646 26060 4466 1 7 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.762 1.428 26060 4467 1 7 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.211 0.539 26060 4468 1 7 . 1 1 20 20 ALA H H 20 8.070 8.070 8.453 -0.383 26060 4469 1 7 . 1 1 21 21 GLN N N 21 121.790 121.790 121.379 0.411 26060 4470 1 7 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.881 0.349 26060 4471 1 7 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.346 -0.016 26060 4472 1 7 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.801 0.099 26060 4473 1 7 . 1 1 21 21 GLN H H 21 9.240 9.240 8.965 0.275 26060 4474 1 7 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.690 -1.060 26060 4475 1 7 . 1 1 22 22 VAL C C 22 176.500 176.500 175.479 1.021 26060 4476 1 7 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.897 3.134 26060 4477 1 7 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.858 -2.258 26060 4478 1 7 . 1 1 23 23 ARG N N 23 127.840 127.840 127.158 0.682 26060 4479 1 7 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.609 -0.479 26060 4480 1 7 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.110 1.490 26060 4481 1 7 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.924 1.226 26060 4482 1 7 . 1 1 23 23 ARG H H 23 8.720 8.720 8.479 0.241 26060 4483 1 7 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.141 -0.101 26060 4484 1 7 . 1 1 24 24 LYS C C 24 176.960 176.960 176.214 0.746 26060 4485 1 7 . 1 1 24 24 LYS CA C 24 58.800 58.800 58.145 0.655 26060 4486 1 7 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.640 -0.580 26060 4487 1 7 . 1 1 25 25 LYS N N 25 115.870 115.870 119.272 -3.402 26060 4488 1 7 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.620 0.210 26060 4489 1 7 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.518 -0.558 26060 4490 1 7 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.129 1.951 26060 4491 1 7 . 1 1 25 25 LYS H H 25 7.720 7.720 7.735 -0.015 26060 4492 1 7 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.626 0.204 26060 4493 1 7 . 1 1 26 26 PRO C C 26 177.400 177.400 176.836 0.564 26060 4494 1 7 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.810 -0.160 26060 4495 1 7 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.374 0.016 26060 4496 1 7 . 1 1 27 27 THR N N 27 111.270 111.270 114.877 -3.607 26060 4497 1 7 . 1 1 27 27 THR HA H 27 4.530 4.530 4.156 0.374 26060 4498 1 7 . 1 1 27 27 THR C C 27 177.300 177.300 176.952 0.348 26060 4499 1 7 . 1 1 27 27 THR CA C 27 61.300 61.300 61.602 -0.302 26060 4500 1 7 . 1 1 27 27 THR CB C 27 71.460 71.460 69.897 1.563 26060 4501 1 7 . 1 1 27 27 THR H H 27 8.380 8.380 8.078 0.302 26060 4502 1 7 . 1 1 28 28 VAL N N 28 121.170 121.170 122.106 -0.936 26060 4503 1 7 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.803 0.080 26060 4504 1 7 . 1 1 28 28 VAL C C 28 177.030 177.030 176.018 1.012 26060 4505 1 7 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.099 0.101 26060 4506 1 7 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.634 -0.234 26060 4507 1 7 . 1 1 28 28 VAL H H 28 8.910 8.910 8.520 0.390 26060 4508 1 7 . 1 1 29 29 GLU N N 29 116.800 116.800 116.791 0.009 26060 4509 1 7 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.227 -0.307 26060 4510 1 7 . 1 1 29 29 GLU C C 29 176.200 176.200 175.800 0.400 26060 4511 1 7 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.297 1.953 26060 4512 1 7 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.531 -1.361 26060 4513 1 7 . 1 1 29 29 GLU H H 29 7.990 7.990 7.882 0.108 26060 4514 1 7 . 1 1 30 30 GLY N N 30 105.500 105.500 107.920 -2.420 26060 4515 1 7 . 1 1 30 30 GLY C C 30 174.900 174.900 173.989 0.911 26060 4516 1 7 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.248 -0.788 26060 4517 1 7 . 1 1 30 30 GLY H H 30 7.950 7.950 7.850 0.100 26060 4518 1 7 . 1 1 31 31 PHE N N 31 119.300 119.300 119.040 0.260 26060 4519 1 7 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.908 -0.148 26060 4520 1 7 . 1 1 31 31 PHE C C 31 176.400 176.400 176.026 0.374 26060 4521 1 7 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.660 1.240 26060 4522 1 7 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.161 -3.661 26060 4523 1 7 . 1 1 31 31 PHE H H 31 7.520 7.520 7.368 0.152 26060 4524 1 7 . 1 1 32 32 THR N N 32 112.300 112.300 116.208 -3.908 26060 4525 1 7 . 1 1 32 32 THR HA H 32 4.330 4.330 4.437 -0.107 26060 4526 1 7 . 1 1 32 32 THR C C 32 175.200 175.200 174.410 0.790 26060 4527 1 7 . 1 1 32 32 THR CA C 32 62.780 62.780 62.889 -0.109 26060 4528 1 7 . 1 1 32 32 THR CB C 32 70.350 70.350 69.982 0.368 26060 4529 1 7 . 1 1 32 32 THR H H 32 7.770 7.770 9.105 -1.335 26060 4530 1 7 . 1 1 33 33 HIS N N 33 121.900 121.900 122.204 -0.304 26060 4531 1 7 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.230 0.270 26060 4532 1 7 . 1 1 33 33 HIS C C 33 173.880 173.880 173.788 0.092 26060 4533 1 7 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.413 0.367 26060 4534 1 7 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.522 4.118 26060 4535 1 7 . 1 1 33 33 HIS H H 33 9.110 9.110 8.871 0.239 26060 4536 1 7 . 1 1 34 34 ASP N N 34 120.300 120.300 125.357 -5.057 26060 4537 1 7 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.372 0.028 26060 4538 1 7 . 1 1 34 34 ASP C C 34 175.100 175.100 175.365 -0.265 26060 4539 1 7 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.358 -1.048 26060 4540 1 7 . 1 1 34 34 ASP CB C 34 43.100 43.100 42.988 0.112 26060 4541 1 7 . 1 1 34 34 ASP H H 34 8.810 8.810 8.896 -0.086 26060 4542 1 7 . 1 1 35 35 TRP N N 35 119.800 119.800 120.508 -0.708 26060 4543 1 7 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.642 0.088 26060 4544 1 7 . 1 1 35 35 TRP C C 35 174.900 174.900 173.451 1.449 26060 4545 1 7 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.856 0.044 26060 4546 1 7 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.361 1.709 26060 4547 1 7 . 1 1 35 35 TRP H H 35 9.250 9.250 8.842 0.408 26060 4548 1 7 . 1 1 36 36 MET N N 36 120.980 120.980 122.446 -1.466 26060 4549 1 7 . 1 1 36 36 MET HA H 36 5.750 5.750 5.862 -0.112 26060 4550 1 7 . 1 1 36 36 MET C C 36 173.700 173.700 174.340 -0.640 26060 4551 1 7 . 1 1 36 36 MET CA C 36 54.830 54.830 54.216 0.614 26060 4552 1 7 . 1 1 36 36 MET CB C 36 35.220 35.220 36.580 -1.360 26060 4553 1 7 . 1 1 36 36 MET H H 36 9.080 9.080 8.899 0.181 26060 4554 1 7 . 1 1 37 37 VAL N N 37 126.220 126.220 121.607 4.613 26060 4555 1 7 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.135 0.175 26060 4556 1 7 . 1 1 37 37 VAL C C 37 172.300 172.300 174.389 -2.089 26060 4557 1 7 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.856 -1.316 26060 4558 1 7 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.392 1.678 26060 4559 1 7 . 1 1 37 37 VAL H H 37 9.080 9.080 8.949 0.131 26060 4560 1 7 . 1 1 38 38 PHE N N 38 120.640 120.640 122.442 -1.802 26060 4561 1 7 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.291 0.679 26060 4562 1 7 . 1 1 38 38 PHE C C 38 172.960 172.960 175.114 -2.154 26060 4563 1 7 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.774 -0.644 26060 4564 1 7 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.443 -0.443 26060 4565 1 7 . 1 1 38 38 PHE H H 38 8.320 8.320 9.050 -0.730 26060 4566 1 7 . 1 1 39 39 VAL N N 39 116.500 116.500 120.849 -4.349 26060 4567 1 7 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.648 -0.638 26060 4568 1 7 . 1 1 39 39 VAL C C 39 174.700 174.700 174.378 0.322 26060 4569 1 7 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.158 1.482 26060 4570 1 7 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.552 1.848 26060 4571 1 7 . 1 1 39 39 VAL H H 39 8.580 8.580 9.210 -0.630 26060 4572 1 7 . 1 1 40 40 ARG N N 40 124.100 124.100 124.129 -0.029 26060 4573 1 7 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.986 0.094 26060 4574 1 7 . 1 1 40 40 ARG C C 40 173.800 173.800 174.304 -0.504 26060 4575 1 7 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.767 -0.837 26060 4576 1 7 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.603 0.977 26060 4577 1 7 . 1 1 40 40 ARG H H 40 9.880 9.880 8.715 1.165 26060 4578 1 7 . 1 1 41 41 GLY N N 41 107.640 107.640 106.591 1.049 26060 4579 1 7 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.625 1.345 26060 4580 1 7 . 1 1 41 41 GLY H H 41 8.910 8.910 8.607 0.303 26060 4581 1 7 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.308 0.182 26060 4582 1 7 . 1 1 42 42 PRO C C 42 177.300 177.300 177.163 0.137 26060 4583 1 7 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.589 -0.149 26060 4584 1 7 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.442 -0.332 26060 4585 1 7 . 1 1 43 43 GLU N N 43 121.050 121.050 120.205 0.845 26060 4586 1 7 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.131 -0.341 26060 4587 1 7 . 1 1 43 43 GLU C C 43 176.110 176.110 177.752 -1.642 26060 4588 1 7 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.418 -0.568 26060 4589 1 7 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.724 -0.874 26060 4590 1 7 . 1 1 43 43 GLU H H 43 9.060 9.060 8.838 0.222 26060 4591 1 7 . 1 1 44 44 HIS N N 44 114.100 114.100 118.555 -4.455 26060 4592 1 7 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.225 0.126 26060 4593 1 7 . 1 1 44 44 HIS C C 44 175.170 175.170 173.710 1.460 26060 4594 1 7 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.745 -0.095 26060 4595 1 7 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.600 -0.230 26060 4596 1 7 . 1 1 44 44 HIS H H 44 8.420 8.420 8.716 -0.296 26060 4597 1 7 . 1 1 45 45 SER N N 45 115.540 115.540 116.745 -1.205 26060 4598 1 7 . 1 1 45 45 SER HA H 45 4.560 4.560 4.375 0.185 26060 4599 1 7 . 1 1 45 45 SER C C 45 173.700 173.700 174.237 -0.537 26060 4600 1 7 . 1 1 45 45 SER CA C 45 58.710 58.710 57.818 0.892 26060 4601 1 7 . 1 1 45 45 SER CB C 45 65.040 65.040 63.278 1.762 26060 4602 1 7 . 1 1 45 45 SER H H 45 7.870 7.870 7.486 0.384 26060 4603 1 7 . 1 1 46 46 ASN N N 46 123.900 123.900 124.651 -0.751 26060 4604 1 7 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.955 0.165 26060 4605 1 7 . 1 1 46 46 ASN C C 46 176.300 176.300 175.565 0.735 26060 4606 1 7 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.831 -0.141 26060 4607 1 7 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.581 -1.851 26060 4608 1 7 . 1 1 46 46 ASN H H 46 9.480 9.480 8.468 1.012 26060 4609 1 7 . 1 1 47 47 ILE N N 47 115.240 115.240 121.347 -6.107 26060 4610 1 7 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.108 0.832 26060 4611 1 7 . 1 1 47 47 ILE C C 47 176.000 176.000 176.847 -0.847 26060 4612 1 7 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.265 -0.065 26060 4613 1 7 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.270 -1.570 26060 4614 1 7 . 1 1 47 47 ILE H H 47 8.170 8.170 8.611 -0.441 26060 4615 1 7 . 1 1 48 48 GLN N N 48 123.200 123.200 119.390 3.810 26060 4616 1 7 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.149 0.132 26060 4617 1 7 . 1 1 48 48 GLN C C 48 175.670 175.670 176.700 -1.030 26060 4618 1 7 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.189 -0.289 26060 4619 1 7 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.790 -0.800 26060 4620 1 7 . 1 1 48 48 GLN H H 48 8.850 8.850 8.557 0.293 26060 4621 1 7 . 1 1 49 49 HIS N N 49 115.400 115.400 116.396 -0.996 26060 4622 1 7 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.393 0.177 26060 4623 1 7 . 1 1 49 49 HIS C C 49 176.380 176.380 176.891 -0.511 26060 4624 1 7 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.611 0.139 26060 4625 1 7 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.612 1.008 26060 4626 1 7 . 1 1 49 49 HIS H H 49 7.400 7.400 7.544 -0.144 26060 4627 1 7 . 1 1 50 50 PHE N N 50 109.800 109.800 112.651 -2.851 26060 4628 1 7 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.923 0.307 26060 4629 1 7 . 1 1 50 50 PHE C C 50 173.800 173.800 174.267 -0.467 26060 4630 1 7 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.770 -0.110 26060 4631 1 7 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.698 1.302 26060 4632 1 7 . 1 1 50 50 PHE H H 50 7.570 7.570 7.497 0.073 26060 4633 1 7 . 1 1 51 51 VAL N N 51 127.810 127.810 120.562 7.248 26060 4634 1 7 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.824 -0.454 26060 4635 1 7 . 1 1 51 51 VAL C C 51 174.500 174.500 174.552 -0.052 26060 4636 1 7 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.279 1.721 26060 4637 1 7 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.638 -1.358 26060 4638 1 7 . 1 1 51 51 VAL H H 51 7.810 7.810 8.057 -0.247 26060 4639 1 7 . 1 1 52 52 GLU N N 52 130.700 130.700 127.481 3.219 26060 4640 1 7 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.358 -0.378 26060 4641 1 7 . 1 1 52 52 GLU C C 52 175.400 175.400 175.569 -0.169 26060 4642 1 7 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.819 0.281 26060 4643 1 7 . 1 1 52 52 GLU CB C 52 31.580 31.580 31.692 -0.112 26060 4644 1 7 . 1 1 52 52 GLU H H 52 9.380 9.380 9.004 0.376 26060 4645 1 7 . 1 1 53 53 LYS N N 53 109.200 109.200 115.373 -6.173 26060 4646 1 7 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.063 -0.263 26060 4647 1 7 . 1 1 53 53 LYS C C 53 172.300 172.300 174.245 -1.945 26060 4648 1 7 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.570 0.270 26060 4649 1 7 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.146 -1.896 26060 4650 1 7 . 1 1 53 53 LYS H H 53 7.190 7.190 7.765 -0.575 26060 4651 1 7 . 1 1 54 54 VAL N N 54 120.380 120.380 117.619 2.761 26060 4652 1 7 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.671 0.099 26060 4653 1 7 . 1 1 54 54 VAL C C 54 173.600 173.600 173.975 -0.375 26060 4654 1 7 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.279 -0.239 26060 4655 1 7 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.569 -1.869 26060 4656 1 7 . 1 1 54 54 VAL H H 54 8.450 8.450 8.212 0.238 26060 4657 1 7 . 1 1 55 55 VAL N N 55 126.920 126.920 122.957 3.963 26060 4658 1 7 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.163 -0.463 26060 4659 1 7 . 1 1 55 55 VAL C C 55 173.800 173.800 173.834 -0.034 26060 4660 1 7 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.818 0.052 26060 4661 1 7 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.919 -2.819 26060 4662 1 7 . 1 1 55 55 VAL H H 55 9.260 9.260 9.014 0.246 26060 4663 1 7 . 1 1 56 56 PHE N N 56 126.130 126.130 124.418 1.712 26060 4664 1 7 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.020 -0.330 26060 4665 1 7 . 1 1 56 56 PHE C C 56 174.000 174.000 174.316 -0.316 26060 4666 1 7 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.721 -0.141 26060 4667 1 7 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.295 -1.405 26060 4668 1 7 . 1 1 56 56 PHE H H 56 9.290 9.290 9.323 -0.033 26060 4669 1 7 . 1 1 57 57 HIS N N 57 124.180 124.180 124.727 -0.547 26060 4670 1 7 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.927 -0.127 26060 4671 1 7 . 1 1 57 57 HIS C C 57 174.700 174.700 175.085 -0.385 26060 4672 1 7 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.149 0.171 26060 4673 1 7 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.578 1.522 26060 4674 1 7 . 1 1 57 57 HIS H H 57 8.690 8.690 8.564 0.126 26060 4675 1 7 . 1 1 58 58 LEU N N 58 122.050 122.050 123.561 -1.511 26060 4676 1 7 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.376 -0.136 26060 4677 1 7 . 1 1 58 58 LEU C C 58 174.400 174.400 177.043 -2.643 26060 4678 1 7 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.949 0.461 26060 4679 1 7 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.388 -1.228 26060 4680 1 7 . 1 1 58 58 LEU H H 58 9.050 9.050 7.881 1.169 26060 4681 1 7 . 1 1 59 59 HIS N N 59 118.510 118.510 117.948 0.562 26060 4682 1 7 . 1 1 59 59 HIS C C 59 175.300 175.300 176.620 -1.320 26060 4683 1 7 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.509 3.601 26060 4684 1 7 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.451 0.479 26060 4685 1 7 . 1 1 59 59 HIS H H 59 5.160 5.160 7.849 -2.689 26060 4686 1 7 . 1 1 60 60 GLU N N 60 122.190 122.190 125.705 -3.515 26060 4687 1 7 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.036 -0.076 26060 4688 1 7 . 1 1 60 60 GLU C C 60 175.130 175.130 177.125 -1.995 26060 4689 1 7 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.448 -0.438 26060 4690 1 7 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.744 0.076 26060 4691 1 7 . 1 1 60 60 GLU H H 60 7.960 7.960 8.565 -0.605 26060 4692 1 7 . 1 1 61 61 SER N N 61 116.940 116.940 113.947 2.993 26060 4693 1 7 . 1 1 61 61 SER HA H 61 4.200 4.200 4.222 -0.022 26060 4694 1 7 . 1 1 61 61 SER CA C 61 60.010 60.010 59.476 0.534 26060 4695 1 7 . 1 1 61 61 SER CB C 61 63.140 63.140 63.169 -0.029 26060 4696 1 7 . 1 1 61 61 SER H H 61 8.540 8.540 7.910 0.630 26060 4697 1 7 . 1 1 62 62 PHE N N 62 123.700 123.700 121.587 2.113 26060 4698 1 7 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.553 -0.003 26060 4699 1 7 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.382 2.558 26060 4700 1 7 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.816 -0.416 26060 4701 1 7 . 1 1 62 62 PHE H H 62 8.640 8.640 8.122 0.518 26060 4702 1 7 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.481 -0.071 26060 4703 1 7 . 1 1 63 63 PRO C C 63 176.400 176.400 176.449 -0.049 26060 4704 1 7 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.133 -0.533 26060 4705 1 7 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.952 -0.092 26060 4706 1 7 . 1 1 64 64 ARG N N 64 116.840 116.840 121.314 -4.474 26060 4707 1 7 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.057 0.043 26060 4708 1 7 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.012 -0.402 26060 4709 1 7 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.582 0.248 26060 4710 1 7 . 1 1 64 64 ARG H H 64 8.890 8.890 8.775 0.115 26060 4711 1 7 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.383 -0.393 26060 4712 1 7 . 1 1 65 65 PRO C C 65 175.800 175.800 177.147 -1.347 26060 4713 1 7 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.949 1.861 26060 4714 1 7 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.965 -0.085 26060 4715 1 7 . 1 1 66 66 LYS N N 66 119.035 119.035 120.299 -1.264 26060 4716 1 7 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.086 -0.476 26060 4717 1 7 . 1 1 66 66 LYS C C 66 175.400 175.400 175.875 -0.475 26060 4718 1 7 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.603 -0.150 26060 4719 1 7 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.004 -0.274 26060 4720 1 7 . 1 1 66 66 LYS H H 66 7.630 7.630 7.846 -0.216 26060 4721 1 7 . 1 1 67 67 ARG N N 67 127.394 127.394 127.534 -0.140 26060 4722 1 7 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.641 0.099 26060 4723 1 7 . 1 1 67 67 ARG C C 67 174.500 174.500 174.757 -0.257 26060 4724 1 7 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.470 0.330 26060 4725 1 7 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.657 -1.943 26060 4726 1 7 . 1 1 67 67 ARG H H 67 8.855 8.855 8.863 -0.008 26060 4727 1 7 . 1 1 68 68 VAL N N 68 124.388 124.388 119.373 5.015 26060 4728 1 7 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.133 -0.553 26060 4729 1 7 . 1 1 68 68 VAL C C 68 176.850 176.850 175.363 1.487 26060 4730 1 7 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.746 2.326 26060 4731 1 7 . 1 1 68 68 VAL CB C 68 33.604 33.604 34.064 -0.460 26060 4732 1 7 . 1 1 68 68 VAL H H 68 8.681 8.681 8.404 0.277 26060 4733 1 7 . 1 1 69 69 CYS N N 69 127.080 127.080 126.112 0.968 26060 4734 1 7 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.761 0.309 26060 4735 1 7 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.481 0.865 26060 4736 1 7 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.067 1.703 26060 4737 1 7 . 1 1 69 69 CYS H H 69 9.455 9.455 9.013 0.442 26060 4738 1 7 . 1 1 70 70 LYS N N 70 125.480 125.480 123.190 2.290 26060 4739 1 7 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.559 -0.069 26060 4740 1 7 . 1 1 70 70 LYS C C 70 174.300 174.300 175.573 -1.273 26060 4741 1 7 . 1 1 70 70 LYS CA C 70 57.760 57.760 55.919 1.841 26060 4742 1 7 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.089 0.081 26060 4743 1 7 . 1 1 70 70 LYS H H 70 9.050 9.050 8.518 0.532 26060 4744 1 7 . 1 1 71 71 ASP N N 71 116.940 116.940 121.386 -4.446 26060 4745 1 7 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.900 0.200 26060 4746 1 7 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.250 -1.170 26060 4747 1 7 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.093 2.287 26060 4748 1 7 . 1 1 71 71 ASP H H 71 7.620 7.620 7.536 0.084 26060 4749 1 7 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.176 -0.916 26060 4750 1 7 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.706 -2.056 26060 4751 1 7 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.941 -0.901 26060 4752 1 7 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.075 0.025 26060 4753 1 7 . 1 1 73 73 PRO C C 73 174.700 174.700 175.902 -1.202 26060 4754 1 7 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.284 -2.594 26060 4755 1 7 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.275 2.765 26060 4756 1 7 . 1 1 74 74 TYR N N 74 125.400 125.400 124.543 0.857 26060 4757 1 7 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.471 0.379 26060 4758 1 7 . 1 1 74 74 TYR C C 74 172.900 172.900 175.542 -2.642 26060 4759 1 7 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.096 -2.426 26060 4760 1 7 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.190 -3.789 26060 4761 1 7 . 1 1 74 74 TYR H H 74 8.960 8.960 8.264 0.696 26060 4762 1 7 . 1 1 75 75 LYS N N 75 121.400 121.400 119.833 1.567 26060 4763 1 7 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.052 0.538 26060 4764 1 7 . 1 1 75 75 LYS C C 75 173.800 173.800 174.512 -0.712 26060 4765 1 7 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.860 -0.210 26060 4766 1 7 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.546 -0.656 26060 4767 1 7 . 1 1 75 75 LYS H H 75 7.670 7.670 7.966 -0.296 26060 4768 1 7 . 1 1 76 76 VAL N N 76 119.800 119.800 121.439 -1.639 26060 4769 1 7 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.127 -0.237 26060 4770 1 7 . 1 1 76 76 VAL C C 76 173.900 173.900 174.443 -0.543 26060 4771 1 7 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.272 1.458 26060 4772 1 7 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.926 0.614 26060 4773 1 7 . 1 1 76 76 VAL H H 76 8.180 8.180 7.775 0.405 26060 4774 1 7 . 1 1 77 77 GLU N N 77 126.190 126.190 127.676 -1.486 26060 4775 1 7 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.986 -0.036 26060 4776 1 7 . 1 1 77 77 GLU C C 77 174.700 174.700 175.258 -0.558 26060 4777 1 7 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.243 -0.303 26060 4778 1 7 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.717 -0.167 26060 4779 1 7 . 1 1 77 77 GLU H H 77 8.270 8.270 8.663 -0.393 26060 4780 1 7 . 1 1 78 78 GLU N N 78 126.180 126.180 123.302 2.878 26060 4781 1 7 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.576 -0.126 26060 4782 1 7 . 1 1 78 78 GLU C C 78 175.400 175.400 174.040 1.360 26060 4783 1 7 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.988 0.054 26060 4784 1 7 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.953 3.147 26060 4785 1 7 . 1 1 78 78 GLU H H 78 7.870 7.870 8.497 -0.627 26060 4786 1 7 . 1 1 79 79 SER N N 79 112.109 112.109 113.365 -1.256 26060 4787 1 7 . 1 1 79 79 SER HA H 79 5.560 5.560 5.276 0.284 26060 4788 1 7 . 1 1 79 79 SER C C 79 172.490 172.490 173.106 -0.616 26060 4789 1 7 . 1 1 79 79 SER CA C 79 57.754 57.754 56.928 0.826 26060 4790 1 7 . 1 1 79 79 SER CB C 79 65.861 65.861 65.080 0.781 26060 4791 1 7 . 1 1 79 79 SER H H 79 7.714 7.714 8.321 -0.607 26060 4792 1 7 . 1 1 80 80 GLY N N 80 106.048 106.048 111.373 -5.325 26060 4793 1 7 . 1 1 80 80 GLY C C 80 172.630 172.630 171.832 0.798 26060 4794 1 7 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.619 0.951 26060 4795 1 7 . 1 1 80 80 GLY H H 80 8.828 8.828 8.959 -0.131 26060 4796 1 7 . 1 1 81 81 TYR N N 81 115.280 115.280 114.331 0.949 26060 4797 1 7 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.361 0.319 26060 4798 1 7 . 1 1 81 81 TYR C C 81 174.100 174.100 174.064 0.036 26060 4799 1 7 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.066 -1.566 26060 4800 1 7 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.326 2.014 26060 4801 1 7 . 1 1 81 81 TYR H H 81 8.770 8.770 8.108 0.662 26060 4802 1 7 . 1 1 82 82 ALA N N 82 122.350 122.350 122.734 -0.384 26060 4803 1 7 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.603 -0.203 26060 4804 1 7 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.766 0.274 26060 4805 1 7 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.270 1.130 26060 4806 1 7 . 1 1 82 82 ALA H H 82 7.160 7.160 7.434 -0.274 26060 4807 1 7 . 1 1 83 83 GLY N N 83 107.100 107.100 106.676 0.424 26060 4808 1 7 . 1 1 83 83 GLY C C 83 172.500 172.500 173.538 -1.038 26060 4809 1 7 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.042 0.568 26060 4810 1 7 . 1 1 83 83 GLY H H 83 8.220 8.220 8.271 -0.051 26060 4811 1 7 . 1 1 84 84 PHE N N 84 111.660 111.660 114.737 -3.077 26060 4812 1 7 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.483 0.207 26060 4813 1 7 . 1 1 84 84 PHE C C 84 172.460 172.460 173.061 -0.601 26060 4814 1 7 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.409 0.091 26060 4815 1 7 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.418 -0.838 26060 4816 1 7 . 1 1 84 84 PHE H H 84 7.700 7.700 7.906 -0.206 26060 4817 1 7 . 1 1 85 85 ILE N N 85 117.810 117.810 121.522 -3.712 26060 4818 1 7 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.074 0.236 26060 4819 1 7 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.067 -1.727 26060 4820 1 7 . 1 1 85 85 ILE CB C 85 35.260 35.260 36.949 -1.688 26060 4821 1 7 . 1 1 85 85 ILE H H 85 8.340 8.340 8.267 0.073 26060 4822 1 7 . 1 1 86 86 LEU N N 86 108.130 108.130 129.141 -21.011 26060 4823 1 7 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.043 -0.063 26060 4824 1 7 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.979 2.221 26060 4825 1 7 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.291 0.009 26060 4826 1 7 . 1 1 86 86 LEU H H 86 9.900 9.900 8.734 1.166 26060 4827 1 7 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.626 0.474 26060 4828 1 7 . 1 1 87 87 PRO C C 87 175.340 175.340 176.022 -0.682 26060 4829 1 7 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.877 0.233 26060 4830 1 7 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.563 0.997 26060 4831 1 7 . 1 1 88 88 ILE N N 88 126.000 126.000 126.312 -0.312 26060 4832 1 7 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.336 0.454 26060 4833 1 7 . 1 1 88 88 ILE C C 88 176.100 176.100 175.042 1.058 26060 4834 1 7 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.401 0.159 26060 4835 1 7 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.040 1.960 26060 4836 1 7 . 1 1 88 88 ILE H H 88 9.380 9.380 9.065 0.315 26060 4837 1 7 . 1 1 89 89 GLU N N 89 123.900 123.900 125.428 -1.528 26060 4838 1 7 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.256 -0.056 26060 4839 1 7 . 1 1 89 89 GLU C C 89 173.800 173.800 175.582 -1.782 26060 4840 1 7 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.377 -0.407 26060 4841 1 7 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.103 1.277 26060 4842 1 7 . 1 1 89 89 GLU H H 89 9.320 9.320 9.019 0.301 26060 4843 1 7 . 1 1 90 90 VAL N N 90 123.980 123.980 123.848 0.132 26060 4844 1 7 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.143 0.017 26060 4845 1 7 . 1 1 90 90 VAL C C 90 174.800 174.800 174.755 0.045 26060 4846 1 7 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.265 0.725 26060 4847 1 7 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.832 0.658 26060 4848 1 7 . 1 1 90 90 VAL H H 90 8.630 8.630 8.358 0.272 26060 4849 1 7 . 1 1 91 91 TYR N N 91 124.230 124.230 127.457 -3.227 26060 4850 1 7 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.335 0.325 26060 4851 1 7 . 1 1 91 91 TYR C C 91 176.800 176.800 175.687 1.113 26060 4852 1 7 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.297 -1.597 26060 4853 1 7 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.815 1.425 26060 4854 1 7 . 1 1 91 91 TYR H H 91 8.640 8.640 8.974 -0.334 26060 4855 1 7 . 1 1 92 92 PHE N N 92 121.200 121.200 122.247 -1.047 26060 4856 1 7 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.172 0.488 26060 4857 1 7 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.132 1.378 26060 4858 1 7 . 1 1 92 92 PHE CB C 92 42.700 42.700 42.095 0.605 26060 4859 1 7 . 1 1 92 92 PHE H H 92 8.750 8.750 9.040 -0.290 26060 4860 1 7 . 1 1 93 93 LYS N N 93 123.450 123.450 121.912 1.538 26060 4861 1 7 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.598 0.002 26060 4862 1 7 . 1 1 93 93 LYS C C 93 174.200 174.200 175.362 -1.162 26060 4863 1 7 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.738 -0.558 26060 4864 1 7 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.683 -1.003 26060 4865 1 7 . 1 1 93 93 LYS H H 93 8.560 8.560 8.880 -0.320 26060 4866 1 7 . 1 1 94 94 ASN N N 94 118.800 118.800 120.051 -1.251 26060 4867 1 7 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.696 -0.256 26060 4868 1 7 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.522 -1.312 26060 4869 1 7 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.064 -1.264 26060 4870 1 7 . 1 1 94 94 ASN H H 94 7.820 7.820 8.262 -0.442 26060 4871 1 7 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.512 -0.182 26060 4872 1 7 . 1 1 95 95 LYS C C 95 175.800 175.800 175.966 -0.166 26060 4873 1 7 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.627 -0.417 26060 4874 1 7 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.304 -0.294 26060 4875 1 7 . 1 1 96 96 GLU N N 96 118.330 118.330 119.880 -1.550 26060 4876 1 7 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.339 0.171 26060 4877 1 7 . 1 1 96 96 GLU C C 96 173.200 173.200 176.069 -2.869 26060 4878 1 7 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.262 -1.162 26060 4879 1 7 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.524 1.946 26060 4880 1 7 . 1 1 96 96 GLU H H 96 7.120 7.120 8.046 -0.926 26060 4881 1 7 . 1 1 97 97 GLU N N 97 115.630 115.630 119.585 -3.955 26060 4882 1 7 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.165 0.265 26060 4883 1 7 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.356 -1.496 26060 4884 1 7 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.679 0.591 26060 4885 1 7 . 1 1 97 97 GLU H H 97 8.060 8.060 8.304 -0.244 26060 4886 1 7 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.209 0.791 26060 4887 1 7 . 1 1 98 98 PRO C C 98 175.900 175.900 176.530 -0.630 26060 4888 1 7 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.164 -2.004 26060 4889 1 7 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.832 2.167 26060 4890 1 7 . 1 1 99 99 ARG N N 99 122.800 122.800 120.261 2.539 26060 4891 1 7 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.423 0.207 26060 4892 1 7 . 1 1 99 99 ARG C C 99 175.800 175.800 175.489 0.311 26060 4893 1 7 . 1 1 99 99 ARG CA C 99 56.490 56.490 55.931 0.559 26060 4894 1 7 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.374 0.036 26060 4895 1 7 . 1 1 99 99 ARG H H 99 8.602 8.602 8.565 0.037 26060 4896 1 7 . 1 1 100 100 LYS N N 100 113.220 113.220 116.228 -3.008 26060 4897 1 7 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.300 0.640 26060 4898 1 7 . 1 1 100 100 LYS C C 100 174.100 174.100 174.390 -0.290 26060 4899 1 7 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.129 -0.219 26060 4900 1 7 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.753 -1.033 26060 4901 1 7 . 1 1 100 100 LYS H H 100 7.650 7.650 7.327 0.323 26060 4902 1 7 . 1 1 101 101 VAL N N 101 116.230 116.230 120.693 -4.463 26060 4903 1 7 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.104 0.166 26060 4904 1 7 . 1 1 101 101 VAL C C 101 171.600 171.600 173.671 -2.071 26060 4905 1 7 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.368 0.892 26060 4906 1 7 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.331 -0.151 26060 4907 1 7 . 1 1 101 101 VAL H H 101 8.120 8.120 7.734 0.386 26060 4908 1 7 . 1 1 102 102 ARG N N 102 124.980 124.980 127.567 -2.587 26060 4909 1 7 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.779 0.381 26060 4910 1 7 . 1 1 102 102 ARG C C 102 174.340 174.340 175.091 -0.751 26060 4911 1 7 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.634 -0.884 26060 4912 1 7 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.206 2.144 26060 4913 1 7 . 1 1 102 102 ARG H H 102 7.930 7.930 8.256 -0.326 26060 4914 1 7 . 1 1 103 103 PHE N N 103 124.590 124.590 126.778 -2.188 26060 4915 1 7 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.712 0.080 26060 4916 1 7 . 1 1 103 103 PHE C C 103 174.280 174.280 175.130 -0.850 26060 4917 1 7 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.751 1.229 26060 4918 1 7 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.363 1.887 26060 4919 1 7 . 1 1 103 103 PHE H H 103 9.390 9.390 9.097 0.293 26060 4920 1 7 . 1 1 104 104 ASP N N 104 124.700 124.700 126.714 -2.014 26060 4921 1 7 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.796 0.003 26060 4922 1 7 . 1 1 104 104 ASP C C 104 174.500 174.500 174.889 -0.389 26060 4923 1 7 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.159 0.231 26060 4924 1 7 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.885 0.345 26060 4925 1 7 . 1 1 104 104 ASP H H 104 9.010 9.010 8.947 0.063 26060 4926 1 7 . 1 1 105 105 TYR N N 105 129.840 129.840 124.529 5.311 26060 4927 1 7 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.491 -0.391 26060 4928 1 7 . 1 1 105 105 TYR C C 105 173.100 173.100 173.749 -0.649 26060 4929 1 7 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.893 0.787 26060 4930 1 7 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.695 1.155 26060 4931 1 7 . 1 1 105 105 TYR H H 105 8.140 8.140 8.206 -0.066 26060 4932 1 7 . 1 1 106 106 ASP N N 106 126.800 126.800 127.700 -0.900 26060 4933 1 7 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.387 -0.167 26060 4934 1 7 . 1 1 106 106 ASP C C 106 172.900 172.900 174.620 -1.720 26060 4935 1 7 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.406 0.104 26060 4936 1 7 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.241 -1.741 26060 4937 1 7 . 1 1 106 106 ASP H H 106 7.730 7.730 8.321 -0.591 26060 4938 1 7 . 1 1 107 107 LEU N N 107 132.150 132.150 128.456 3.694 26060 4939 1 7 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.359 -0.519 26060 4940 1 7 . 1 1 107 107 LEU C C 107 172.100 172.100 174.800 -2.700 26060 4941 1 7 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.675 0.025 26060 4942 1 7 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.433 -1.193 26060 4943 1 7 . 1 1 107 107 LEU H H 107 7.770 7.770 7.615 0.155 26060 4944 1 7 . 1 1 108 108 PHE N N 108 118.960 118.960 121.765 -2.805 26060 4945 1 7 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.895 -0.205 26060 4946 1 7 . 1 1 108 108 PHE C C 108 174.300 174.300 173.814 0.486 26060 4947 1 7 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.361 -0.671 26060 4948 1 7 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.370 -0.080 26060 4949 1 7 . 1 1 108 108 PHE H H 108 6.060 6.060 7.211 -1.151 26060 4950 1 7 . 1 1 109 109 LEU N N 109 118.900 118.900 123.692 -4.792 26060 4951 1 7 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.805 -0.405 26060 4952 1 7 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.251 -1.091 26060 4953 1 7 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.747 -1.667 26060 4954 1 7 . 1 1 109 109 LEU H H 109 8.388 8.388 8.430 -0.042 26060 4955 1 7 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.478 -0.038 26060 4956 1 7 . 1 1 111 111 LEU C C 111 177.300 177.300 176.955 0.345 26060 4957 1 7 . 1 1 111 111 LEU CA C 111 54.220 54.220 54.779 -0.559 26060 4958 1 7 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.810 1.060 26060 4959 1 7 . 1 1 112 112 GLU N N 112 120.660 120.660 123.321 -2.661 26060 4960 1 7 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.098 0.072 26060 4961 1 7 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.441 0.018 26060 4962 1 7 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.980 -0.290 26060 4963 1 7 . 1 1 112 112 GLU H H 112 8.780 8.780 8.847 -0.067 26060 4964 1 7 . 1 1 113 113 GLY C C 113 173.900 173.900 173.601 0.299 26060 4965 1 7 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.866 0.084 26060 4966 1 7 . 1 1 114 114 HIS N N 114 120.890 120.890 122.223 -1.333 26060 4967 1 7 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.114 -0.208 26060 4968 1 7 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.189 0.581 26060 4969 1 7 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.844 -1.254 26060 4970 1 7 . 1 1 114 114 HIS H H 114 7.934 7.934 7.980 -0.046 26060 4971 1 7 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.082 -0.282 26060 4972 1 7 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.937 1.153 26060 4973 1 7 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.656 -0.976 26060 4974 1 7 . 1 1 116 116 PRO C C 116 176.600 176.600 175.463 1.137 26060 4975 1 7 . 1 1 116 116 PRO CB C 116 32.300 32.300 31.951 0.349 26060 4976 1 7 . 1 1 117 117 VAL N N 117 127.480 127.480 125.473 2.007 26060 4977 1 7 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.251 -0.461 26060 4978 1 7 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.946 0.754 26060 4979 1 7 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.668 -0.468 26060 4980 1 7 . 1 1 117 117 VAL H H 117 8.890 8.890 7.845 1.045 26060 4981 1 7 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.981 0.009 26060 4982 1 7 . 1 1 118 118 ASN C C 118 172.700 172.700 173.634 -0.934 26060 4983 1 7 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.306 0.054 26060 4984 1 7 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.966 -0.766 26060 4985 1 7 . 1 1 119 119 HIS N N 119 124.930 124.930 125.857 -0.927 26060 4986 1 7 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.049 -0.229 26060 4987 1 7 . 1 1 119 119 HIS C C 119 173.500 173.500 172.801 0.699 26060 4988 1 7 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.894 2.076 26060 4989 1 7 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.008 0.662 26060 4990 1 7 . 1 1 119 119 HIS H H 119 8.790 8.790 8.896 -0.106 26060 4991 1 7 . 1 1 120 120 LEU N N 120 128.280 128.280 124.483 3.797 26060 4992 1 7 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.184 -0.234 26060 4993 1 7 . 1 1 120 120 LEU C C 120 174.030 174.030 175.091 -1.061 26060 4994 1 7 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.487 0.953 26060 4995 1 7 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.341 0.259 26060 4996 1 7 . 1 1 120 120 LEU H H 120 7.460 7.460 8.544 -1.084 26060 4997 1 7 . 1 1 121 121 ARG N N 121 128.060 128.060 121.701 6.359 26060 4998 1 7 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.697 -0.057 26060 4999 1 7 . 1 1 121 121 ARG C C 121 173.400 173.400 173.594 -0.194 26060 5000 1 7 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.777 -0.417 26060 5001 1 7 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.089 2.171 26060 5002 1 7 . 1 1 121 121 ARG H H 121 9.860 9.860 9.027 0.833 26060 5003 1 7 . 1 1 122 122 CYS N N 122 125.290 125.290 120.588 4.702 26060 5004 1 7 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.250 -0.230 26060 5005 1 7 . 1 1 122 122 CYS C C 122 174.600 174.600 174.646 -0.046 26060 5006 1 7 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.642 1.648 26060 5007 1 7 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.440 -2.410 26060 5008 1 7 . 1 1 122 122 CYS H H 122 8.835 8.835 8.631 0.204 26060 5009 1 7 . 1 1 123 123 GLU N N 123 125.920 125.920 123.820 2.100 26060 5010 1 7 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.394 0.286 26060 5011 1 7 . 1 1 123 123 GLU C C 123 174.500 174.500 174.753 -0.253 26060 5012 1 7 . 1 1 123 123 GLU CA C 123 54.420 54.420 55.041 -0.621 26060 5013 1 7 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.925 0.658 26060 5014 1 7 . 1 1 123 123 GLU H H 123 8.970 8.970 9.069 -0.099 26060 5015 1 7 . 1 1 124 124 LYS N N 124 121.837 121.837 122.088 -0.251 26060 5016 1 7 . 1 1 124 124 LYS HA H 124 4.960 4.960 5.002 -0.042 26060 5017 1 7 . 1 1 124 124 LYS C C 124 175.700 175.700 175.653 0.047 26060 5018 1 7 . 1 1 124 124 LYS CA C 124 55.357 55.357 54.933 0.424 26060 5019 1 7 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.755 -0.566 26060 5020 1 7 . 1 1 124 124 LYS H H 124 8.652 8.652 8.355 0.297 26060 5021 1 7 . 1 1 125 125 LEU N N 125 127.000 127.000 129.199 -2.199 26060 5022 1 7 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.628 0.022 26060 5023 1 7 . 1 1 125 125 LEU C C 125 175.110 175.110 175.357 -0.247 26060 5024 1 7 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.894 -0.040 26060 5025 1 7 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.960 0.307 26060 5026 1 7 . 1 1 125 125 LEU H H 125 9.175 9.175 9.206 -0.031 26060 5027 1 7 . 1 1 126 126 THR N N 126 117.779 117.779 119.434 -1.655 26060 5028 1 7 . 1 1 126 126 THR HA H 126 4.650 4.650 4.419 0.231 26060 5029 1 7 . 1 1 126 126 THR C C 126 173.200 173.200 173.459 -0.259 26060 5030 1 7 . 1 1 126 126 THR CA C 126 62.036 62.036 61.368 0.668 26060 5031 1 7 . 1 1 126 126 THR CB C 126 70.284 70.284 69.348 0.936 26060 5032 1 7 . 1 1 126 126 THR H H 126 8.331 8.331 8.411 -0.080 26060 5033 1 7 . 1 1 127 127 PHE N N 127 126.576 126.576 126.253 0.323 26060 5034 1 7 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.650 -0.060 26060 5035 1 7 . 1 1 127 127 PHE C C 127 174.860 174.860 174.610 0.250 26060 5036 1 7 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.413 0.452 26060 5037 1 7 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.551 -0.551 26060 5038 1 7 . 1 1 127 127 PHE H H 127 9.051 9.051 8.601 0.450 26060 5039 1 7 . 1 1 128 128 ASN N N 128 123.040 123.040 124.133 -1.093 26060 5040 1 7 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.677 -0.057 26060 5041 1 7 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.100 0.380 26060 5042 1 7 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.642 0.818 26060 5043 1 7 . 1 1 128 128 ASN H H 128 8.880 8.880 8.784 0.096 26060 5044 1 7 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.544 0.216 26060 5045 1 7 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.504 -0.604 26060 5046 1 7 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.565 1.165 26060 5047 1 7 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.684 0.106 26060 5048 1 7 . 1 1 130 130 PRO C C 130 177.470 177.470 176.690 0.780 26060 5049 1 7 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.436 0.138 26060 5050 1 7 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.849 -0.538 26060 5051 1 7 . 1 1 131 131 THR N N 131 113.400 113.400 114.697 -1.297 26060 5052 1 7 . 1 1 131 131 THR HA H 131 4.300 4.300 4.199 0.101 26060 5053 1 7 . 1 1 131 131 THR C C 131 175.200 175.200 176.199 -0.999 26060 5054 1 7 . 1 1 131 131 THR CA C 131 62.200 62.200 61.609 0.591 26060 5055 1 7 . 1 1 131 131 THR CB C 131 70.600 70.600 70.510 0.090 26060 5056 1 7 . 1 1 131 131 THR H H 131 8.950 8.950 8.240 0.710 26060 5057 1 7 . 1 1 132 132 GLU N N 132 122.199 122.199 124.773 -2.574 26060 5058 1 7 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.002 0.008 26060 5059 1 7 . 1 1 132 132 GLU C C 132 178.700 178.700 178.248 0.452 26060 5060 1 7 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.315 -0.021 26060 5061 1 7 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.698 -0.537 26060 5062 1 7 . 1 1 132 132 GLU H H 132 8.932 8.932 9.026 -0.094 26060 5063 1 7 . 1 1 133 133 ASP N N 133 116.324 116.324 119.561 -3.237 26060 5064 1 7 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.401 -0.071 26060 5065 1 7 . 1 1 133 133 ASP C C 133 177.800 177.800 179.247 -1.447 26060 5066 1 7 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.528 0.018 26060 5067 1 7 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.612 1.211 26060 5068 1 7 . 1 1 133 133 ASP H H 133 8.490 8.490 8.226 0.264 26060 5069 1 7 . 1 1 134 134 PHE N N 134 119.914 119.914 122.637 -2.723 26060 5070 1 7 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.328 0.282 26060 5071 1 7 . 1 1 134 134 PHE C C 134 177.300 177.300 176.877 0.423 26060 5072 1 7 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.453 0.085 26060 5073 1 7 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.981 0.219 26060 5074 1 7 . 1 1 134 134 PHE H H 134 7.787 7.787 7.562 0.225 26060 5075 1 7 . 1 1 135 135 ARG N N 135 119.794 119.794 120.574 -0.780 26060 5076 1 7 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.580 -0.230 26060 5077 1 7 . 1 1 135 135 ARG C C 135 177.370 177.370 178.318 -0.948 26060 5078 1 7 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.065 0.311 26060 5079 1 7 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.971 0.425 26060 5080 1 7 . 1 1 135 135 ARG H H 135 9.087 9.087 8.843 0.244 26060 5081 1 7 . 1 1 136 136 ARG N N 136 114.554 114.554 118.608 -4.054 26060 5082 1 7 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.890 -0.070 26060 5083 1 7 . 1 1 136 136 ARG C C 136 178.950 178.950 178.640 0.310 26060 5084 1 7 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.914 -0.114 26060 5085 1 7 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.184 0.033 26060 5086 1 7 . 1 1 136 136 ARG H H 136 7.747 7.747 8.478 -0.731 26060 5087 1 7 . 1 1 137 137 LYS N N 137 118.298 118.298 119.122 -0.824 26060 5088 1 7 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.983 -0.083 26060 5089 1 7 . 1 1 137 137 LYS C C 137 177.980 177.980 179.035 -1.055 26060 5090 1 7 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.567 0.828 26060 5091 1 7 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.410 0.037 26060 5092 1 7 . 1 1 137 137 LYS H H 137 7.154 7.154 7.472 -0.318 26060 5093 1 7 . 1 1 138 138 LEU N N 138 117.159 117.159 118.647 -1.488 26060 5094 1 7 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.692 -0.272 26060 5095 1 7 . 1 1 138 138 LEU C C 138 179.100 179.100 178.526 0.574 26060 5096 1 7 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.065 0.166 26060 5097 1 7 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.402 0.926 26060 5098 1 7 . 1 1 138 138 LEU H H 138 7.709 7.709 7.777 -0.068 26060 5099 1 7 . 1 1 139 139 LEU N N 139 115.158 115.158 117.427 -2.269 26060 5100 1 7 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.076 0.074 26060 5101 1 7 . 1 1 139 139 LEU C C 139 177.600 177.600 178.666 -1.066 26060 5102 1 7 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.766 -1.237 26060 5103 1 7 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.921 -0.177 26060 5104 1 7 . 1 1 139 139 LEU H H 139 7.507 7.507 7.982 -0.475 26060 5105 1 7 . 1 1 140 140 LYS N N 140 120.256 120.256 118.060 2.196 26060 5106 1 7 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.026 0.084 26060 5107 1 7 . 1 1 140 140 LYS C C 140 175.800 175.800 177.039 -1.239 26060 5108 1 7 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.217 -0.165 26060 5109 1 7 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.453 0.193 26060 5110 1 7 . 1 1 140 140 LYS H H 140 7.304 7.304 7.621 -0.317 26060 5111 1 8 . 1 1 4 4 MET C C 4 175.800 175.800 175.514 0.286 26060 5112 1 8 . 1 1 4 4 MET CA C 4 55.350 55.350 56.415 -1.065 26060 5113 1 8 . 1 1 4 4 MET CB C 4 32.880 32.880 33.211 -0.331 26060 5114 1 8 . 1 1 5 5 ALA N N 5 125.230 125.230 120.947 4.283 26060 5115 1 8 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.442 -0.092 26060 5116 1 8 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.765 0.665 26060 5117 1 8 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.591 -0.221 26060 5118 1 8 . 1 1 5 5 ALA H H 5 8.320 8.320 8.071 0.249 26060 5119 1 8 . 1 1 6 6 SER HA H 6 4.490 4.490 4.650 -0.160 26060 5120 1 8 . 1 1 6 6 SER CA C 6 58.200 58.200 57.890 0.310 26060 5121 1 8 . 1 1 6 6 SER CB C 6 63.700 63.700 62.893 0.807 26060 5122 1 8 . 1 1 7 7 SER HA H 7 4.530 4.530 4.847 -0.317 26060 5123 1 8 . 1 1 7 7 SER CA C 7 58.200 58.200 57.661 0.539 26060 5124 1 8 . 1 1 7 7 SER CB C 7 63.700 63.700 63.475 0.225 26060 5125 1 8 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.572 0.038 26060 5126 1 8 . 1 1 8 8 CYS C C 8 173.500 173.500 173.327 0.173 26060 5127 1 8 . 1 1 8 8 CYS CA C 8 58.340 58.340 58.295 0.045 26060 5128 1 8 . 1 1 8 8 CYS CB C 8 28.490 28.490 28.565 -0.075 26060 5129 1 8 . 1 1 9 9 ALA N N 9 124.700 124.700 128.903 -4.203 26060 5130 1 8 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.863 -0.073 26060 5131 1 8 . 1 1 9 9 ALA C C 9 177.400 177.400 176.853 0.547 26060 5132 1 8 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.245 0.825 26060 5133 1 8 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.751 0.878 26060 5134 1 8 . 1 1 9 9 ALA H H 9 7.960 7.960 8.592 -0.632 26060 5135 1 8 . 1 1 10 10 VAL N N 10 120.124 120.124 124.497 -4.373 26060 5136 1 8 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.165 0.125 26060 5137 1 8 . 1 1 10 10 VAL C C 10 173.900 173.900 175.045 -1.145 26060 5138 1 8 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.461 0.089 26060 5139 1 8 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.754 2.146 26060 5140 1 8 . 1 1 10 10 VAL H H 10 8.424 8.424 8.593 -0.169 26060 5141 1 8 . 1 1 11 11 GLN N N 11 125.818 125.818 126.058 -0.240 26060 5142 1 8 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.443 0.117 26060 5143 1 8 . 1 1 11 11 GLN C C 11 175.400 175.400 175.104 0.296 26060 5144 1 8 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.276 -0.153 26060 5145 1 8 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.838 1.191 26060 5146 1 8 . 1 1 11 11 GLN H H 11 8.636 8.636 8.521 0.115 26060 5147 1 8 . 1 1 12 12 VAL N N 12 119.106 119.106 118.400 0.706 26060 5148 1 8 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.438 0.192 26060 5149 1 8 . 1 1 12 12 VAL C C 12 173.800 173.800 174.617 -0.817 26060 5150 1 8 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.321 0.479 26060 5151 1 8 . 1 1 12 12 VAL CB C 12 35.711 35.711 34.195 1.516 26060 5152 1 8 . 1 1 12 12 VAL H H 12 8.827 8.827 9.076 -0.249 26060 5153 1 8 . 1 1 13 13 LYS N N 13 121.700 121.700 125.350 -3.650 26060 5154 1 8 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.334 -0.134 26060 5155 1 8 . 1 1 13 13 LYS C C 13 175.030 175.030 175.905 -0.875 26060 5156 1 8 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.993 0.437 26060 5157 1 8 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.277 1.643 26060 5158 1 8 . 1 1 13 13 LYS H H 13 8.234 8.234 8.575 -0.341 26060 5159 1 8 . 1 1 14 14 LEU N N 14 119.100 119.100 124.792 -5.692 26060 5160 1 8 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.218 -0.268 26060 5161 1 8 . 1 1 14 14 LEU C C 14 175.110 175.110 175.386 -0.276 26060 5162 1 8 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.445 -0.088 26060 5163 1 8 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.682 1.239 26060 5164 1 8 . 1 1 14 14 LEU H H 14 8.840 8.840 8.369 0.471 26060 5165 1 8 . 1 1 15 15 GLU N N 15 120.978 120.978 122.792 -1.814 26060 5166 1 8 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.213 -0.223 26060 5167 1 8 . 1 1 15 15 GLU C C 15 173.800 173.800 174.979 -1.179 26060 5168 1 8 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.559 0.869 26060 5169 1 8 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.776 -0.950 26060 5170 1 8 . 1 1 15 15 GLU H H 15 9.181 9.181 9.310 -0.129 26060 5171 1 8 . 1 1 16 16 LEU N N 16 124.438 124.438 126.359 -1.921 26060 5172 1 8 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.296 -0.186 26060 5173 1 8 . 1 1 16 16 LEU C C 16 174.700 174.700 176.223 -1.523 26060 5174 1 8 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.788 0.288 26060 5175 1 8 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.580 2.312 26060 5176 1 8 . 1 1 16 16 LEU H H 16 8.891 8.891 8.843 0.048 26060 5177 1 8 . 1 1 17 17 GLY N N 17 108.067 108.067 108.452 -0.385 26060 5178 1 8 . 1 1 17 17 GLY C C 17 170.350 170.350 172.365 -2.015 26060 5179 1 8 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.465 1.519 26060 5180 1 8 . 1 1 17 17 GLY H H 17 7.227 7.227 8.499 -1.272 26060 5181 1 8 . 1 1 18 18 HIS N N 18 111.200 111.200 117.996 -6.796 26060 5182 1 8 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.758 -0.138 26060 5183 1 8 . 1 1 18 18 HIS C C 18 172.400 172.400 172.751 -0.351 26060 5184 1 8 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.706 -0.766 26060 5185 1 8 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.272 1.888 26060 5186 1 8 . 1 1 18 18 HIS H H 18 8.150 8.150 9.088 -0.938 26060 5187 1 8 . 1 1 19 19 ARG N N 19 117.800 117.800 121.910 -4.110 26060 5188 1 8 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.971 0.129 26060 5189 1 8 . 1 1 19 19 ARG C C 19 175.800 175.800 174.730 1.070 26060 5190 1 8 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.959 -0.459 26060 5191 1 8 . 1 1 19 19 ARG CB C 19 34.650 34.650 34.128 0.522 26060 5192 1 8 . 1 1 19 19 ARG H H 19 9.010 9.010 8.987 0.023 26060 5193 1 8 . 1 1 20 20 ALA N N 20 120.390 120.390 122.124 -1.734 26060 5194 1 8 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.574 -0.043 26060 5195 1 8 . 1 1 20 20 ALA C C 20 175.800 175.800 175.096 0.704 26060 5196 1 8 . 1 1 20 20 ALA CA C 20 52.190 52.190 51.186 1.004 26060 5197 1 8 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.045 0.705 26060 5198 1 8 . 1 1 20 20 ALA H H 20 8.070 8.070 8.690 -0.620 26060 5199 1 8 . 1 1 21 21 GLN N N 21 121.790 121.790 122.136 -0.346 26060 5200 1 8 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.870 0.360 26060 5201 1 8 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.098 0.232 26060 5202 1 8 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.303 -0.403 26060 5203 1 8 . 1 1 21 21 GLN H H 21 9.240 9.240 8.842 0.398 26060 5204 1 8 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.351 -0.721 26060 5205 1 8 . 1 1 22 22 VAL C C 22 176.500 176.500 175.155 1.345 26060 5206 1 8 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.061 2.969 26060 5207 1 8 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.552 -1.952 26060 5208 1 8 . 1 1 23 23 ARG N N 23 127.840 127.840 127.246 0.594 26060 5209 1 8 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.586 -0.456 26060 5210 1 8 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.254 1.346 26060 5211 1 8 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.927 1.223 26060 5212 1 8 . 1 1 23 23 ARG H H 23 8.720 8.720 8.310 0.410 26060 5213 1 8 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.131 -0.091 26060 5214 1 8 . 1 1 24 24 LYS C C 24 176.960 176.960 176.272 0.688 26060 5215 1 8 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.966 0.834 26060 5216 1 8 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.562 -0.502 26060 5217 1 8 . 1 1 25 25 LYS N N 25 115.870 115.870 118.744 -2.874 26060 5218 1 8 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.644 0.186 26060 5219 1 8 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.004 -0.044 26060 5220 1 8 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.592 1.488 26060 5221 1 8 . 1 1 25 25 LYS H H 25 7.720 7.720 7.670 0.050 26060 5222 1 8 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.733 0.097 26060 5223 1 8 . 1 1 26 26 PRO C C 26 177.400 177.400 176.685 0.715 26060 5224 1 8 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.471 0.180 26060 5225 1 8 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.691 -0.301 26060 5226 1 8 . 1 1 27 27 THR N N 27 111.270 111.270 113.553 -2.283 26060 5227 1 8 . 1 1 27 27 THR HA H 27 4.530 4.530 4.280 0.250 26060 5228 1 8 . 1 1 27 27 THR C C 27 177.300 177.300 176.797 0.503 26060 5229 1 8 . 1 1 27 27 THR CA C 27 61.300 61.300 60.527 0.773 26060 5230 1 8 . 1 1 27 27 THR CB C 27 71.460 71.460 69.903 1.557 26060 5231 1 8 . 1 1 27 27 THR H H 27 8.380 8.380 8.024 0.356 26060 5232 1 8 . 1 1 28 28 VAL N N 28 121.170 121.170 122.828 -1.658 26060 5233 1 8 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.804 0.079 26060 5234 1 8 . 1 1 28 28 VAL C C 28 177.030 177.030 176.104 0.926 26060 5235 1 8 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.096 0.104 26060 5236 1 8 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.651 -0.251 26060 5237 1 8 . 1 1 28 28 VAL H H 28 8.910 8.910 8.507 0.403 26060 5238 1 8 . 1 1 29 29 GLU N N 29 116.800 116.800 118.711 -1.911 26060 5239 1 8 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.128 -0.208 26060 5240 1 8 . 1 1 29 29 GLU C C 29 176.200 176.200 175.992 0.208 26060 5241 1 8 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.416 1.834 26060 5242 1 8 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.342 -1.172 26060 5243 1 8 . 1 1 29 29 GLU H H 29 7.990 7.990 7.957 0.033 26060 5244 1 8 . 1 1 30 30 GLY N N 30 105.500 105.500 107.126 -1.626 26060 5245 1 8 . 1 1 30 30 GLY C C 30 174.900 174.900 173.758 1.142 26060 5246 1 8 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.104 -0.644 26060 5247 1 8 . 1 1 30 30 GLY H H 30 7.950 7.950 7.580 0.370 26060 5248 1 8 . 1 1 31 31 PHE N N 31 119.300 119.300 118.905 0.395 26060 5249 1 8 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.919 -0.159 26060 5250 1 8 . 1 1 31 31 PHE C C 31 176.400 176.400 175.766 0.634 26060 5251 1 8 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.473 1.427 26060 5252 1 8 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.057 -3.557 26060 5253 1 8 . 1 1 31 31 PHE H H 31 7.520 7.520 7.383 0.137 26060 5254 1 8 . 1 1 32 32 THR N N 32 112.300 112.300 115.642 -3.342 26060 5255 1 8 . 1 1 32 32 THR HA H 32 4.330 4.330 4.447 -0.117 26060 5256 1 8 . 1 1 32 32 THR C C 32 175.200 175.200 174.387 0.813 26060 5257 1 8 . 1 1 32 32 THR CA C 32 62.780 62.780 62.693 0.087 26060 5258 1 8 . 1 1 32 32 THR CB C 32 70.350 70.350 70.093 0.257 26060 5259 1 8 . 1 1 32 32 THR H H 32 7.770 7.770 9.030 -1.260 26060 5260 1 8 . 1 1 33 33 HIS N N 33 121.900 121.900 122.125 -0.225 26060 5261 1 8 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.164 0.336 26060 5262 1 8 . 1 1 33 33 HIS C C 33 173.880 173.880 173.757 0.123 26060 5263 1 8 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.883 -0.103 26060 5264 1 8 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.971 3.669 26060 5265 1 8 . 1 1 33 33 HIS H H 33 9.110 9.110 8.859 0.251 26060 5266 1 8 . 1 1 34 34 ASP N N 34 120.300 120.300 124.652 -4.352 26060 5267 1 8 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.472 -0.072 26060 5268 1 8 . 1 1 34 34 ASP C C 34 175.100 175.100 175.444 -0.344 26060 5269 1 8 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.563 -0.253 26060 5270 1 8 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.213 -0.113 26060 5271 1 8 . 1 1 34 34 ASP H H 34 8.810 8.810 8.796 0.014 26060 5272 1 8 . 1 1 35 35 TRP N N 35 119.800 119.800 118.631 1.169 26060 5273 1 8 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.351 0.379 26060 5274 1 8 . 1 1 35 35 TRP C C 35 174.900 174.900 173.241 1.659 26060 5275 1 8 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.293 -0.393 26060 5276 1 8 . 1 1 35 35 TRP CB C 35 35.070 35.070 32.885 2.185 26060 5277 1 8 . 1 1 35 35 TRP H H 35 9.250 9.250 8.861 0.389 26060 5278 1 8 . 1 1 36 36 MET N N 36 120.980 120.980 122.595 -1.615 26060 5279 1 8 . 1 1 36 36 MET HA H 36 5.750 5.750 5.853 -0.103 26060 5280 1 8 . 1 1 36 36 MET C C 36 173.700 173.700 174.587 -0.887 26060 5281 1 8 . 1 1 36 36 MET CA C 36 54.830 54.830 53.986 0.844 26060 5282 1 8 . 1 1 36 36 MET CB C 36 35.220 35.220 36.227 -1.007 26060 5283 1 8 . 1 1 36 36 MET H H 36 9.080 9.080 8.491 0.589 26060 5284 1 8 . 1 1 37 37 VAL N N 37 126.220 126.220 122.501 3.719 26060 5285 1 8 . 1 1 37 37 VAL HA H 37 5.310 5.310 4.911 0.399 26060 5286 1 8 . 1 1 37 37 VAL C C 37 172.300 172.300 174.321 -2.021 26060 5287 1 8 . 1 1 37 37 VAL CA C 37 58.540 58.540 60.379 -1.839 26060 5288 1 8 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.028 2.042 26060 5289 1 8 . 1 1 37 37 VAL H H 37 9.080 9.080 8.916 0.164 26060 5290 1 8 . 1 1 38 38 PHE N N 38 120.640 120.640 123.614 -2.974 26060 5291 1 8 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.256 0.714 26060 5292 1 8 . 1 1 38 38 PHE C C 38 172.960 172.960 174.970 -2.010 26060 5293 1 8 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.839 -0.709 26060 5294 1 8 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.017 -0.017 26060 5295 1 8 . 1 1 38 38 PHE H H 38 8.320 8.320 9.065 -0.745 26060 5296 1 8 . 1 1 39 39 VAL N N 39 116.500 116.500 121.173 -4.673 26060 5297 1 8 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.719 -0.709 26060 5298 1 8 . 1 1 39 39 VAL C C 39 174.700 174.700 174.470 0.230 26060 5299 1 8 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.739 1.901 26060 5300 1 8 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.886 1.514 26060 5301 1 8 . 1 1 39 39 VAL H H 39 8.580 8.580 9.463 -0.883 26060 5302 1 8 . 1 1 40 40 ARG N N 40 124.100 124.100 124.344 -0.244 26060 5303 1 8 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.855 0.225 26060 5304 1 8 . 1 1 40 40 ARG C C 40 173.800 173.800 174.228 -0.428 26060 5305 1 8 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.519 -0.589 26060 5306 1 8 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.688 0.893 26060 5307 1 8 . 1 1 40 40 ARG H H 40 9.880 9.880 8.636 1.244 26060 5308 1 8 . 1 1 41 41 GLY N N 41 107.640 107.640 106.707 0.933 26060 5309 1 8 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.481 1.489 26060 5310 1 8 . 1 1 41 41 GLY H H 41 8.910 8.910 8.541 0.369 26060 5311 1 8 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.343 0.147 26060 5312 1 8 . 1 1 42 42 PRO C C 42 177.300 177.300 176.822 0.478 26060 5313 1 8 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.355 0.085 26060 5314 1 8 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.409 -0.299 26060 5315 1 8 . 1 1 43 43 GLU N N 43 121.050 121.050 122.004 -0.954 26060 5316 1 8 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.977 -0.187 26060 5317 1 8 . 1 1 43 43 GLU C C 43 176.110 176.110 176.220 -0.110 26060 5318 1 8 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.369 -0.519 26060 5319 1 8 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.274 -0.424 26060 5320 1 8 . 1 1 43 43 GLU H H 43 9.060 9.060 8.727 0.333 26060 5321 1 8 . 1 1 44 44 HIS N N 44 114.100 114.100 115.242 -1.142 26060 5322 1 8 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.265 0.086 26060 5323 1 8 . 1 1 44 44 HIS C C 44 175.170 175.170 174.442 0.728 26060 5324 1 8 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.890 -0.240 26060 5325 1 8 . 1 1 44 44 HIS CB C 44 28.370 28.370 29.097 -0.727 26060 5326 1 8 . 1 1 44 44 HIS H H 44 8.420 8.420 8.616 -0.196 26060 5327 1 8 . 1 1 45 45 SER N N 45 115.540 115.540 117.672 -2.132 26060 5328 1 8 . 1 1 45 45 SER HA H 45 4.560 4.560 4.702 -0.142 26060 5329 1 8 . 1 1 45 45 SER C C 45 173.700 173.700 173.400 0.300 26060 5330 1 8 . 1 1 45 45 SER CA C 45 58.710 58.710 57.483 1.226 26060 5331 1 8 . 1 1 45 45 SER CB C 45 65.040 65.040 63.763 1.277 26060 5332 1 8 . 1 1 45 45 SER H H 45 7.870 7.870 7.915 -0.045 26060 5333 1 8 . 1 1 46 46 ASN N N 46 123.900 123.900 124.298 -0.398 26060 5334 1 8 . 1 1 46 46 ASN HA H 46 5.120 5.120 5.016 0.104 26060 5335 1 8 . 1 1 46 46 ASN C C 46 176.300 176.300 175.678 0.622 26060 5336 1 8 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.498 0.192 26060 5337 1 8 . 1 1 46 46 ASN CB C 46 38.730 38.730 41.250 -2.520 26060 5338 1 8 . 1 1 46 46 ASN H H 46 9.480 9.480 8.596 0.884 26060 5339 1 8 . 1 1 47 47 ILE N N 47 115.240 115.240 121.940 -6.700 26060 5340 1 8 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.165 0.775 26060 5341 1 8 . 1 1 47 47 ILE C C 47 176.000 176.000 176.649 -0.649 26060 5342 1 8 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.984 0.216 26060 5343 1 8 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.147 -1.447 26060 5344 1 8 . 1 1 47 47 ILE H H 47 8.170 8.170 8.662 -0.492 26060 5345 1 8 . 1 1 48 48 GLN N N 48 123.200 123.200 119.924 3.276 26060 5346 1 8 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.131 0.149 26060 5347 1 8 . 1 1 48 48 GLN C C 48 175.670 175.670 176.671 -1.001 26060 5348 1 8 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.841 0.059 26060 5349 1 8 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.349 -0.359 26060 5350 1 8 . 1 1 48 48 GLN H H 48 8.850 8.850 8.600 0.250 26060 5351 1 8 . 1 1 49 49 HIS N N 49 115.400 115.400 116.666 -1.266 26060 5352 1 8 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.418 0.152 26060 5353 1 8 . 1 1 49 49 HIS C C 49 176.380 176.380 177.150 -0.770 26060 5354 1 8 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.509 0.241 26060 5355 1 8 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.744 0.876 26060 5356 1 8 . 1 1 49 49 HIS H H 49 7.400 7.400 7.480 -0.080 26060 5357 1 8 . 1 1 50 50 PHE N N 50 109.800 109.800 113.760 -3.960 26060 5358 1 8 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.942 0.288 26060 5359 1 8 . 1 1 50 50 PHE C C 50 173.800 173.800 174.105 -0.305 26060 5360 1 8 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.689 -0.029 26060 5361 1 8 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.641 1.359 26060 5362 1 8 . 1 1 50 50 PHE H H 50 7.570 7.570 7.573 -0.003 26060 5363 1 8 . 1 1 51 51 VAL N N 51 127.810 127.810 120.620 7.190 26060 5364 1 8 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.799 -0.429 26060 5365 1 8 . 1 1 51 51 VAL C C 51 174.500 174.500 174.617 -0.117 26060 5366 1 8 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.611 1.389 26060 5367 1 8 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.806 -1.526 26060 5368 1 8 . 1 1 51 51 VAL H H 51 7.810 7.810 8.084 -0.274 26060 5369 1 8 . 1 1 52 52 GLU N N 52 130.700 130.700 127.908 2.792 26060 5370 1 8 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.480 -0.500 26060 5371 1 8 . 1 1 52 52 GLU C C 52 175.400 175.400 175.659 -0.259 26060 5372 1 8 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.353 0.747 26060 5373 1 8 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.065 -0.484 26060 5374 1 8 . 1 1 52 52 GLU H H 52 9.380 9.380 9.006 0.374 26060 5375 1 8 . 1 1 53 53 LYS N N 53 109.200 109.200 113.619 -4.419 26060 5376 1 8 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.997 -0.197 26060 5377 1 8 . 1 1 53 53 LYS C C 53 172.300 172.300 174.549 -2.249 26060 5378 1 8 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.418 0.422 26060 5379 1 8 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.099 -1.849 26060 5380 1 8 . 1 1 53 53 LYS H H 53 7.190 7.190 7.400 -0.210 26060 5381 1 8 . 1 1 54 54 VAL N N 54 120.380 120.380 117.634 2.746 26060 5382 1 8 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.673 0.097 26060 5383 1 8 . 1 1 54 54 VAL C C 54 173.600 173.600 173.891 -0.291 26060 5384 1 8 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.467 -0.427 26060 5385 1 8 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.658 -1.958 26060 5386 1 8 . 1 1 54 54 VAL H H 54 8.450 8.450 8.310 0.140 26060 5387 1 8 . 1 1 55 55 VAL N N 55 126.920 126.920 122.649 4.271 26060 5388 1 8 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.147 -0.447 26060 5389 1 8 . 1 1 55 55 VAL C C 55 173.800 173.800 173.769 0.031 26060 5390 1 8 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.719 0.151 26060 5391 1 8 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.967 -2.867 26060 5392 1 8 . 1 1 55 55 VAL H H 55 9.260 9.260 9.074 0.186 26060 5393 1 8 . 1 1 56 56 PHE N N 56 126.130 126.130 123.647 2.483 26060 5394 1 8 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.019 -0.329 26060 5395 1 8 . 1 1 56 56 PHE C C 56 174.000 174.000 174.187 -0.187 26060 5396 1 8 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.629 -0.049 26060 5397 1 8 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.982 -2.092 26060 5398 1 8 . 1 1 56 56 PHE H H 56 9.290 9.290 9.251 0.039 26060 5399 1 8 . 1 1 57 57 HIS N N 57 124.180 124.180 123.338 0.842 26060 5400 1 8 . 1 1 57 57 HIS HA H 57 4.800 4.800 5.055 -0.255 26060 5401 1 8 . 1 1 57 57 HIS C C 57 174.700 174.700 174.776 -0.076 26060 5402 1 8 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.050 0.271 26060 5403 1 8 . 1 1 57 57 HIS CB C 57 30.100 30.100 29.252 0.848 26060 5404 1 8 . 1 1 57 57 HIS H H 57 8.690 8.690 8.495 0.195 26060 5405 1 8 . 1 1 58 58 LEU N N 58 122.050 122.050 122.738 -0.688 26060 5406 1 8 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.409 -0.169 26060 5407 1 8 . 1 1 58 58 LEU C C 58 174.400 174.400 176.951 -2.551 26060 5408 1 8 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.741 0.669 26060 5409 1 8 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.456 -1.296 26060 5410 1 8 . 1 1 58 58 LEU H H 58 9.050 9.050 8.275 0.775 26060 5411 1 8 . 1 1 59 59 HIS N N 59 118.510 118.510 118.584 -0.074 26060 5412 1 8 . 1 1 59 59 HIS C C 59 175.300 175.300 176.833 -1.533 26060 5413 1 8 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.847 3.263 26060 5414 1 8 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.884 0.046 26060 5415 1 8 . 1 1 59 59 HIS H H 59 5.160 5.160 7.829 -2.669 26060 5416 1 8 . 1 1 60 60 GLU N N 60 122.190 122.190 125.402 -3.212 26060 5417 1 8 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.031 -0.071 26060 5418 1 8 . 1 1 60 60 GLU C C 60 175.130 175.130 177.115 -1.985 26060 5419 1 8 . 1 1 60 60 GLU CA C 60 59.010 59.010 58.983 0.028 26060 5420 1 8 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.953 -0.133 26060 5421 1 8 . 1 1 60 60 GLU H H 60 7.960 7.960 8.633 -0.673 26060 5422 1 8 . 1 1 61 61 SER N N 61 116.940 116.940 113.361 3.579 26060 5423 1 8 . 1 1 61 61 SER HA H 61 4.200 4.200 4.323 -0.123 26060 5424 1 8 . 1 1 61 61 SER CA C 61 60.010 60.010 59.725 0.285 26060 5425 1 8 . 1 1 61 61 SER CB C 61 63.140 63.140 63.604 -0.464 26060 5426 1 8 . 1 1 61 61 SER H H 61 8.540 8.540 8.174 0.366 26060 5427 1 8 . 1 1 62 62 PHE N N 62 123.700 123.700 121.770 1.930 26060 5428 1 8 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.531 0.019 26060 5429 1 8 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.903 2.037 26060 5430 1 8 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.968 -0.568 26060 5431 1 8 . 1 1 62 62 PHE H H 62 8.640 8.640 8.108 0.532 26060 5432 1 8 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.501 -0.091 26060 5433 1 8 . 1 1 63 63 PRO C C 63 176.400 176.400 176.342 0.058 26060 5434 1 8 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.216 -0.616 26060 5435 1 8 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.947 -0.087 26060 5436 1 8 . 1 1 64 64 ARG N N 64 116.840 116.840 121.453 -4.613 26060 5437 1 8 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.072 0.028 26060 5438 1 8 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.075 -0.465 26060 5439 1 8 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.727 0.103 26060 5440 1 8 . 1 1 64 64 ARG H H 64 8.890 8.890 8.761 0.129 26060 5441 1 8 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.401 -0.411 26060 5442 1 8 . 1 1 65 65 PRO C C 65 175.800 175.800 177.004 -1.204 26060 5443 1 8 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.064 1.746 26060 5444 1 8 . 1 1 65 65 PRO CB C 65 31.880 31.880 32.020 -0.140 26060 5445 1 8 . 1 1 66 66 LYS N N 66 119.035 119.035 119.974 -0.939 26060 5446 1 8 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.227 -0.617 26060 5447 1 8 . 1 1 66 66 LYS C C 66 175.400 175.400 175.860 -0.460 26060 5448 1 8 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.070 0.383 26060 5449 1 8 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.406 -0.676 26060 5450 1 8 . 1 1 66 66 LYS H H 66 7.630 7.630 7.845 -0.215 26060 5451 1 8 . 1 1 67 67 ARG N N 67 127.394 127.394 127.115 0.279 26060 5452 1 8 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.666 0.074 26060 5453 1 8 . 1 1 67 67 ARG C C 67 174.500 174.500 174.699 -0.199 26060 5454 1 8 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.873 -0.073 26060 5455 1 8 . 1 1 67 67 ARG CB C 67 29.714 29.714 32.176 -2.462 26060 5456 1 8 . 1 1 67 67 ARG H H 67 8.855 8.855 8.486 0.369 26060 5457 1 8 . 1 1 68 68 VAL N N 68 124.388 124.388 119.356 5.032 26060 5458 1 8 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.084 -0.504 26060 5459 1 8 . 1 1 68 68 VAL C C 68 176.850 176.850 175.291 1.559 26060 5460 1 8 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.798 2.275 26060 5461 1 8 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.936 -0.332 26060 5462 1 8 . 1 1 68 68 VAL H H 68 8.681 8.681 8.382 0.299 26060 5463 1 8 . 1 1 69 69 CYS N N 69 127.080 127.080 125.985 1.095 26060 5464 1 8 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.760 0.310 26060 5465 1 8 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.777 0.569 26060 5466 1 8 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.899 0.871 26060 5467 1 8 . 1 1 69 69 CYS H H 69 9.455 9.455 9.094 0.361 26060 5468 1 8 . 1 1 70 70 LYS N N 70 125.480 125.480 123.440 2.040 26060 5469 1 8 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.558 -0.068 26060 5470 1 8 . 1 1 70 70 LYS C C 70 174.300 174.300 175.322 -1.022 26060 5471 1 8 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.116 1.644 26060 5472 1 8 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.368 -0.198 26060 5473 1 8 . 1 1 70 70 LYS H H 70 9.050 9.050 8.575 0.475 26060 5474 1 8 . 1 1 71 71 ASP N N 71 116.940 116.940 119.600 -2.660 26060 5475 1 8 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.763 0.337 26060 5476 1 8 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.960 -0.880 26060 5477 1 8 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.821 1.559 26060 5478 1 8 . 1 1 71 71 ASP H H 71 7.620 7.620 7.486 0.134 26060 5479 1 8 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.134 -0.874 26060 5480 1 8 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.882 -2.232 26060 5481 1 8 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.230 -1.190 26060 5482 1 8 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.203 -0.103 26060 5483 1 8 . 1 1 73 73 PRO C C 73 174.700 174.700 176.297 -1.597 26060 5484 1 8 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.307 -2.617 26060 5485 1 8 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.161 2.879 26060 5486 1 8 . 1 1 74 74 TYR N N 74 125.400 125.400 125.042 0.358 26060 5487 1 8 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.507 0.343 26060 5488 1 8 . 1 1 74 74 TYR C C 74 172.900 172.900 175.228 -2.328 26060 5489 1 8 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.372 -2.702 26060 5490 1 8 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.459 -3.059 26060 5491 1 8 . 1 1 74 74 TYR H H 74 8.960 8.960 8.424 0.536 26060 5492 1 8 . 1 1 75 75 LYS N N 75 121.400 121.400 120.504 0.896 26060 5493 1 8 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.313 0.277 26060 5494 1 8 . 1 1 75 75 LYS C C 75 173.800 173.800 174.660 -0.860 26060 5495 1 8 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.380 0.270 26060 5496 1 8 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.893 -1.003 26060 5497 1 8 . 1 1 75 75 LYS H H 75 7.670 7.670 7.956 -0.286 26060 5498 1 8 . 1 1 76 76 VAL N N 76 119.800 119.800 121.530 -1.730 26060 5499 1 8 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.141 -0.251 26060 5500 1 8 . 1 1 76 76 VAL C C 76 173.900 173.900 174.386 -0.486 26060 5501 1 8 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.364 1.365 26060 5502 1 8 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.111 0.429 26060 5503 1 8 . 1 1 76 76 VAL H H 76 8.180 8.180 7.784 0.396 26060 5504 1 8 . 1 1 77 77 GLU N N 77 126.190 126.190 127.803 -1.613 26060 5505 1 8 . 1 1 77 77 GLU HA H 77 4.950 4.950 5.044 -0.094 26060 5506 1 8 . 1 1 77 77 GLU C C 77 174.700 174.700 175.211 -0.511 26060 5507 1 8 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.191 -0.251 26060 5508 1 8 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.413 0.136 26060 5509 1 8 . 1 1 77 77 GLU H H 77 8.270 8.270 8.630 -0.360 26060 5510 1 8 . 1 1 78 78 GLU N N 78 126.180 126.180 123.074 3.106 26060 5511 1 8 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.579 -0.129 26060 5512 1 8 . 1 1 78 78 GLU C C 78 175.400 175.400 173.874 1.526 26060 5513 1 8 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.043 -0.001 26060 5514 1 8 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.066 3.034 26060 5515 1 8 . 1 1 78 78 GLU H H 78 7.870 7.870 8.286 -0.416 26060 5516 1 8 . 1 1 79 79 SER N N 79 112.109 112.109 113.303 -1.194 26060 5517 1 8 . 1 1 79 79 SER HA H 79 5.560 5.560 5.385 0.175 26060 5518 1 8 . 1 1 79 79 SER C C 79 172.490 172.490 173.166 -0.676 26060 5519 1 8 . 1 1 79 79 SER CA C 79 57.754 57.754 56.616 1.138 26060 5520 1 8 . 1 1 79 79 SER CB C 79 65.861 65.861 65.357 0.504 26060 5521 1 8 . 1 1 79 79 SER H H 79 7.714 7.714 8.369 -0.655 26060 5522 1 8 . 1 1 80 80 GLY N N 80 106.048 106.048 110.928 -4.880 26060 5523 1 8 . 1 1 80 80 GLY C C 80 172.630 172.630 171.815 0.815 26060 5524 1 8 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.516 1.054 26060 5525 1 8 . 1 1 80 80 GLY H H 80 8.828 8.828 8.915 -0.087 26060 5526 1 8 . 1 1 81 81 TYR N N 81 115.280 115.280 114.486 0.794 26060 5527 1 8 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.359 0.321 26060 5528 1 8 . 1 1 81 81 TYR C C 81 174.100 174.100 174.407 -0.307 26060 5529 1 8 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.502 -1.002 26060 5530 1 8 . 1 1 81 81 TYR CB C 81 41.340 41.340 38.788 2.552 26060 5531 1 8 . 1 1 81 81 TYR H H 81 8.770 8.770 7.998 0.772 26060 5532 1 8 . 1 1 82 82 ALA N N 82 122.350 122.350 122.711 -0.361 26060 5533 1 8 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.495 -0.095 26060 5534 1 8 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.693 0.347 26060 5535 1 8 . 1 1 82 82 ALA CB C 82 22.400 22.400 20.657 1.743 26060 5536 1 8 . 1 1 82 82 ALA H H 82 7.160 7.160 7.534 -0.374 26060 5537 1 8 . 1 1 83 83 GLY N N 83 107.100 107.100 106.702 0.398 26060 5538 1 8 . 1 1 83 83 GLY C C 83 172.500 172.500 173.590 -1.090 26060 5539 1 8 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.234 0.376 26060 5540 1 8 . 1 1 83 83 GLY H H 83 8.220 8.220 8.320 -0.100 26060 5541 1 8 . 1 1 84 84 PHE N N 84 111.660 111.660 115.797 -4.137 26060 5542 1 8 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.577 0.113 26060 5543 1 8 . 1 1 84 84 PHE C C 84 172.460 172.460 173.409 -0.949 26060 5544 1 8 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.426 0.074 26060 5545 1 8 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.623 -1.042 26060 5546 1 8 . 1 1 84 84 PHE H H 84 7.700 7.700 7.997 -0.297 26060 5547 1 8 . 1 1 85 85 ILE N N 85 117.810 117.810 121.834 -4.024 26060 5548 1 8 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.062 0.248 26060 5549 1 8 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.564 -1.224 26060 5550 1 8 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.262 -2.002 26060 5551 1 8 . 1 1 85 85 ILE H H 85 8.340 8.340 8.405 -0.065 26060 5552 1 8 . 1 1 86 86 LEU N N 86 108.130 108.130 129.051 -20.921 26060 5553 1 8 . 1 1 86 86 LEU HA H 86 4.980 4.980 4.974 0.006 26060 5554 1 8 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.817 2.383 26060 5555 1 8 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.319 -0.019 26060 5556 1 8 . 1 1 86 86 LEU H H 86 9.900 9.900 8.749 1.151 26060 5557 1 8 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.469 0.631 26060 5558 1 8 . 1 1 87 87 PRO C C 87 175.340 175.340 175.942 -0.602 26060 5559 1 8 . 1 1 87 87 PRO CA C 87 63.110 63.110 63.030 0.080 26060 5560 1 8 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.520 1.040 26060 5561 1 8 . 1 1 88 88 ILE N N 88 126.000 126.000 125.978 0.022 26060 5562 1 8 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.223 0.567 26060 5563 1 8 . 1 1 88 88 ILE C C 88 176.100 176.100 175.041 1.059 26060 5564 1 8 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.454 0.106 26060 5565 1 8 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.072 1.928 26060 5566 1 8 . 1 1 88 88 ILE H H 88 9.380 9.380 8.898 0.482 26060 5567 1 8 . 1 1 89 89 GLU N N 89 123.900 123.900 124.301 -0.401 26060 5568 1 8 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.344 -0.144 26060 5569 1 8 . 1 1 89 89 GLU C C 89 173.800 173.800 175.495 -1.695 26060 5570 1 8 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.421 -0.451 26060 5571 1 8 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.583 0.797 26060 5572 1 8 . 1 1 89 89 GLU H H 89 9.320 9.320 8.841 0.479 26060 5573 1 8 . 1 1 90 90 VAL N N 90 123.980 123.980 122.907 1.073 26060 5574 1 8 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.170 -0.010 26060 5575 1 8 . 1 1 90 90 VAL C C 90 174.800 174.800 174.430 0.370 26060 5576 1 8 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.098 0.892 26060 5577 1 8 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.592 -1.102 26060 5578 1 8 . 1 1 90 90 VAL H H 90 8.630 8.630 8.509 0.121 26060 5579 1 8 . 1 1 91 91 TYR N N 91 124.230 124.230 125.809 -1.579 26060 5580 1 8 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.671 -0.011 26060 5581 1 8 . 1 1 91 91 TYR C C 91 176.800 176.800 175.665 1.135 26060 5582 1 8 . 1 1 91 91 TYR CA C 91 56.700 56.700 56.982 -0.282 26060 5583 1 8 . 1 1 91 91 TYR CB C 91 40.240 40.240 39.151 1.089 26060 5584 1 8 . 1 1 91 91 TYR H H 91 8.640 8.640 9.121 -0.481 26060 5585 1 8 . 1 1 92 92 PHE N N 92 121.200 121.200 122.380 -1.180 26060 5586 1 8 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.202 0.458 26060 5587 1 8 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.130 1.380 26060 5588 1 8 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.829 0.871 26060 5589 1 8 . 1 1 92 92 PHE H H 92 8.750 8.750 8.984 -0.234 26060 5590 1 8 . 1 1 93 93 LYS N N 93 123.450 123.450 122.665 0.785 26060 5591 1 8 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.594 0.006 26060 5592 1 8 . 1 1 93 93 LYS C C 93 174.200 174.200 175.048 -0.848 26060 5593 1 8 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.914 -0.734 26060 5594 1 8 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.117 -0.437 26060 5595 1 8 . 1 1 93 93 LYS H H 93 8.560 8.560 9.025 -0.465 26060 5596 1 8 . 1 1 94 94 ASN N N 94 118.800 118.800 121.007 -2.207 26060 5597 1 8 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.649 -0.208 26060 5598 1 8 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.005 -0.795 26060 5599 1 8 . 1 1 94 94 ASN CB C 94 39.800 39.800 39.760 0.040 26060 5600 1 8 . 1 1 94 94 ASN H H 94 7.820 7.820 8.003 -0.183 26060 5601 1 8 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.450 -0.120 26060 5602 1 8 . 1 1 95 95 LYS C C 95 175.800 175.800 175.658 0.142 26060 5603 1 8 . 1 1 95 95 LYS CA C 95 56.210 56.210 55.852 0.358 26060 5604 1 8 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.062 -0.052 26060 5605 1 8 . 1 1 96 96 GLU N N 96 118.330 118.330 119.980 -1.650 26060 5606 1 8 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.332 0.178 26060 5607 1 8 . 1 1 96 96 GLU C C 96 173.200 173.200 175.982 -2.782 26060 5608 1 8 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.473 -1.373 26060 5609 1 8 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.777 1.692 26060 5610 1 8 . 1 1 96 96 GLU H H 96 7.120 7.120 7.520 -0.400 26060 5611 1 8 . 1 1 97 97 GLU N N 97 115.630 115.630 120.147 -4.517 26060 5612 1 8 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.248 0.182 26060 5613 1 8 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.241 -1.381 26060 5614 1 8 . 1 1 97 97 GLU CB C 97 29.270 29.270 29.038 0.232 26060 5615 1 8 . 1 1 97 97 GLU H H 97 8.060 8.060 8.397 -0.337 26060 5616 1 8 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.211 0.789 26060 5617 1 8 . 1 1 98 98 PRO C C 98 175.900 175.900 176.792 -0.892 26060 5618 1 8 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.181 -2.021 26060 5619 1 8 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.843 2.157 26060 5620 1 8 . 1 1 99 99 ARG N N 99 122.800 122.800 119.415 3.385 26060 5621 1 8 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.534 0.096 26060 5622 1 8 . 1 1 99 99 ARG C C 99 175.800 175.800 175.589 0.211 26060 5623 1 8 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.598 -0.108 26060 5624 1 8 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.956 -0.546 26060 5625 1 8 . 1 1 99 99 ARG H H 99 8.602 8.602 8.554 0.048 26060 5626 1 8 . 1 1 100 100 LYS N N 100 113.220 113.220 117.003 -3.783 26060 5627 1 8 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.737 0.203 26060 5628 1 8 . 1 1 100 100 LYS C C 100 174.100 174.100 174.495 -0.395 26060 5629 1 8 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.142 -0.231 26060 5630 1 8 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.615 -0.895 26060 5631 1 8 . 1 1 100 100 LYS H H 100 7.650 7.650 7.279 0.371 26060 5632 1 8 . 1 1 101 101 VAL N N 101 116.230 116.230 121.883 -5.653 26060 5633 1 8 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.149 0.121 26060 5634 1 8 . 1 1 101 101 VAL C C 101 171.600 171.600 173.617 -2.017 26060 5635 1 8 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.207 1.053 26060 5636 1 8 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.112 0.068 26060 5637 1 8 . 1 1 101 101 VAL H H 101 8.120 8.120 8.294 -0.174 26060 5638 1 8 . 1 1 102 102 ARG N N 102 124.980 124.980 127.896 -2.916 26060 5639 1 8 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.823 0.337 26060 5640 1 8 . 1 1 102 102 ARG C C 102 174.340 174.340 175.159 -0.819 26060 5641 1 8 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.759 -1.009 26060 5642 1 8 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.366 1.984 26060 5643 1 8 . 1 1 102 102 ARG H H 102 7.930 7.930 8.272 -0.342 26060 5644 1 8 . 1 1 103 103 PHE N N 103 124.590 124.590 126.897 -2.307 26060 5645 1 8 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.755 0.037 26060 5646 1 8 . 1 1 103 103 PHE C C 103 174.280 174.280 175.164 -0.884 26060 5647 1 8 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.376 1.604 26060 5648 1 8 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.184 2.066 26060 5649 1 8 . 1 1 103 103 PHE H H 103 9.390 9.390 9.116 0.274 26060 5650 1 8 . 1 1 104 104 ASP N N 104 124.700 124.700 124.941 -0.241 26060 5651 1 8 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.523 0.276 26060 5652 1 8 . 1 1 104 104 ASP C C 104 174.500 174.500 174.877 -0.377 26060 5653 1 8 . 1 1 104 104 ASP CA C 104 54.390 54.390 53.637 0.753 26060 5654 1 8 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.450 0.780 26060 5655 1 8 . 1 1 104 104 ASP H H 104 9.010 9.010 8.917 0.093 26060 5656 1 8 . 1 1 105 105 TYR N N 105 129.840 129.840 123.723 6.117 26060 5657 1 8 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.447 -0.347 26060 5658 1 8 . 1 1 105 105 TYR C C 105 173.100 173.100 173.972 -0.872 26060 5659 1 8 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.572 1.108 26060 5660 1 8 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.558 1.292 26060 5661 1 8 . 1 1 105 105 TYR H H 105 8.140 8.140 8.219 -0.079 26060 5662 1 8 . 1 1 106 106 ASP N N 106 126.800 126.800 128.202 -1.402 26060 5663 1 8 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.265 -0.045 26060 5664 1 8 . 1 1 106 106 ASP C C 106 172.900 172.900 174.192 -1.292 26060 5665 1 8 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.994 -0.484 26060 5666 1 8 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.459 -1.959 26060 5667 1 8 . 1 1 106 106 ASP H H 106 7.730 7.730 8.356 -0.626 26060 5668 1 8 . 1 1 107 107 LEU N N 107 132.150 132.150 128.331 3.819 26060 5669 1 8 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.319 -0.479 26060 5670 1 8 . 1 1 107 107 LEU C C 107 172.100 172.100 174.568 -2.468 26060 5671 1 8 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.365 0.334 26060 5672 1 8 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.569 -1.329 26060 5673 1 8 . 1 1 107 107 LEU H H 107 7.770 7.770 7.839 -0.069 26060 5674 1 8 . 1 1 108 108 PHE N N 108 118.960 118.960 121.658 -2.698 26060 5675 1 8 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.852 -0.162 26060 5676 1 8 . 1 1 108 108 PHE C C 108 174.300 174.300 173.695 0.605 26060 5677 1 8 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.254 -0.564 26060 5678 1 8 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.481 -0.191 26060 5679 1 8 . 1 1 108 108 PHE H H 108 6.060 6.060 7.025 -0.965 26060 5680 1 8 . 1 1 109 109 LEU N N 109 118.900 118.900 123.716 -4.816 26060 5681 1 8 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.687 -0.287 26060 5682 1 8 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.257 -1.097 26060 5683 1 8 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.478 -1.398 26060 5684 1 8 . 1 1 109 109 LEU H H 109 8.388 8.388 8.390 -0.002 26060 5685 1 8 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.359 0.081 26060 5686 1 8 . 1 1 111 111 LEU C C 111 177.300 177.300 176.777 0.523 26060 5687 1 8 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.156 -0.936 26060 5688 1 8 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.572 1.298 26060 5689 1 8 . 1 1 112 112 GLU N N 112 120.660 120.660 125.479 -4.819 26060 5690 1 8 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.002 0.168 26060 5691 1 8 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.313 0.147 26060 5692 1 8 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.733 -0.042 26060 5693 1 8 . 1 1 112 112 GLU H H 112 8.780 8.780 8.773 0.007 26060 5694 1 8 . 1 1 113 113 GLY C C 113 173.900 173.900 173.808 0.092 26060 5695 1 8 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.943 0.007 26060 5696 1 8 . 1 1 114 114 HIS N N 114 120.890 120.890 118.332 2.558 26060 5697 1 8 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.003 -0.097 26060 5698 1 8 . 1 1 114 114 HIS CA C 114 54.770 54.770 52.759 2.011 26060 5699 1 8 . 1 1 114 114 HIS CB C 114 30.590 30.590 30.308 0.282 26060 5700 1 8 . 1 1 114 114 HIS H H 114 7.934 7.934 7.609 0.325 26060 5701 1 8 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.027 -0.227 26060 5702 1 8 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.076 1.014 26060 5703 1 8 . 1 1 115 115 PRO CB C 115 30.680 30.680 32.416 -1.736 26060 5704 1 8 . 1 1 116 116 PRO C C 116 176.600 176.600 175.633 0.967 26060 5705 1 8 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.360 -0.060 26060 5706 1 8 . 1 1 117 117 VAL N N 117 127.480 127.480 127.228 0.252 26060 5707 1 8 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.366 -0.576 26060 5708 1 8 . 1 1 117 117 VAL CA C 117 62.700 62.700 62.113 0.587 26060 5709 1 8 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.614 -0.414 26060 5710 1 8 . 1 1 117 117 VAL H H 117 8.890 8.890 8.017 0.873 26060 5711 1 8 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.073 -0.083 26060 5712 1 8 . 1 1 118 118 ASN C C 118 172.700 172.700 173.664 -0.964 26060 5713 1 8 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.399 -0.039 26060 5714 1 8 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.958 -0.758 26060 5715 1 8 . 1 1 119 119 HIS N N 119 124.930 124.930 125.814 -0.884 26060 5716 1 8 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.086 -0.266 26060 5717 1 8 . 1 1 119 119 HIS C C 119 173.500 173.500 172.903 0.597 26060 5718 1 8 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.056 1.914 26060 5719 1 8 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.040 0.630 26060 5720 1 8 . 1 1 119 119 HIS H H 119 8.790 8.790 9.039 -0.249 26060 5721 1 8 . 1 1 120 120 LEU N N 120 128.280 128.280 123.338 4.942 26060 5722 1 8 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.213 -0.263 26060 5723 1 8 . 1 1 120 120 LEU C C 120 174.030 174.030 175.045 -1.015 26060 5724 1 8 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.504 0.936 26060 5725 1 8 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.403 0.197 26060 5726 1 8 . 1 1 120 120 LEU H H 120 7.460 7.460 8.128 -0.668 26060 5727 1 8 . 1 1 121 121 ARG N N 121 128.060 128.060 121.718 6.342 26060 5728 1 8 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.701 -0.061 26060 5729 1 8 . 1 1 121 121 ARG C C 121 173.400 173.400 173.613 -0.213 26060 5730 1 8 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.610 -0.250 26060 5731 1 8 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.500 1.760 26060 5732 1 8 . 1 1 121 121 ARG H H 121 9.860 9.860 9.060 0.800 26060 5733 1 8 . 1 1 122 122 CYS N N 122 125.290 125.290 119.237 6.053 26060 5734 1 8 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.252 -0.232 26060 5735 1 8 . 1 1 122 122 CYS C C 122 174.600 174.600 174.449 0.151 26060 5736 1 8 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.159 2.131 26060 5737 1 8 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.695 -2.665 26060 5738 1 8 . 1 1 122 122 CYS H H 122 8.835 8.835 8.741 0.094 26060 5739 1 8 . 1 1 123 123 GLU N N 123 125.920 125.920 124.125 1.795 26060 5740 1 8 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.487 0.193 26060 5741 1 8 . 1 1 123 123 GLU C C 123 174.500 174.500 174.563 -0.063 26060 5742 1 8 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.842 -0.422 26060 5743 1 8 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.198 0.385 26060 5744 1 8 . 1 1 123 123 GLU H H 123 8.970 8.970 9.142 -0.172 26060 5745 1 8 . 1 1 124 124 LYS N N 124 121.837 121.837 122.414 -0.577 26060 5746 1 8 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.978 -0.018 26060 5747 1 8 . 1 1 124 124 LYS C C 124 175.700 175.700 175.714 -0.014 26060 5748 1 8 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.127 0.230 26060 5749 1 8 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.453 -0.264 26060 5750 1 8 . 1 1 124 124 LYS H H 124 8.652 8.652 8.397 0.255 26060 5751 1 8 . 1 1 125 125 LEU N N 125 127.000 127.000 129.891 -2.891 26060 5752 1 8 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.644 0.007 26060 5753 1 8 . 1 1 125 125 LEU C C 125 175.110 175.110 175.522 -0.412 26060 5754 1 8 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.817 0.037 26060 5755 1 8 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.488 0.779 26060 5756 1 8 . 1 1 125 125 LEU H H 125 9.175 9.175 9.300 -0.125 26060 5757 1 8 . 1 1 126 126 THR N N 126 117.779 117.779 119.213 -1.434 26060 5758 1 8 . 1 1 126 126 THR HA H 126 4.650 4.650 4.538 0.112 26060 5759 1 8 . 1 1 126 126 THR C C 126 173.200 173.200 173.490 -0.290 26060 5760 1 8 . 1 1 126 126 THR CA C 126 62.036 62.036 61.297 0.739 26060 5761 1 8 . 1 1 126 126 THR CB C 126 70.284 70.284 69.441 0.843 26060 5762 1 8 . 1 1 126 126 THR H H 126 8.331 8.331 8.407 -0.076 26060 5763 1 8 . 1 1 127 127 PHE N N 127 126.576 126.576 125.708 0.868 26060 5764 1 8 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.650 -0.060 26060 5765 1 8 . 1 1 127 127 PHE C C 127 174.860 174.860 174.546 0.314 26060 5766 1 8 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.442 0.422 26060 5767 1 8 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.906 -0.906 26060 5768 1 8 . 1 1 127 127 PHE H H 127 9.051 9.051 8.780 0.271 26060 5769 1 8 . 1 1 128 128 ASN N N 128 123.040 123.040 124.194 -1.154 26060 5770 1 8 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.660 -0.040 26060 5771 1 8 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.132 0.348 26060 5772 1 8 . 1 1 128 128 ASN CB C 128 39.460 39.460 39.257 0.203 26060 5773 1 8 . 1 1 128 128 ASN H H 128 8.880 8.880 8.787 0.093 26060 5774 1 8 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.581 0.179 26060 5775 1 8 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.220 -0.320 26060 5776 1 8 . 1 1 129 129 ASN CB C 129 38.730 38.730 38.537 0.193 26060 5777 1 8 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.929 -0.139 26060 5778 1 8 . 1 1 130 130 PRO C C 130 177.470 177.470 176.808 0.662 26060 5779 1 8 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.230 0.344 26060 5780 1 8 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.589 -1.279 26060 5781 1 8 . 1 1 131 131 THR N N 131 113.400 113.400 116.423 -3.023 26060 5782 1 8 . 1 1 131 131 THR HA H 131 4.300 4.300 4.183 0.117 26060 5783 1 8 . 1 1 131 131 THR C C 131 175.200 175.200 175.947 -0.747 26060 5784 1 8 . 1 1 131 131 THR CA C 131 62.200 62.200 62.289 -0.089 26060 5785 1 8 . 1 1 131 131 THR CB C 131 70.600 70.600 70.737 -0.137 26060 5786 1 8 . 1 1 131 131 THR H H 131 8.950 8.950 8.943 0.007 26060 5787 1 8 . 1 1 132 132 GLU N N 132 122.199 122.199 125.307 -3.108 26060 5788 1 8 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.991 0.019 26060 5789 1 8 . 1 1 132 132 GLU C C 132 178.700 178.700 178.376 0.324 26060 5790 1 8 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.456 -0.162 26060 5791 1 8 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.648 -0.487 26060 5792 1 8 . 1 1 132 132 GLU H H 132 8.932 8.932 9.009 -0.077 26060 5793 1 8 . 1 1 133 133 ASP N N 133 116.324 116.324 119.498 -3.174 26060 5794 1 8 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.340 -0.010 26060 5795 1 8 . 1 1 133 133 ASP C C 133 177.800 177.800 178.731 -0.931 26060 5796 1 8 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.477 0.069 26060 5797 1 8 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.370 1.453 26060 5798 1 8 . 1 1 133 133 ASP H H 133 8.490 8.490 8.226 0.264 26060 5799 1 8 . 1 1 134 134 PHE N N 134 119.914 119.914 121.171 -1.257 26060 5800 1 8 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.265 0.345 26060 5801 1 8 . 1 1 134 134 PHE C C 134 177.300 177.300 177.368 -0.068 26060 5802 1 8 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.632 -0.094 26060 5803 1 8 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.784 0.416 26060 5804 1 8 . 1 1 134 134 PHE H H 134 7.787 7.787 7.494 0.293 26060 5805 1 8 . 1 1 135 135 ARG N N 135 119.794 119.794 120.567 -0.773 26060 5806 1 8 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.534 -0.184 26060 5807 1 8 . 1 1 135 135 ARG C C 135 177.370 177.370 178.265 -0.895 26060 5808 1 8 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.987 0.389 26060 5809 1 8 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.948 0.448 26060 5810 1 8 . 1 1 135 135 ARG H H 135 9.087 9.087 8.523 0.564 26060 5811 1 8 . 1 1 136 136 ARG N N 136 114.554 114.554 118.618 -4.064 26060 5812 1 8 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.939 -0.119 26060 5813 1 8 . 1 1 136 136 ARG C C 136 178.950 178.950 178.698 0.252 26060 5814 1 8 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.627 0.173 26060 5815 1 8 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.044 0.173 26060 5816 1 8 . 1 1 136 136 ARG H H 136 7.747 7.747 8.567 -0.820 26060 5817 1 8 . 1 1 137 137 LYS N N 137 118.298 118.298 119.211 -0.913 26060 5818 1 8 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.056 -0.156 26060 5819 1 8 . 1 1 137 137 LYS C C 137 177.980 177.980 178.985 -1.005 26060 5820 1 8 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.439 0.956 26060 5821 1 8 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.525 -0.078 26060 5822 1 8 . 1 1 137 137 LYS H H 137 7.154 7.154 7.533 -0.379 26060 5823 1 8 . 1 1 138 138 LEU N N 138 117.159 117.159 119.173 -2.014 26060 5824 1 8 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.708 -0.287 26060 5825 1 8 . 1 1 138 138 LEU C C 138 179.100 179.100 178.410 0.690 26060 5826 1 8 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.223 0.008 26060 5827 1 8 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.400 0.928 26060 5828 1 8 . 1 1 138 138 LEU H H 138 7.709 7.709 7.981 -0.272 26060 5829 1 8 . 1 1 139 139 LEU N N 139 115.158 115.158 116.905 -1.747 26060 5830 1 8 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.091 0.059 26060 5831 1 8 . 1 1 139 139 LEU C C 139 177.600 177.600 178.633 -1.033 26060 5832 1 8 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.634 -1.105 26060 5833 1 8 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.836 -0.091 26060 5834 1 8 . 1 1 139 139 LEU H H 139 7.507 7.507 7.991 -0.484 26060 5835 1 8 . 1 1 140 140 LYS N N 140 120.256 120.256 118.247 2.009 26060 5836 1 8 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.008 0.102 26060 5837 1 8 . 1 1 140 140 LYS C C 140 175.800 175.800 177.095 -1.295 26060 5838 1 8 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.314 -0.262 26060 5839 1 8 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.366 0.280 26060 5840 1 8 . 1 1 140 140 LYS H H 140 7.304 7.304 7.503 -0.199 26060 5841 1 9 . 1 1 4 4 MET C C 4 175.800 175.800 174.676 1.124 26060 5842 1 9 . 1 1 4 4 MET CA C 4 55.350 55.350 53.963 1.387 26060 5843 1 9 . 1 1 4 4 MET CB C 4 32.880 32.880 35.060 -2.180 26060 5844 1 9 . 1 1 5 5 ALA N N 5 125.230 125.230 123.530 1.700 26060 5845 1 9 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.681 -0.331 26060 5846 1 9 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.741 0.689 26060 5847 1 9 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.666 -0.295 26060 5848 1 9 . 1 1 5 5 ALA H H 5 8.320 8.320 8.370 -0.050 26060 5849 1 9 . 1 1 6 6 SER HA H 6 4.490 4.490 4.590 -0.100 26060 5850 1 9 . 1 1 6 6 SER CA C 6 58.200 58.200 57.333 0.867 26060 5851 1 9 . 1 1 6 6 SER CB C 6 63.700 63.700 64.459 -0.759 26060 5852 1 9 . 1 1 7 7 SER HA H 7 4.530 4.530 4.426 0.104 26060 5853 1 9 . 1 1 7 7 SER CA C 7 58.200 58.200 59.460 -1.260 26060 5854 1 9 . 1 1 7 7 SER CB C 7 63.700 63.700 62.250 1.450 26060 5855 1 9 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.730 -0.120 26060 5856 1 9 . 1 1 8 8 CYS C C 8 173.500 173.500 173.071 0.429 26060 5857 1 9 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.347 1.993 26060 5858 1 9 . 1 1 8 8 CYS CB C 8 28.490 28.490 29.958 -1.468 26060 5859 1 9 . 1 1 9 9 ALA N N 9 124.700 124.700 123.648 1.052 26060 5860 1 9 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.955 -0.165 26060 5861 1 9 . 1 1 9 9 ALA C C 9 177.400 177.400 177.086 0.314 26060 5862 1 9 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.515 0.555 26060 5863 1 9 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.299 1.329 26060 5864 1 9 . 1 1 9 9 ALA H H 9 7.960 7.960 8.258 -0.298 26060 5865 1 9 . 1 1 10 10 VAL N N 10 120.124 120.124 125.141 -5.017 26060 5866 1 9 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.224 0.066 26060 5867 1 9 . 1 1 10 10 VAL C C 10 173.900 173.900 175.190 -1.290 26060 5868 1 9 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.664 -0.114 26060 5869 1 9 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.682 2.218 26060 5870 1 9 . 1 1 10 10 VAL H H 10 8.424 8.424 8.530 -0.106 26060 5871 1 9 . 1 1 11 11 GLN N N 11 125.818 125.818 127.068 -1.250 26060 5872 1 9 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.169 0.391 26060 5873 1 9 . 1 1 11 11 GLN C C 11 175.400 175.400 175.416 -0.016 26060 5874 1 9 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.778 -0.655 26060 5875 1 9 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.635 1.394 26060 5876 1 9 . 1 1 11 11 GLN H H 11 8.636 8.636 8.531 0.105 26060 5877 1 9 . 1 1 12 12 VAL N N 12 119.106 119.106 116.495 2.611 26060 5878 1 9 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.295 0.335 26060 5879 1 9 . 1 1 12 12 VAL C C 12 173.800 173.800 174.006 -0.206 26060 5880 1 9 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.267 0.533 26060 5881 1 9 . 1 1 12 12 VAL CB C 12 35.711 35.711 34.109 1.602 26060 5882 1 9 . 1 1 12 12 VAL H H 12 8.827 8.827 8.617 0.210 26060 5883 1 9 . 1 1 13 13 LYS N N 13 121.700 121.700 126.737 -5.037 26060 5884 1 9 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.222 -0.022 26060 5885 1 9 . 1 1 13 13 LYS C C 13 175.030 175.030 174.957 0.073 26060 5886 1 9 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.618 0.812 26060 5887 1 9 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.133 1.788 26060 5888 1 9 . 1 1 13 13 LYS H H 13 8.234 8.234 8.558 -0.324 26060 5889 1 9 . 1 1 14 14 LEU N N 14 119.100 119.100 126.457 -7.357 26060 5890 1 9 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.490 -0.540 26060 5891 1 9 . 1 1 14 14 LEU C C 14 175.110 175.110 175.191 -0.081 26060 5892 1 9 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.358 -0.001 26060 5893 1 9 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.903 1.018 26060 5894 1 9 . 1 1 14 14 LEU H H 14 8.840 8.840 8.490 0.350 26060 5895 1 9 . 1 1 15 15 GLU N N 15 120.978 120.978 122.025 -1.047 26060 5896 1 9 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.249 -0.259 26060 5897 1 9 . 1 1 15 15 GLU C C 15 173.800 173.800 174.924 -1.124 26060 5898 1 9 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.457 0.971 26060 5899 1 9 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.110 -1.284 26060 5900 1 9 . 1 1 15 15 GLU H H 15 9.181 9.181 9.195 -0.014 26060 5901 1 9 . 1 1 16 16 LEU N N 16 124.438 124.438 126.272 -1.834 26060 5902 1 9 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.257 -0.147 26060 5903 1 9 . 1 1 16 16 LEU C C 16 174.700 174.700 176.169 -1.469 26060 5904 1 9 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.739 0.337 26060 5905 1 9 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.571 2.321 26060 5906 1 9 . 1 1 16 16 LEU H H 16 8.891 8.891 8.633 0.258 26060 5907 1 9 . 1 1 17 17 GLY N N 17 108.067 108.067 108.670 -0.603 26060 5908 1 9 . 1 1 17 17 GLY C C 17 170.350 170.350 172.317 -1.967 26060 5909 1 9 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.184 1.800 26060 5910 1 9 . 1 1 17 17 GLY H H 17 7.227 7.227 8.482 -1.255 26060 5911 1 9 . 1 1 18 18 HIS N N 18 111.200 111.200 118.467 -7.267 26060 5912 1 9 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.887 -0.267 26060 5913 1 9 . 1 1 18 18 HIS C C 18 172.400 172.400 172.719 -0.319 26060 5914 1 9 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.727 -0.787 26060 5915 1 9 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.562 1.598 26060 5916 1 9 . 1 1 18 18 HIS H H 18 8.150 8.150 9.187 -1.037 26060 5917 1 9 . 1 1 19 19 ARG N N 19 117.800 117.800 121.826 -4.026 26060 5918 1 9 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.772 0.328 26060 5919 1 9 . 1 1 19 19 ARG C C 19 175.800 175.800 174.155 1.645 26060 5920 1 9 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.090 -0.590 26060 5921 1 9 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.109 -0.459 26060 5922 1 9 . 1 1 19 19 ARG H H 19 9.010 9.010 8.942 0.068 26060 5923 1 9 . 1 1 20 20 ALA N N 20 120.390 120.390 122.130 -1.740 26060 5924 1 9 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.572 -0.042 26060 5925 1 9 . 1 1 20 20 ALA C C 20 175.800 175.800 175.227 0.573 26060 5926 1 9 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.666 1.524 26060 5927 1 9 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.178 0.572 26060 5928 1 9 . 1 1 20 20 ALA H H 20 8.070 8.070 8.303 -0.233 26060 5929 1 9 . 1 1 21 21 GLN N N 21 121.790 121.790 121.297 0.493 26060 5930 1 9 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.105 0.125 26060 5931 1 9 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.410 -0.080 26060 5932 1 9 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.916 -0.016 26060 5933 1 9 . 1 1 21 21 GLN H H 21 9.240 9.240 9.259 -0.019 26060 5934 1 9 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.748 -1.118 26060 5935 1 9 . 1 1 22 22 VAL C C 22 176.500 176.500 175.345 1.155 26060 5936 1 9 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.759 3.271 26060 5937 1 9 . 1 1 22 22 VAL CB C 22 31.600 31.600 34.025 -2.425 26060 5938 1 9 . 1 1 23 23 ARG N N 23 127.840 127.840 127.163 0.677 26060 5939 1 9 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.608 -0.478 26060 5940 1 9 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.130 1.470 26060 5941 1 9 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.748 1.402 26060 5942 1 9 . 1 1 23 23 ARG H H 23 8.720 8.720 8.595 0.125 26060 5943 1 9 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.053 -0.013 26060 5944 1 9 . 1 1 24 24 LYS C C 24 176.960 176.960 176.275 0.685 26060 5945 1 9 . 1 1 24 24 LYS CA C 24 58.800 58.800 58.299 0.501 26060 5946 1 9 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.664 -0.605 26060 5947 1 9 . 1 1 25 25 LYS N N 25 115.870 115.870 119.481 -3.611 26060 5948 1 9 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.643 0.187 26060 5949 1 9 . 1 1 25 25 LYS CA C 25 52.960 52.960 52.980 -0.020 26060 5950 1 9 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.593 1.487 26060 5951 1 9 . 1 1 25 25 LYS H H 25 7.720 7.720 7.768 -0.048 26060 5952 1 9 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.594 0.236 26060 5953 1 9 . 1 1 26 26 PRO C C 26 177.400 177.400 177.060 0.340 26060 5954 1 9 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.795 -0.145 26060 5955 1 9 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.349 0.041 26060 5956 1 9 . 1 1 27 27 THR N N 27 111.270 111.270 114.714 -3.444 26060 5957 1 9 . 1 1 27 27 THR HA H 27 4.530 4.530 4.212 0.318 26060 5958 1 9 . 1 1 27 27 THR C C 27 177.300 177.300 176.903 0.397 26060 5959 1 9 . 1 1 27 27 THR CA C 27 61.300 61.300 61.204 0.096 26060 5960 1 9 . 1 1 27 27 THR CB C 27 71.460 71.460 69.995 1.465 26060 5961 1 9 . 1 1 27 27 THR H H 27 8.380 8.380 8.119 0.261 26060 5962 1 9 . 1 1 28 28 VAL N N 28 121.170 121.170 122.715 -1.545 26060 5963 1 9 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.810 0.073 26060 5964 1 9 . 1 1 28 28 VAL C C 28 177.030 177.030 176.052 0.978 26060 5965 1 9 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.100 0.100 26060 5966 1 9 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.642 -0.242 26060 5967 1 9 . 1 1 28 28 VAL H H 28 8.910 8.910 8.535 0.375 26060 5968 1 9 . 1 1 29 29 GLU N N 29 116.800 116.800 116.908 -0.108 26060 5969 1 9 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.182 -0.262 26060 5970 1 9 . 1 1 29 29 GLU C C 29 176.200 176.200 175.928 0.272 26060 5971 1 9 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.361 1.889 26060 5972 1 9 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.355 -1.185 26060 5973 1 9 . 1 1 29 29 GLU H H 29 7.990 7.990 7.950 0.040 26060 5974 1 9 . 1 1 30 30 GLY N N 30 105.500 105.500 107.850 -2.350 26060 5975 1 9 . 1 1 30 30 GLY C C 30 174.900 174.900 173.952 0.948 26060 5976 1 9 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.249 -0.789 26060 5977 1 9 . 1 1 30 30 GLY H H 30 7.950 7.950 7.904 0.046 26060 5978 1 9 . 1 1 31 31 PHE N N 31 119.300 119.300 119.044 0.256 26060 5979 1 9 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.929 -0.169 26060 5980 1 9 . 1 1 31 31 PHE C C 31 176.400 176.400 175.934 0.466 26060 5981 1 9 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.556 1.344 26060 5982 1 9 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.143 -3.643 26060 5983 1 9 . 1 1 31 31 PHE H H 31 7.520 7.520 7.396 0.124 26060 5984 1 9 . 1 1 32 32 THR N N 32 112.300 112.300 116.012 -3.712 26060 5985 1 9 . 1 1 32 32 THR HA H 32 4.330 4.330 4.454 -0.124 26060 5986 1 9 . 1 1 32 32 THR C C 32 175.200 175.200 174.362 0.838 26060 5987 1 9 . 1 1 32 32 THR CA C 32 62.780 62.780 62.709 0.070 26060 5988 1 9 . 1 1 32 32 THR CB C 32 70.350 70.350 70.106 0.244 26060 5989 1 9 . 1 1 32 32 THR H H 32 7.770 7.770 9.124 -1.354 26060 5990 1 9 . 1 1 33 33 HIS N N 33 121.900 121.900 122.256 -0.356 26060 5991 1 9 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.224 0.276 26060 5992 1 9 . 1 1 33 33 HIS C C 33 173.880 173.880 173.728 0.152 26060 5993 1 9 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.589 0.191 26060 5994 1 9 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.653 3.987 26060 5995 1 9 . 1 1 33 33 HIS H H 33 9.110 9.110 8.812 0.298 26060 5996 1 9 . 1 1 34 34 ASP N N 34 120.300 120.300 125.533 -5.233 26060 5997 1 9 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.346 0.054 26060 5998 1 9 . 1 1 34 34 ASP C C 34 175.100 175.100 175.173 -0.073 26060 5999 1 9 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.221 -0.911 26060 6000 1 9 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.072 0.028 26060 6001 1 9 . 1 1 34 34 ASP H H 34 8.810 8.810 9.073 -0.263 26060 6002 1 9 . 1 1 35 35 TRP N N 35 119.800 119.800 121.407 -1.607 26060 6003 1 9 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.678 0.052 26060 6004 1 9 . 1 1 35 35 TRP C C 35 174.900 174.900 173.543 1.357 26060 6005 1 9 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.692 0.208 26060 6006 1 9 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.266 1.804 26060 6007 1 9 . 1 1 35 35 TRP H H 35 9.250 9.250 8.699 0.551 26060 6008 1 9 . 1 1 36 36 MET N N 36 120.980 120.980 121.863 -0.883 26060 6009 1 9 . 1 1 36 36 MET HA H 36 5.750 5.750 5.932 -0.182 26060 6010 1 9 . 1 1 36 36 MET C C 36 173.700 173.700 174.309 -0.609 26060 6011 1 9 . 1 1 36 36 MET CA C 36 54.830 54.830 54.397 0.433 26060 6012 1 9 . 1 1 36 36 MET CB C 36 35.220 35.220 36.626 -1.406 26060 6013 1 9 . 1 1 36 36 MET H H 36 9.080 9.080 9.023 0.057 26060 6014 1 9 . 1 1 37 37 VAL N N 37 126.220 126.220 121.124 5.096 26060 6015 1 9 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.196 0.114 26060 6016 1 9 . 1 1 37 37 VAL C C 37 172.300 172.300 174.462 -2.162 26060 6017 1 9 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.762 -1.222 26060 6018 1 9 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.667 1.403 26060 6019 1 9 . 1 1 37 37 VAL H H 37 9.080 9.080 8.608 0.472 26060 6020 1 9 . 1 1 38 38 PHE N N 38 120.640 120.640 121.635 -0.995 26060 6021 1 9 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.269 0.701 26060 6022 1 9 . 1 1 38 38 PHE C C 38 172.960 172.960 174.846 -1.886 26060 6023 1 9 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.896 -0.766 26060 6024 1 9 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.854 -0.854 26060 6025 1 9 . 1 1 38 38 PHE H H 38 8.320 8.320 8.900 -0.580 26060 6026 1 9 . 1 1 39 39 VAL N N 39 116.500 116.500 120.408 -3.908 26060 6027 1 9 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.643 -0.633 26060 6028 1 9 . 1 1 39 39 VAL C C 39 174.700 174.700 174.351 0.349 26060 6029 1 9 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.019 1.621 26060 6030 1 9 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.732 1.668 26060 6031 1 9 . 1 1 39 39 VAL H H 39 8.580 8.580 9.292 -0.712 26060 6032 1 9 . 1 1 40 40 ARG N N 40 124.100 124.100 124.229 -0.129 26060 6033 1 9 . 1 1 40 40 ARG HA H 40 5.080 5.080 5.061 0.019 26060 6034 1 9 . 1 1 40 40 ARG C C 40 173.800 173.800 174.389 -0.589 26060 6035 1 9 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.372 -0.442 26060 6036 1 9 . 1 1 40 40 ARG CB C 40 33.580 33.580 33.170 0.409 26060 6037 1 9 . 1 1 40 40 ARG H H 40 9.880 9.880 8.662 1.218 26060 6038 1 9 . 1 1 41 41 GLY N N 41 107.640 107.640 106.548 1.092 26060 6039 1 9 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.562 1.408 26060 6040 1 9 . 1 1 41 41 GLY H H 41 8.910 8.910 8.622 0.288 26060 6041 1 9 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.372 0.118 26060 6042 1 9 . 1 1 42 42 PRO C C 42 177.300 177.300 176.675 0.625 26060 6043 1 9 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.172 0.268 26060 6044 1 9 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.481 -0.371 26060 6045 1 9 . 1 1 43 43 GLU N N 43 121.050 121.050 120.690 0.360 26060 6046 1 9 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.205 -0.415 26060 6047 1 9 . 1 1 43 43 GLU C C 43 176.110 176.110 177.345 -1.235 26060 6048 1 9 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.269 -0.419 26060 6049 1 9 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.831 -0.981 26060 6050 1 9 . 1 1 43 43 GLU H H 43 9.060 9.060 8.731 0.329 26060 6051 1 9 . 1 1 44 44 HIS N N 44 114.100 114.100 119.297 -5.197 26060 6052 1 9 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.260 0.091 26060 6053 1 9 . 1 1 44 44 HIS C C 44 175.170 175.170 173.596 1.574 26060 6054 1 9 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.594 0.056 26060 6055 1 9 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.439 -0.070 26060 6056 1 9 . 1 1 44 44 HIS H H 44 8.420 8.420 8.670 -0.250 26060 6057 1 9 . 1 1 45 45 SER N N 45 115.540 115.540 116.233 -0.693 26060 6058 1 9 . 1 1 45 45 SER HA H 45 4.560 4.560 4.317 0.243 26060 6059 1 9 . 1 1 45 45 SER C C 45 173.700 173.700 174.073 -0.373 26060 6060 1 9 . 1 1 45 45 SER CA C 45 58.710 58.710 57.602 1.108 26060 6061 1 9 . 1 1 45 45 SER CB C 45 65.040 65.040 63.304 1.736 26060 6062 1 9 . 1 1 45 45 SER H H 45 7.870 7.870 7.439 0.431 26060 6063 1 9 . 1 1 46 46 ASN N N 46 123.900 123.900 124.209 -0.309 26060 6064 1 9 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.899 0.221 26060 6065 1 9 . 1 1 46 46 ASN C C 46 176.300 176.300 176.046 0.254 26060 6066 1 9 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.624 0.066 26060 6067 1 9 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.587 -1.857 26060 6068 1 9 . 1 1 46 46 ASN H H 46 9.480 9.480 8.289 1.191 26060 6069 1 9 . 1 1 47 47 ILE N N 47 115.240 115.240 121.845 -6.605 26060 6070 1 9 . 1 1 47 47 ILE HA H 47 3.940 3.940 2.989 0.951 26060 6071 1 9 . 1 1 47 47 ILE C C 47 176.000 176.000 176.747 -0.747 26060 6072 1 9 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.241 -0.041 26060 6073 1 9 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.002 -1.302 26060 6074 1 9 . 1 1 47 47 ILE H H 47 8.170 8.170 8.602 -0.432 26060 6075 1 9 . 1 1 48 48 GLN N N 48 123.200 123.200 119.752 3.448 26060 6076 1 9 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.173 0.107 26060 6077 1 9 . 1 1 48 48 GLN C C 48 175.670 175.670 176.512 -0.842 26060 6078 1 9 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.694 0.206 26060 6079 1 9 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.285 -0.295 26060 6080 1 9 . 1 1 48 48 GLN H H 48 8.850 8.850 8.596 0.254 26060 6081 1 9 . 1 1 49 49 HIS N N 49 115.400 115.400 116.602 -1.202 26060 6082 1 9 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.399 0.171 26060 6083 1 9 . 1 1 49 49 HIS C C 49 176.380 176.380 177.373 -0.993 26060 6084 1 9 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.495 0.255 26060 6085 1 9 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.770 0.850 26060 6086 1 9 . 1 1 49 49 HIS H H 49 7.400 7.400 7.420 -0.020 26060 6087 1 9 . 1 1 50 50 PHE N N 50 109.800 109.800 114.277 -4.477 26060 6088 1 9 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.914 0.316 26060 6089 1 9 . 1 1 50 50 PHE C C 50 173.800 173.800 174.412 -0.612 26060 6090 1 9 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.776 -0.116 26060 6091 1 9 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.536 1.464 26060 6092 1 9 . 1 1 50 50 PHE H H 50 7.570 7.570 7.628 -0.058 26060 6093 1 9 . 1 1 51 51 VAL N N 51 127.810 127.810 120.808 7.002 26060 6094 1 9 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.827 -0.457 26060 6095 1 9 . 1 1 51 51 VAL C C 51 174.500 174.500 174.396 0.104 26060 6096 1 9 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.386 1.614 26060 6097 1 9 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.666 -1.386 26060 6098 1 9 . 1 1 51 51 VAL H H 51 7.810 7.810 8.088 -0.278 26060 6099 1 9 . 1 1 52 52 GLU N N 52 130.700 130.700 127.814 2.886 26060 6100 1 9 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.547 -0.567 26060 6101 1 9 . 1 1 52 52 GLU C C 52 175.400 175.400 176.027 -0.627 26060 6102 1 9 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.386 0.713 26060 6103 1 9 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.396 -0.816 26060 6104 1 9 . 1 1 52 52 GLU H H 52 9.380 9.380 8.970 0.410 26060 6105 1 9 . 1 1 53 53 LYS N N 53 109.200 109.200 114.768 -5.568 26060 6106 1 9 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.150 -0.350 26060 6107 1 9 . 1 1 53 53 LYS C C 53 172.300 172.300 174.600 -2.300 26060 6108 1 9 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.606 0.234 26060 6109 1 9 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.105 -1.855 26060 6110 1 9 . 1 1 53 53 LYS H H 53 7.190 7.190 7.426 -0.236 26060 6111 1 9 . 1 1 54 54 VAL N N 54 120.380 120.380 117.929 2.451 26060 6112 1 9 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.761 0.009 26060 6113 1 9 . 1 1 54 54 VAL C C 54 173.600 173.600 174.045 -0.445 26060 6114 1 9 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.359 -0.319 26060 6115 1 9 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.746 -2.046 26060 6116 1 9 . 1 1 54 54 VAL H H 54 8.450 8.450 8.503 -0.053 26060 6117 1 9 . 1 1 55 55 VAL N N 55 126.920 126.920 122.864 4.056 26060 6118 1 9 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.948 -0.248 26060 6119 1 9 . 1 1 55 55 VAL C C 55 173.800 173.800 173.833 -0.033 26060 6120 1 9 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.935 -0.065 26060 6121 1 9 . 1 1 55 55 VAL CB C 55 34.100 34.100 37.012 -2.912 26060 6122 1 9 . 1 1 55 55 VAL H H 55 9.260 9.260 9.157 0.103 26060 6123 1 9 . 1 1 56 56 PHE N N 56 126.130 126.130 124.366 1.764 26060 6124 1 9 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.976 -0.286 26060 6125 1 9 . 1 1 56 56 PHE C C 56 174.000 174.000 174.339 -0.339 26060 6126 1 9 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.739 -0.159 26060 6127 1 9 . 1 1 56 56 PHE CB C 56 40.890 40.890 41.783 -0.893 26060 6128 1 9 . 1 1 56 56 PHE H H 56 9.290 9.290 8.863 0.427 26060 6129 1 9 . 1 1 57 57 HIS N N 57 124.180 124.180 125.125 -0.945 26060 6130 1 9 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.890 -0.090 26060 6131 1 9 . 1 1 57 57 HIS C C 57 174.700 174.700 175.116 -0.416 26060 6132 1 9 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.434 -0.115 26060 6133 1 9 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.349 1.751 26060 6134 1 9 . 1 1 57 57 HIS H H 57 8.690 8.690 8.499 0.191 26060 6135 1 9 . 1 1 58 58 LEU N N 58 122.050 122.050 122.834 -0.784 26060 6136 1 9 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.409 -0.169 26060 6137 1 9 . 1 1 58 58 LEU C C 58 174.400 174.400 177.057 -2.657 26060 6138 1 9 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.721 0.689 26060 6139 1 9 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.422 -1.262 26060 6140 1 9 . 1 1 58 58 LEU H H 58 9.050 9.050 7.870 1.180 26060 6141 1 9 . 1 1 59 59 HIS N N 59 118.510 118.510 117.869 0.641 26060 6142 1 9 . 1 1 59 59 HIS C C 59 175.300 175.300 176.809 -1.509 26060 6143 1 9 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.281 3.829 26060 6144 1 9 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.106 -0.176 26060 6145 1 9 . 1 1 59 59 HIS H H 59 5.160 5.160 7.889 -2.729 26060 6146 1 9 . 1 1 60 60 GLU N N 60 122.190 122.190 124.244 -2.054 26060 6147 1 9 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.046 -0.086 26060 6148 1 9 . 1 1 60 60 GLU C C 60 175.130 175.130 177.302 -2.172 26060 6149 1 9 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.147 -0.137 26060 6150 1 9 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.029 -0.209 26060 6151 1 9 . 1 1 60 60 GLU H H 60 7.960 7.960 8.692 -0.732 26060 6152 1 9 . 1 1 61 61 SER N N 61 116.940 116.940 112.952 3.988 26060 6153 1 9 . 1 1 61 61 SER HA H 61 4.200 4.200 4.335 -0.135 26060 6154 1 9 . 1 1 61 61 SER CA C 61 60.010 60.010 59.374 0.636 26060 6155 1 9 . 1 1 61 61 SER CB C 61 63.140 63.140 63.396 -0.256 26060 6156 1 9 . 1 1 61 61 SER H H 61 8.540 8.540 8.294 0.246 26060 6157 1 9 . 1 1 62 62 PHE N N 62 123.700 123.700 122.326 1.374 26060 6158 1 9 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.674 -0.124 26060 6159 1 9 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.550 2.390 26060 6160 1 9 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.004 -0.604 26060 6161 1 9 . 1 1 62 62 PHE H H 62 8.640 8.640 8.038 0.602 26060 6162 1 9 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.438 -0.028 26060 6163 1 9 . 1 1 63 63 PRO C C 63 176.400 176.400 176.513 -0.113 26060 6164 1 9 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.301 -0.701 26060 6165 1 9 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.923 -0.063 26060 6166 1 9 . 1 1 64 64 ARG N N 64 116.840 116.840 120.959 -4.119 26060 6167 1 9 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.092 0.008 26060 6168 1 9 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.088 -0.478 26060 6169 1 9 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.779 0.052 26060 6170 1 9 . 1 1 64 64 ARG H H 64 8.890 8.890 8.690 0.200 26060 6171 1 9 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.348 -0.358 26060 6172 1 9 . 1 1 65 65 PRO C C 65 175.800 175.800 177.239 -1.439 26060 6173 1 9 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.179 1.631 26060 6174 1 9 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.934 -0.054 26060 6175 1 9 . 1 1 66 66 LYS N N 66 119.035 119.035 120.174 -1.139 26060 6176 1 9 . 1 1 66 66 LYS HA H 66 4.610 4.610 4.867 -0.257 26060 6177 1 9 . 1 1 66 66 LYS C C 66 175.400 175.400 175.810 -0.410 26060 6178 1 9 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.817 -0.364 26060 6179 1 9 . 1 1 66 66 LYS CB C 66 31.730 31.730 31.906 -0.176 26060 6180 1 9 . 1 1 66 66 LYS H H 66 7.630 7.630 7.909 -0.279 26060 6181 1 9 . 1 1 67 67 ARG N N 67 127.394 127.394 128.013 -0.619 26060 6182 1 9 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.614 0.126 26060 6183 1 9 . 1 1 67 67 ARG C C 67 174.500 174.500 174.995 -0.495 26060 6184 1 9 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.455 0.345 26060 6185 1 9 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.529 -0.815 26060 6186 1 9 . 1 1 67 67 ARG H H 67 8.855 8.855 8.724 0.131 26060 6187 1 9 . 1 1 68 68 VAL N N 68 124.388 124.388 120.071 4.317 26060 6188 1 9 . 1 1 68 68 VAL HA H 68 4.580 4.580 4.981 -0.401 26060 6189 1 9 . 1 1 68 68 VAL C C 68 176.850 176.850 175.510 1.340 26060 6190 1 9 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.931 2.142 26060 6191 1 9 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.425 0.179 26060 6192 1 9 . 1 1 68 68 VAL H H 68 8.681 8.681 8.409 0.272 26060 6193 1 9 . 1 1 69 69 CYS N N 69 127.080 127.080 125.565 1.515 26060 6194 1 9 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.748 0.322 26060 6195 1 9 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.925 0.421 26060 6196 1 9 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.994 0.776 26060 6197 1 9 . 1 1 69 69 CYS H H 69 9.455 9.455 8.997 0.458 26060 6198 1 9 . 1 1 70 70 LYS N N 70 125.480 125.480 123.493 1.987 26060 6199 1 9 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.559 -0.069 26060 6200 1 9 . 1 1 70 70 LYS C C 70 174.300 174.300 175.333 -1.033 26060 6201 1 9 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.206 1.554 26060 6202 1 9 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.343 -0.173 26060 6203 1 9 . 1 1 70 70 LYS H H 70 9.050 9.050 8.548 0.502 26060 6204 1 9 . 1 1 71 71 ASP N N 71 116.940 116.940 119.291 -2.351 26060 6205 1 9 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.913 0.187 26060 6206 1 9 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.068 -0.988 26060 6207 1 9 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.171 2.209 26060 6208 1 9 . 1 1 71 71 ASP H H 71 7.620 7.620 7.482 0.138 26060 6209 1 9 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.093 -0.833 26060 6210 1 9 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.901 -2.251 26060 6211 1 9 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.113 -1.073 26060 6212 1 9 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.099 0.001 26060 6213 1 9 . 1 1 73 73 PRO C C 73 174.700 174.700 175.861 -1.161 26060 6214 1 9 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.265 -2.575 26060 6215 1 9 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.234 2.806 26060 6216 1 9 . 1 1 74 74 TYR N N 74 125.400 125.400 125.206 0.194 26060 6217 1 9 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.489 0.361 26060 6218 1 9 . 1 1 74 74 TYR C C 74 172.900 172.900 175.061 -2.161 26060 6219 1 9 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.003 -2.333 26060 6220 1 9 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.362 -2.962 26060 6221 1 9 . 1 1 74 74 TYR H H 74 8.960 8.960 8.365 0.595 26060 6222 1 9 . 1 1 75 75 LYS N N 75 121.400 121.400 120.081 1.319 26060 6223 1 9 . 1 1 75 75 LYS HA H 75 5.590 5.590 4.881 0.709 26060 6224 1 9 . 1 1 75 75 LYS C C 75 173.800 173.800 174.299 -0.499 26060 6225 1 9 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.553 0.097 26060 6226 1 9 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.598 -0.708 26060 6227 1 9 . 1 1 75 75 LYS H H 75 7.670 7.670 7.925 -0.255 26060 6228 1 9 . 1 1 76 76 VAL N N 76 119.800 119.800 120.719 -0.919 26060 6229 1 9 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.167 -0.277 26060 6230 1 9 . 1 1 76 76 VAL C C 76 173.900 173.900 174.143 -0.243 26060 6231 1 9 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.467 1.263 26060 6232 1 9 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.743 -0.203 26060 6233 1 9 . 1 1 76 76 VAL H H 76 8.180 8.180 7.842 0.338 26060 6234 1 9 . 1 1 77 77 GLU N N 77 126.190 126.190 126.878 -0.688 26060 6235 1 9 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.805 0.145 26060 6236 1 9 . 1 1 77 77 GLU C C 77 174.700 174.700 175.459 -0.759 26060 6237 1 9 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.164 -0.224 26060 6238 1 9 . 1 1 77 77 GLU CB C 77 31.550 31.550 30.814 0.736 26060 6239 1 9 . 1 1 77 77 GLU H H 77 8.270 8.270 8.629 -0.359 26060 6240 1 9 . 1 1 78 78 GLU N N 78 126.180 126.180 123.964 2.216 26060 6241 1 9 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.594 -0.144 26060 6242 1 9 . 1 1 78 78 GLU C C 78 175.400 175.400 174.060 1.340 26060 6243 1 9 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.113 -0.071 26060 6244 1 9 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.888 3.212 26060 6245 1 9 . 1 1 78 78 GLU H H 78 7.870 7.870 8.582 -0.712 26060 6246 1 9 . 1 1 79 79 SER N N 79 112.109 112.109 113.091 -0.982 26060 6247 1 9 . 1 1 79 79 SER HA H 79 5.560 5.560 5.260 0.300 26060 6248 1 9 . 1 1 79 79 SER C C 79 172.490 172.490 172.965 -0.475 26060 6249 1 9 . 1 1 79 79 SER CA C 79 57.754 57.754 56.637 1.117 26060 6250 1 9 . 1 1 79 79 SER CB C 79 65.861 65.861 65.305 0.556 26060 6251 1 9 . 1 1 79 79 SER H H 79 7.714 7.714 8.278 -0.564 26060 6252 1 9 . 1 1 80 80 GLY N N 80 106.048 106.048 110.184 -4.136 26060 6253 1 9 . 1 1 80 80 GLY C C 80 172.630 172.630 171.850 0.780 26060 6254 1 9 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.749 0.821 26060 6255 1 9 . 1 1 80 80 GLY H H 80 8.828 8.828 8.824 0.004 26060 6256 1 9 . 1 1 81 81 TYR N N 81 115.280 115.280 114.514 0.766 26060 6257 1 9 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.350 0.330 26060 6258 1 9 . 1 1 81 81 TYR C C 81 174.100 174.100 174.010 0.090 26060 6259 1 9 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.929 -1.429 26060 6260 1 9 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.505 1.835 26060 6261 1 9 . 1 1 81 81 TYR H H 81 8.770 8.770 8.098 0.672 26060 6262 1 9 . 1 1 82 82 ALA N N 82 122.350 122.350 122.662 -0.312 26060 6263 1 9 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.589 -0.189 26060 6264 1 9 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.611 0.429 26060 6265 1 9 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.304 1.096 26060 6266 1 9 . 1 1 82 82 ALA H H 82 7.160 7.160 7.361 -0.201 26060 6267 1 9 . 1 1 83 83 GLY N N 83 107.100 107.100 106.690 0.410 26060 6268 1 9 . 1 1 83 83 GLY C C 83 172.500 172.500 173.578 -1.078 26060 6269 1 9 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.005 0.605 26060 6270 1 9 . 1 1 83 83 GLY H H 83 8.220 8.220 8.272 -0.052 26060 6271 1 9 . 1 1 84 84 PHE N N 84 111.660 111.660 114.235 -2.575 26060 6272 1 9 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.512 0.178 26060 6273 1 9 . 1 1 84 84 PHE C C 84 172.460 172.460 173.410 -0.950 26060 6274 1 9 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.688 -0.188 26060 6275 1 9 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.297 -0.717 26060 6276 1 9 . 1 1 84 84 PHE H H 84 7.700 7.700 8.149 -0.449 26060 6277 1 9 . 1 1 85 85 ILE N N 85 117.810 117.810 121.870 -4.060 26060 6278 1 9 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.076 0.234 26060 6279 1 9 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.002 -1.662 26060 6280 1 9 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.093 -1.833 26060 6281 1 9 . 1 1 85 85 ILE H H 85 8.340 8.340 8.536 -0.196 26060 6282 1 9 . 1 1 86 86 LEU N N 86 108.130 108.130 129.396 -21.266 26060 6283 1 9 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.027 -0.047 26060 6284 1 9 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.929 2.271 26060 6285 1 9 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.235 0.065 26060 6286 1 9 . 1 1 86 86 LEU H H 86 9.900 9.900 8.750 1.150 26060 6287 1 9 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.542 0.558 26060 6288 1 9 . 1 1 87 87 PRO C C 87 175.340 175.340 175.805 -0.465 26060 6289 1 9 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.702 0.408 26060 6290 1 9 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.490 1.070 26060 6291 1 9 . 1 1 88 88 ILE N N 88 126.000 126.000 126.217 -0.217 26060 6292 1 9 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.275 0.515 26060 6293 1 9 . 1 1 88 88 ILE C C 88 176.100 176.100 175.224 0.876 26060 6294 1 9 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.654 -0.094 26060 6295 1 9 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.687 2.313 26060 6296 1 9 . 1 1 88 88 ILE H H 88 9.380 9.380 8.661 0.719 26060 6297 1 9 . 1 1 89 89 GLU N N 89 123.900 123.900 125.658 -1.758 26060 6298 1 9 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.271 -0.071 26060 6299 1 9 . 1 1 89 89 GLU C C 89 173.800 173.800 175.594 -1.794 26060 6300 1 9 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.396 -0.426 26060 6301 1 9 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.304 1.076 26060 6302 1 9 . 1 1 89 89 GLU H H 89 9.320 9.320 9.014 0.306 26060 6303 1 9 . 1 1 90 90 VAL N N 90 123.980 123.980 123.662 0.318 26060 6304 1 9 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.146 0.014 26060 6305 1 9 . 1 1 90 90 VAL C C 90 174.800 174.800 174.482 0.318 26060 6306 1 9 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.169 0.821 26060 6307 1 9 . 1 1 90 90 VAL CB C 90 32.490 32.490 32.967 -0.477 26060 6308 1 9 . 1 1 90 90 VAL H H 90 8.630 8.630 8.523 0.107 26060 6309 1 9 . 1 1 91 91 TYR N N 91 124.230 124.230 126.936 -2.706 26060 6310 1 9 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.498 0.162 26060 6311 1 9 . 1 1 91 91 TYR C C 91 176.800 176.800 175.404 1.396 26060 6312 1 9 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.658 -0.958 26060 6313 1 9 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.591 1.649 26060 6314 1 9 . 1 1 91 91 TYR H H 91 8.640 8.640 9.082 -0.442 26060 6315 1 9 . 1 1 92 92 PHE N N 92 121.200 121.200 123.319 -2.119 26060 6316 1 9 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.204 0.456 26060 6317 1 9 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.141 1.369 26060 6318 1 9 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.346 1.354 26060 6319 1 9 . 1 1 92 92 PHE H H 92 8.750 8.750 9.057 -0.307 26060 6320 1 9 . 1 1 93 93 LYS N N 93 123.450 123.450 121.764 1.686 26060 6321 1 9 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.569 0.031 26060 6322 1 9 . 1 1 93 93 LYS C C 93 174.200 174.200 175.432 -1.232 26060 6323 1 9 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.003 -0.823 26060 6324 1 9 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.438 -0.758 26060 6325 1 9 . 1 1 93 93 LYS H H 93 8.560 8.560 8.868 -0.308 26060 6326 1 9 . 1 1 94 94 ASN N N 94 118.800 118.800 121.562 -2.762 26060 6327 1 9 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.744 -0.304 26060 6328 1 9 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.454 -1.244 26060 6329 1 9 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.936 -1.136 26060 6330 1 9 . 1 1 94 94 ASN H H 94 7.820 7.820 8.098 -0.278 26060 6331 1 9 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.407 -0.077 26060 6332 1 9 . 1 1 95 95 LYS C C 95 175.800 175.800 175.822 -0.022 26060 6333 1 9 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.617 -0.407 26060 6334 1 9 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.176 -0.166 26060 6335 1 9 . 1 1 96 96 GLU N N 96 118.330 118.330 120.415 -2.085 26060 6336 1 9 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.363 0.147 26060 6337 1 9 . 1 1 96 96 GLU C C 96 173.200 173.200 176.143 -2.943 26060 6338 1 9 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.212 -1.113 26060 6339 1 9 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.813 1.657 26060 6340 1 9 . 1 1 96 96 GLU H H 96 7.120 7.120 7.659 -0.539 26060 6341 1 9 . 1 1 97 97 GLU N N 97 115.630 115.630 120.267 -4.637 26060 6342 1 9 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.169 0.261 26060 6343 1 9 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.220 -1.360 26060 6344 1 9 . 1 1 97 97 GLU CB C 97 29.270 29.270 29.109 0.161 26060 6345 1 9 . 1 1 97 97 GLU H H 97 8.060 8.060 8.308 -0.248 26060 6346 1 9 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.221 0.779 26060 6347 1 9 . 1 1 98 98 PRO C C 98 175.900 175.900 176.692 -0.792 26060 6348 1 9 . 1 1 98 98 PRO CA C 98 62.160 62.160 63.923 -1.763 26060 6349 1 9 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.577 2.423 26060 6350 1 9 . 1 1 99 99 ARG N N 99 122.800 122.800 120.505 2.295 26060 6351 1 9 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.400 0.230 26060 6352 1 9 . 1 1 99 99 ARG C C 99 175.800 175.800 175.165 0.635 26060 6353 1 9 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.167 0.323 26060 6354 1 9 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.378 0.032 26060 6355 1 9 . 1 1 99 99 ARG H H 99 8.602 8.602 8.642 -0.040 26060 6356 1 9 . 1 1 100 100 LYS N N 100 113.220 113.220 117.736 -4.516 26060 6357 1 9 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.764 0.176 26060 6358 1 9 . 1 1 100 100 LYS C C 100 174.100 174.100 174.489 -0.389 26060 6359 1 9 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.169 -0.259 26060 6360 1 9 . 1 1 100 100 LYS CB C 100 34.720 34.720 36.010 -1.290 26060 6361 1 9 . 1 1 100 100 LYS H H 100 7.650 7.650 7.394 0.256 26060 6362 1 9 . 1 1 101 101 VAL N N 101 116.230 116.230 121.051 -4.821 26060 6363 1 9 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.156 0.114 26060 6364 1 9 . 1 1 101 101 VAL C C 101 171.600 171.600 173.540 -1.940 26060 6365 1 9 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.346 0.914 26060 6366 1 9 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.411 -0.231 26060 6367 1 9 . 1 1 101 101 VAL H H 101 8.120 8.120 8.123 -0.003 26060 6368 1 9 . 1 1 102 102 ARG N N 102 124.980 124.980 127.561 -2.581 26060 6369 1 9 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.907 0.253 26060 6370 1 9 . 1 1 102 102 ARG C C 102 174.340 174.340 175.257 -0.917 26060 6371 1 9 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.696 -0.946 26060 6372 1 9 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.718 1.632 26060 6373 1 9 . 1 1 102 102 ARG H H 102 7.930 7.930 8.274 -0.344 26060 6374 1 9 . 1 1 103 103 PHE N N 103 124.590 124.590 127.183 -2.593 26060 6375 1 9 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.806 -0.014 26060 6376 1 9 . 1 1 103 103 PHE C C 103 174.280 174.280 175.032 -0.752 26060 6377 1 9 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.695 1.285 26060 6378 1 9 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.024 2.226 26060 6379 1 9 . 1 1 103 103 PHE H H 103 9.390 9.390 9.173 0.217 26060 6380 1 9 . 1 1 104 104 ASP N N 104 124.700 124.700 126.556 -1.856 26060 6381 1 9 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.711 0.088 26060 6382 1 9 . 1 1 104 104 ASP C C 104 174.500 174.500 174.971 -0.471 26060 6383 1 9 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.946 -0.555 26060 6384 1 9 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.770 0.460 26060 6385 1 9 . 1 1 104 104 ASP H H 104 9.010 9.010 8.935 0.075 26060 6386 1 9 . 1 1 105 105 TYR N N 105 129.840 129.840 125.303 4.537 26060 6387 1 9 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.529 -0.429 26060 6388 1 9 . 1 1 105 105 TYR C C 105 173.100 173.100 173.957 -0.857 26060 6389 1 9 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.573 1.107 26060 6390 1 9 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.881 0.969 26060 6391 1 9 . 1 1 105 105 TYR H H 105 8.140 8.140 8.204 -0.064 26060 6392 1 9 . 1 1 106 106 ASP N N 106 126.800 126.800 128.227 -1.427 26060 6393 1 9 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.381 -0.161 26060 6394 1 9 . 1 1 106 106 ASP C C 106 172.900 172.900 174.634 -1.734 26060 6395 1 9 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.678 -0.168 26060 6396 1 9 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.258 -1.758 26060 6397 1 9 . 1 1 106 106 ASP H H 106 7.730 7.730 8.412 -0.682 26060 6398 1 9 . 1 1 107 107 LEU N N 107 132.150 132.150 128.073 4.077 26060 6399 1 9 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.334 -0.494 26060 6400 1 9 . 1 1 107 107 LEU C C 107 172.100 172.100 174.930 -2.830 26060 6401 1 9 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.822 -0.122 26060 6402 1 9 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.751 -1.511 26060 6403 1 9 . 1 1 107 107 LEU H H 107 7.770 7.770 7.731 0.039 26060 6404 1 9 . 1 1 108 108 PHE N N 108 118.960 118.960 121.903 -2.943 26060 6405 1 9 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.884 -0.194 26060 6406 1 9 . 1 1 108 108 PHE C C 108 174.300 174.300 173.723 0.577 26060 6407 1 9 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.388 -0.698 26060 6408 1 9 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.613 -0.323 26060 6409 1 9 . 1 1 108 108 PHE H H 108 6.060 6.060 7.160 -1.100 26060 6410 1 9 . 1 1 109 109 LEU N N 109 118.900 118.900 123.425 -4.525 26060 6411 1 9 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.733 -0.333 26060 6412 1 9 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.236 -1.076 26060 6413 1 9 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.673 -1.593 26060 6414 1 9 . 1 1 109 109 LEU H H 109 8.388 8.388 8.331 0.057 26060 6415 1 9 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.219 0.221 26060 6416 1 9 . 1 1 111 111 LEU C C 111 177.300 177.300 176.957 0.343 26060 6417 1 9 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.348 -1.128 26060 6418 1 9 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.336 1.534 26060 6419 1 9 . 1 1 112 112 GLU N N 112 120.660 120.660 123.558 -2.898 26060 6420 1 9 . 1 1 112 112 GLU HA H 112 4.170 4.170 3.992 0.178 26060 6421 1 9 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.600 -0.140 26060 6422 1 9 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.165 -0.475 26060 6423 1 9 . 1 1 112 112 GLU H H 112 8.780 8.780 8.746 0.034 26060 6424 1 9 . 1 1 113 113 GLY C C 113 173.900 173.900 173.826 0.074 26060 6425 1 9 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.087 -0.137 26060 6426 1 9 . 1 1 114 114 HIS N N 114 120.890 120.890 117.353 3.537 26060 6427 1 9 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.032 -0.126 26060 6428 1 9 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.093 1.677 26060 6429 1 9 . 1 1 114 114 HIS CB C 114 30.590 30.590 30.673 -0.083 26060 6430 1 9 . 1 1 114 114 HIS H H 114 7.934 7.934 7.608 0.326 26060 6431 1 9 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.842 -0.042 26060 6432 1 9 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.067 1.023 26060 6433 1 9 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.992 -1.312 26060 6434 1 9 . 1 1 116 116 PRO C C 116 176.600 176.600 175.669 0.931 26060 6435 1 9 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.019 0.281 26060 6436 1 9 . 1 1 117 117 VAL N N 117 127.480 127.480 126.526 0.954 26060 6437 1 9 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.299 -0.509 26060 6438 1 9 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.764 0.936 26060 6439 1 9 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.809 -0.609 26060 6440 1 9 . 1 1 117 117 VAL H H 117 8.890 8.890 7.990 0.900 26060 6441 1 9 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.977 0.013 26060 6442 1 9 . 1 1 118 118 ASN C C 118 172.700 172.700 173.581 -0.881 26060 6443 1 9 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.504 -0.144 26060 6444 1 9 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.932 -0.732 26060 6445 1 9 . 1 1 119 119 HIS N N 119 124.930 124.930 125.907 -0.977 26060 6446 1 9 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.062 -0.242 26060 6447 1 9 . 1 1 119 119 HIS C C 119 173.500 173.500 172.820 0.680 26060 6448 1 9 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.819 2.151 26060 6449 1 9 . 1 1 119 119 HIS CB C 119 34.670 34.670 33.934 0.736 26060 6450 1 9 . 1 1 119 119 HIS H H 119 8.790 8.790 9.025 -0.235 26060 6451 1 9 . 1 1 120 120 LEU N N 120 128.280 128.280 125.918 2.362 26060 6452 1 9 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.120 -0.170 26060 6453 1 9 . 1 1 120 120 LEU C C 120 174.030 174.030 175.259 -1.229 26060 6454 1 9 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.601 0.839 26060 6455 1 9 . 1 1 120 120 LEU CB C 120 46.600 46.600 45.633 0.967 26060 6456 1 9 . 1 1 120 120 LEU H H 120 7.460 7.460 8.640 -1.180 26060 6457 1 9 . 1 1 121 121 ARG N N 121 128.060 128.060 123.552 4.508 26060 6458 1 9 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.697 -0.057 26060 6459 1 9 . 1 1 121 121 ARG C C 121 173.400 173.400 173.830 -0.430 26060 6460 1 9 . 1 1 121 121 ARG CA C 121 54.360 54.360 53.921 0.439 26060 6461 1 9 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.416 1.844 26060 6462 1 9 . 1 1 121 121 ARG H H 121 9.860 9.860 9.029 0.831 26060 6463 1 9 . 1 1 122 122 CYS N N 122 125.290 125.290 117.759 7.531 26060 6464 1 9 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.247 -0.227 26060 6465 1 9 . 1 1 122 122 CYS C C 122 174.600 174.600 174.430 0.170 26060 6466 1 9 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.442 1.848 26060 6467 1 9 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.640 -2.610 26060 6468 1 9 . 1 1 122 122 CYS H H 122 8.835 8.835 8.605 0.230 26060 6469 1 9 . 1 1 123 123 GLU N N 123 125.920 125.920 123.040 2.880 26060 6470 1 9 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.506 0.174 26060 6471 1 9 . 1 1 123 123 GLU C C 123 174.500 174.500 174.632 -0.132 26060 6472 1 9 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.737 -0.317 26060 6473 1 9 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.454 0.129 26060 6474 1 9 . 1 1 123 123 GLU H H 123 8.970 8.970 9.181 -0.211 26060 6475 1 9 . 1 1 124 124 LYS N N 124 121.837 121.837 123.427 -1.590 26060 6476 1 9 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.925 0.035 26060 6477 1 9 . 1 1 124 124 LYS C C 124 175.700 175.700 175.706 -0.006 26060 6478 1 9 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.203 0.154 26060 6479 1 9 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.552 -0.363 26060 6480 1 9 . 1 1 124 124 LYS H H 124 8.652 8.652 8.415 0.237 26060 6481 1 9 . 1 1 125 125 LEU N N 125 127.000 127.000 130.141 -3.141 26060 6482 1 9 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.575 0.075 26060 6483 1 9 . 1 1 125 125 LEU C C 125 175.110 175.110 175.511 -0.401 26060 6484 1 9 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.709 0.145 26060 6485 1 9 . 1 1 125 125 LEU CB C 125 44.267 44.267 42.857 1.410 26060 6486 1 9 . 1 1 125 125 LEU H H 125 9.175 9.175 9.105 0.070 26060 6487 1 9 . 1 1 126 126 THR N N 126 117.779 117.779 120.354 -2.575 26060 6488 1 9 . 1 1 126 126 THR HA H 126 4.650 4.650 4.458 0.192 26060 6489 1 9 . 1 1 126 126 THR C C 126 173.200 173.200 173.677 -0.477 26060 6490 1 9 . 1 1 126 126 THR CA C 126 62.036 62.036 62.080 -0.043 26060 6491 1 9 . 1 1 126 126 THR CB C 126 70.284 70.284 68.824 1.460 26060 6492 1 9 . 1 1 126 126 THR H H 126 8.331 8.331 8.445 -0.114 26060 6493 1 9 . 1 1 127 127 PHE N N 127 126.576 126.576 127.616 -1.040 26060 6494 1 9 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.582 0.008 26060 6495 1 9 . 1 1 127 127 PHE C C 127 174.860 174.860 174.532 0.328 26060 6496 1 9 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.823 0.041 26060 6497 1 9 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.790 -0.790 26060 6498 1 9 . 1 1 127 127 PHE H H 127 9.051 9.051 8.857 0.194 26060 6499 1 9 . 1 1 128 128 ASN N N 128 123.040 123.040 122.383 0.657 26060 6500 1 9 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.632 -0.012 26060 6501 1 9 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.388 1.093 26060 6502 1 9 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.899 0.561 26060 6503 1 9 . 1 1 128 128 ASN H H 128 8.880 8.880 8.726 0.154 26060 6504 1 9 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.627 0.133 26060 6505 1 9 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.547 -0.647 26060 6506 1 9 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.223 1.507 26060 6507 1 9 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.811 -0.021 26060 6508 1 9 . 1 1 130 130 PRO C C 130 177.470 177.470 175.983 1.487 26060 6509 1 9 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.508 0.066 26060 6510 1 9 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.267 -0.957 26060 6511 1 9 . 1 1 131 131 THR N N 131 113.400 113.400 113.527 -0.127 26060 6512 1 9 . 1 1 131 131 THR HA H 131 4.300 4.300 4.223 0.077 26060 6513 1 9 . 1 1 131 131 THR C C 131 175.200 175.200 176.160 -0.960 26060 6514 1 9 . 1 1 131 131 THR CA C 131 62.200 62.200 61.041 1.159 26060 6515 1 9 . 1 1 131 131 THR CB C 131 70.600 70.600 70.521 0.079 26060 6516 1 9 . 1 1 131 131 THR H H 131 8.950 8.950 8.028 0.922 26060 6517 1 9 . 1 1 132 132 GLU N N 132 122.199 122.199 125.247 -3.048 26060 6518 1 9 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.977 0.033 26060 6519 1 9 . 1 1 132 132 GLU C C 132 178.700 178.700 178.156 0.544 26060 6520 1 9 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.012 0.282 26060 6521 1 9 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.652 -0.491 26060 6522 1 9 . 1 1 132 132 GLU H H 132 8.932 8.932 9.024 -0.092 26060 6523 1 9 . 1 1 133 133 ASP N N 133 116.324 116.324 119.790 -3.466 26060 6524 1 9 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.343 -0.013 26060 6525 1 9 . 1 1 133 133 ASP C C 133 177.800 177.800 178.726 -0.926 26060 6526 1 9 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.749 -0.203 26060 6527 1 9 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.575 1.248 26060 6528 1 9 . 1 1 133 133 ASP H H 133 8.490 8.490 8.216 0.274 26060 6529 1 9 . 1 1 134 134 PHE N N 134 119.914 119.914 120.792 -0.878 26060 6530 1 9 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.257 0.353 26060 6531 1 9 . 1 1 134 134 PHE C C 134 177.300 177.300 177.194 0.106 26060 6532 1 9 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.472 0.066 26060 6533 1 9 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.989 0.211 26060 6534 1 9 . 1 1 134 134 PHE H H 134 7.787 7.787 7.558 0.229 26060 6535 1 9 . 1 1 135 135 ARG N N 135 119.794 119.794 119.862 -0.068 26060 6536 1 9 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.619 -0.269 26060 6537 1 9 . 1 1 135 135 ARG C C 135 177.370 177.370 178.276 -0.906 26060 6538 1 9 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.966 0.410 26060 6539 1 9 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.021 0.375 26060 6540 1 9 . 1 1 135 135 ARG H H 135 9.087 9.087 8.624 0.463 26060 6541 1 9 . 1 1 136 136 ARG N N 136 114.554 114.554 118.789 -4.235 26060 6542 1 9 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.882 -0.062 26060 6543 1 9 . 1 1 136 136 ARG C C 136 178.950 178.950 178.796 0.154 26060 6544 1 9 . 1 1 136 136 ARG CA C 136 59.800 59.800 60.020 -0.220 26060 6545 1 9 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.109 0.108 26060 6546 1 9 . 1 1 136 136 ARG H H 136 7.747 7.747 8.554 -0.807 26060 6547 1 9 . 1 1 137 137 LYS N N 137 118.298 118.298 118.877 -0.579 26060 6548 1 9 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.993 -0.093 26060 6549 1 9 . 1 1 137 137 LYS C C 137 177.980 177.980 179.021 -1.041 26060 6550 1 9 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.491 0.904 26060 6551 1 9 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.464 -0.017 26060 6552 1 9 . 1 1 137 137 LYS H H 137 7.154 7.154 7.448 -0.294 26060 6553 1 9 . 1 1 138 138 LEU N N 138 117.159 117.159 119.087 -1.928 26060 6554 1 9 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.695 -0.275 26060 6555 1 9 . 1 1 138 138 LEU C C 138 179.100 179.100 178.455 0.645 26060 6556 1 9 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.212 0.019 26060 6557 1 9 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.408 0.920 26060 6558 1 9 . 1 1 138 138 LEU H H 138 7.709 7.709 7.843 -0.134 26060 6559 1 9 . 1 1 139 139 LEU N N 139 115.158 115.158 116.886 -1.728 26060 6560 1 9 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.097 0.053 26060 6561 1 9 . 1 1 139 139 LEU C C 139 177.600 177.600 178.616 -1.016 26060 6562 1 9 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.535 -1.006 26060 6563 1 9 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.936 -0.192 26060 6564 1 9 . 1 1 139 139 LEU H H 139 7.507 7.507 7.996 -0.489 26060 6565 1 9 . 1 1 140 140 LYS N N 140 120.256 120.256 118.415 1.841 26060 6566 1 9 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.002 0.108 26060 6567 1 9 . 1 1 140 140 LYS C C 140 175.800 175.800 177.077 -1.277 26060 6568 1 9 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.394 -0.342 26060 6569 1 9 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.372 0.274 26060 6570 1 9 . 1 1 140 140 LYS H H 140 7.304 7.304 7.609 -0.305 26060 6571 1 10 . 1 1 4 4 MET C C 4 175.800 175.800 177.045 -1.245 26060 6572 1 10 . 1 1 4 4 MET CA C 4 55.350 55.350 55.924 -0.574 26060 6573 1 10 . 1 1 4 4 MET CB C 4 32.880 32.880 29.423 3.457 26060 6574 1 10 . 1 1 5 5 ALA N N 5 125.230 125.230 120.611 4.619 26060 6575 1 10 . 1 1 5 5 ALA HA H 5 4.350 4.350 3.924 0.426 26060 6576 1 10 . 1 1 5 5 ALA CA C 5 52.430 52.430 53.614 -1.184 26060 6577 1 10 . 1 1 5 5 ALA CB C 5 19.370 19.370 17.793 1.577 26060 6578 1 10 . 1 1 5 5 ALA H H 5 8.320 8.320 8.468 -0.148 26060 6579 1 10 . 1 1 6 6 SER HA H 6 4.490 4.490 4.623 -0.133 26060 6580 1 10 . 1 1 6 6 SER CA C 6 58.200 58.200 56.984 1.216 26060 6581 1 10 . 1 1 6 6 SER CB C 6 63.700 63.700 64.146 -0.446 26060 6582 1 10 . 1 1 7 7 SER HA H 7 4.530 4.530 4.650 -0.120 26060 6583 1 10 . 1 1 7 7 SER CA C 7 58.200 58.200 58.967 -0.767 26060 6584 1 10 . 1 1 7 7 SER CB C 7 63.700 63.700 62.841 0.859 26060 6585 1 10 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.445 0.165 26060 6586 1 10 . 1 1 8 8 CYS C C 8 173.500 173.500 173.668 -0.168 26060 6587 1 10 . 1 1 8 8 CYS CA C 8 58.340 58.340 58.922 -0.583 26060 6588 1 10 . 1 1 8 8 CYS CB C 8 28.490 28.490 26.947 1.543 26060 6589 1 10 . 1 1 9 9 ALA N N 9 124.700 124.700 129.667 -4.967 26060 6590 1 10 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.193 -0.403 26060 6591 1 10 . 1 1 9 9 ALA C C 9 177.400 177.400 176.689 0.711 26060 6592 1 10 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.481 1.589 26060 6593 1 10 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.483 0.146 26060 6594 1 10 . 1 1 9 9 ALA H H 9 7.960 7.960 8.516 -0.556 26060 6595 1 10 . 1 1 10 10 VAL N N 10 120.124 120.124 124.376 -4.252 26060 6596 1 10 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.117 0.173 26060 6597 1 10 . 1 1 10 10 VAL C C 10 173.900 173.900 175.117 -1.217 26060 6598 1 10 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.590 -0.040 26060 6599 1 10 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.445 2.455 26060 6600 1 10 . 1 1 10 10 VAL H H 10 8.424 8.424 8.485 -0.061 26060 6601 1 10 . 1 1 11 11 GLN N N 11 125.818 125.818 126.850 -1.032 26060 6602 1 10 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.396 0.164 26060 6603 1 10 . 1 1 11 11 GLN C C 11 175.400 175.400 175.265 0.135 26060 6604 1 10 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.635 -0.512 26060 6605 1 10 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.309 1.720 26060 6606 1 10 . 1 1 11 11 GLN H H 11 8.636 8.636 8.609 0.027 26060 6607 1 10 . 1 1 12 12 VAL N N 12 119.106 119.106 119.683 -0.577 26060 6608 1 10 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.382 0.248 26060 6609 1 10 . 1 1 12 12 VAL C C 12 173.800 173.800 174.702 -0.902 26060 6610 1 10 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.388 0.412 26060 6611 1 10 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.250 2.461 26060 6612 1 10 . 1 1 12 12 VAL H H 12 8.827 8.827 8.975 -0.148 26060 6613 1 10 . 1 1 13 13 LYS N N 13 121.700 121.700 126.463 -4.763 26060 6614 1 10 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.215 -0.015 26060 6615 1 10 . 1 1 13 13 LYS C C 13 175.030 175.030 176.123 -1.093 26060 6616 1 10 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.162 0.268 26060 6617 1 10 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.071 1.849 26060 6618 1 10 . 1 1 13 13 LYS H H 13 8.234 8.234 8.561 -0.327 26060 6619 1 10 . 1 1 14 14 LEU N N 14 119.100 119.100 124.002 -4.902 26060 6620 1 10 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.181 -0.231 26060 6621 1 10 . 1 1 14 14 LEU C C 14 175.110 175.110 175.907 -0.797 26060 6622 1 10 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.373 -0.016 26060 6623 1 10 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.756 1.165 26060 6624 1 10 . 1 1 14 14 LEU H H 14 8.840 8.840 8.289 0.551 26060 6625 1 10 . 1 1 15 15 GLU N N 15 120.978 120.978 119.936 1.042 26060 6626 1 10 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.136 -0.146 26060 6627 1 10 . 1 1 15 15 GLU C C 15 173.800 173.800 174.868 -1.068 26060 6628 1 10 . 1 1 15 15 GLU CA C 15 55.428 55.428 55.048 0.380 26060 6629 1 10 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.411 -1.585 26060 6630 1 10 . 1 1 15 15 GLU H H 15 9.181 9.181 9.028 0.153 26060 6631 1 10 . 1 1 16 16 LEU N N 16 124.438 124.438 126.480 -2.042 26060 6632 1 10 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.380 -0.270 26060 6633 1 10 . 1 1 16 16 LEU C C 16 174.700 174.700 176.178 -1.478 26060 6634 1 10 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.609 0.467 26060 6635 1 10 . 1 1 16 16 LEU CB C 16 44.892 44.892 43.099 1.793 26060 6636 1 10 . 1 1 16 16 LEU H H 16 8.891 8.891 8.874 0.017 26060 6637 1 10 . 1 1 17 17 GLY N N 17 108.067 108.067 108.178 -0.111 26060 6638 1 10 . 1 1 17 17 GLY C C 17 170.350 170.350 172.359 -2.009 26060 6639 1 10 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.347 1.637 26060 6640 1 10 . 1 1 17 17 GLY H H 17 7.227 7.227 8.358 -1.131 26060 6641 1 10 . 1 1 18 18 HIS N N 18 111.200 111.200 118.759 -7.559 26060 6642 1 10 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.785 -0.165 26060 6643 1 10 . 1 1 18 18 HIS C C 18 172.400 172.400 172.680 -0.280 26060 6644 1 10 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.877 -0.937 26060 6645 1 10 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.617 1.542 26060 6646 1 10 . 1 1 18 18 HIS H H 18 8.150 8.150 9.127 -0.977 26060 6647 1 10 . 1 1 19 19 ARG N N 19 117.800 117.800 122.304 -4.504 26060 6648 1 10 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.790 0.310 26060 6649 1 10 . 1 1 19 19 ARG C C 19 175.800 175.800 174.058 1.742 26060 6650 1 10 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.069 -0.569 26060 6651 1 10 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.165 -0.515 26060 6652 1 10 . 1 1 19 19 ARG H H 19 9.010 9.010 8.894 0.116 26060 6653 1 10 . 1 1 20 20 ALA N N 20 120.390 120.390 122.197 -1.807 26060 6654 1 10 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.559 -0.029 26060 6655 1 10 . 1 1 20 20 ALA C C 20 175.800 175.800 175.072 0.728 26060 6656 1 10 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.816 1.374 26060 6657 1 10 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.033 0.717 26060 6658 1 10 . 1 1 20 20 ALA H H 20 8.070 8.070 8.402 -0.332 26060 6659 1 10 . 1 1 21 21 GLN N N 21 121.790 121.790 121.303 0.487 26060 6660 1 10 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.838 0.392 26060 6661 1 10 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.507 -0.177 26060 6662 1 10 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.911 -0.011 26060 6663 1 10 . 1 1 21 21 GLN H H 21 9.240 9.240 9.117 0.123 26060 6664 1 10 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.329 -0.699 26060 6665 1 10 . 1 1 22 22 VAL C C 22 176.500 176.500 175.763 0.737 26060 6666 1 10 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.531 2.499 26060 6667 1 10 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.446 -1.846 26060 6668 1 10 . 1 1 23 23 ARG N N 23 127.840 127.840 127.826 0.014 26060 6669 1 10 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.441 -0.311 26060 6670 1 10 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.730 0.870 26060 6671 1 10 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.691 1.460 26060 6672 1 10 . 1 1 23 23 ARG H H 23 8.720 8.720 8.133 0.587 26060 6673 1 10 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.278 -0.238 26060 6674 1 10 . 1 1 24 24 LYS C C 24 176.960 176.960 176.616 0.344 26060 6675 1 10 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.145 1.655 26060 6676 1 10 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.285 -0.225 26060 6677 1 10 . 1 1 25 25 LYS N N 25 115.870 115.870 119.753 -3.883 26060 6678 1 10 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.653 0.177 26060 6679 1 10 . 1 1 25 25 LYS CA C 25 52.960 52.960 54.073 -1.113 26060 6680 1 10 . 1 1 25 25 LYS CB C 25 35.080 35.080 34.184 0.896 26060 6681 1 10 . 1 1 25 25 LYS H H 25 7.720 7.720 7.490 0.230 26060 6682 1 10 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.737 0.093 26060 6683 1 10 . 1 1 26 26 PRO C C 26 177.400 177.400 176.721 0.679 26060 6684 1 10 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.692 -0.042 26060 6685 1 10 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.316 0.074 26060 6686 1 10 . 1 1 27 27 THR N N 27 111.270 111.270 114.502 -3.232 26060 6687 1 10 . 1 1 27 27 THR HA H 27 4.530 4.530 4.302 0.228 26060 6688 1 10 . 1 1 27 27 THR C C 27 177.300 177.300 176.817 0.483 26060 6689 1 10 . 1 1 27 27 THR CA C 27 61.300 61.300 60.490 0.809 26060 6690 1 10 . 1 1 27 27 THR CB C 27 71.460 71.460 70.176 1.284 26060 6691 1 10 . 1 1 27 27 THR H H 27 8.380 8.380 8.061 0.319 26060 6692 1 10 . 1 1 28 28 VAL N N 28 121.170 121.170 123.102 -1.932 26060 6693 1 10 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.811 0.072 26060 6694 1 10 . 1 1 28 28 VAL C C 28 177.030 177.030 175.984 1.046 26060 6695 1 10 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.070 0.129 26060 6696 1 10 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.671 -0.271 26060 6697 1 10 . 1 1 28 28 VAL H H 28 8.910 8.910 8.546 0.364 26060 6698 1 10 . 1 1 29 29 GLU N N 29 116.800 116.800 116.770 0.030 26060 6699 1 10 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.180 -0.260 26060 6700 1 10 . 1 1 29 29 GLU C C 29 176.200 176.200 175.923 0.277 26060 6701 1 10 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.365 1.885 26060 6702 1 10 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.453 -1.283 26060 6703 1 10 . 1 1 29 29 GLU H H 29 7.990 7.990 7.844 0.146 26060 6704 1 10 . 1 1 30 30 GLY N N 30 105.500 105.500 108.399 -2.899 26060 6705 1 10 . 1 1 30 30 GLY C C 30 174.900 174.900 174.067 0.833 26060 6706 1 10 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.222 -0.762 26060 6707 1 10 . 1 1 30 30 GLY H H 30 7.950 7.950 7.875 0.075 26060 6708 1 10 . 1 1 31 31 PHE N N 31 119.300 119.300 118.847 0.453 26060 6709 1 10 . 1 1 31 31 PHE HA H 31 4.760 4.760 5.049 -0.289 26060 6710 1 10 . 1 1 31 31 PHE C C 31 176.400 176.400 175.872 0.528 26060 6711 1 10 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.342 1.558 26060 6712 1 10 . 1 1 31 31 PHE CB C 31 35.500 35.500 38.902 -3.402 26060 6713 1 10 . 1 1 31 31 PHE H H 31 7.520 7.520 7.245 0.275 26060 6714 1 10 . 1 1 32 32 THR N N 32 112.300 112.300 117.337 -5.037 26060 6715 1 10 . 1 1 32 32 THR HA H 32 4.330 4.330 4.501 -0.171 26060 6716 1 10 . 1 1 32 32 THR C C 32 175.200 175.200 174.328 0.872 26060 6717 1 10 . 1 1 32 32 THR CA C 32 62.780 62.780 63.043 -0.263 26060 6718 1 10 . 1 1 32 32 THR CB C 32 70.350 70.350 70.076 0.274 26060 6719 1 10 . 1 1 32 32 THR H H 32 7.770 7.770 9.156 -1.386 26060 6720 1 10 . 1 1 33 33 HIS N N 33 121.900 121.900 121.589 0.311 26060 6721 1 10 . 1 1 33 33 HIS HA H 33 5.500 5.500 4.972 0.528 26060 6722 1 10 . 1 1 33 33 HIS C C 33 173.880 173.880 173.631 0.249 26060 6723 1 10 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.818 -0.038 26060 6724 1 10 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.930 3.709 26060 6725 1 10 . 1 1 33 33 HIS H H 33 9.110 9.110 8.817 0.293 26060 6726 1 10 . 1 1 34 34 ASP N N 34 120.300 120.300 123.849 -3.549 26060 6727 1 10 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.467 -0.067 26060 6728 1 10 . 1 1 34 34 ASP C C 34 175.100 175.100 175.320 -0.220 26060 6729 1 10 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.862 -0.552 26060 6730 1 10 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.561 -0.461 26060 6731 1 10 . 1 1 34 34 ASP H H 34 8.810 8.810 8.947 -0.137 26060 6732 1 10 . 1 1 35 35 TRP N N 35 119.800 119.800 119.337 0.463 26060 6733 1 10 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.497 0.233 26060 6734 1 10 . 1 1 35 35 TRP C C 35 174.900 174.900 173.267 1.633 26060 6735 1 10 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.198 -0.298 26060 6736 1 10 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.112 1.958 26060 6737 1 10 . 1 1 35 35 TRP H H 35 9.250 9.250 8.830 0.420 26060 6738 1 10 . 1 1 36 36 MET N N 36 120.980 120.980 121.556 -0.576 26060 6739 1 10 . 1 1 36 36 MET HA H 36 5.750 5.750 5.899 -0.149 26060 6740 1 10 . 1 1 36 36 MET C C 36 173.700 173.700 174.238 -0.538 26060 6741 1 10 . 1 1 36 36 MET CA C 36 54.830 54.830 54.207 0.623 26060 6742 1 10 . 1 1 36 36 MET CB C 36 35.220 35.220 36.834 -1.614 26060 6743 1 10 . 1 1 36 36 MET H H 36 9.080 9.080 8.955 0.125 26060 6744 1 10 . 1 1 37 37 VAL N N 37 126.220 126.220 120.865 5.355 26060 6745 1 10 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.106 0.204 26060 6746 1 10 . 1 1 37 37 VAL C C 37 172.300 172.300 174.265 -1.965 26060 6747 1 10 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.764 -1.224 26060 6748 1 10 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.711 1.359 26060 6749 1 10 . 1 1 37 37 VAL H H 37 9.080 9.080 8.815 0.265 26060 6750 1 10 . 1 1 38 38 PHE N N 38 120.640 120.640 122.681 -2.041 26060 6751 1 10 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.299 0.671 26060 6752 1 10 . 1 1 38 38 PHE C C 38 172.960 172.960 175.229 -2.269 26060 6753 1 10 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.794 -0.664 26060 6754 1 10 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.311 -0.311 26060 6755 1 10 . 1 1 38 38 PHE H H 38 8.320 8.320 9.051 -0.731 26060 6756 1 10 . 1 1 39 39 VAL N N 39 116.500 116.500 121.093 -4.593 26060 6757 1 10 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.558 -0.548 26060 6758 1 10 . 1 1 39 39 VAL C C 39 174.700 174.700 174.325 0.375 26060 6759 1 10 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.096 1.544 26060 6760 1 10 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.657 1.743 26060 6761 1 10 . 1 1 39 39 VAL H H 39 8.580 8.580 9.356 -0.776 26060 6762 1 10 . 1 1 40 40 ARG N N 40 124.100 124.100 124.094 0.006 26060 6763 1 10 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.981 0.099 26060 6764 1 10 . 1 1 40 40 ARG C C 40 173.800 173.800 174.172 -0.372 26060 6765 1 10 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.765 -0.835 26060 6766 1 10 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.683 0.897 26060 6767 1 10 . 1 1 40 40 ARG H H 40 9.880 9.880 8.735 1.145 26060 6768 1 10 . 1 1 41 41 GLY N N 41 107.640 107.640 106.342 1.298 26060 6769 1 10 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.646 1.324 26060 6770 1 10 . 1 1 41 41 GLY H H 41 8.910 8.910 8.590 0.320 26060 6771 1 10 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.365 0.125 26060 6772 1 10 . 1 1 42 42 PRO C C 42 177.300 177.300 176.699 0.601 26060 6773 1 10 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.754 -0.314 26060 6774 1 10 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.549 -0.439 26060 6775 1 10 . 1 1 43 43 GLU N N 43 121.050 121.050 121.408 -0.358 26060 6776 1 10 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.918 -0.128 26060 6777 1 10 . 1 1 43 43 GLU C C 43 176.110 176.110 176.004 0.106 26060 6778 1 10 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.395 -0.545 26060 6779 1 10 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.304 -0.454 26060 6780 1 10 . 1 1 43 43 GLU H H 43 9.060 9.060 8.692 0.368 26060 6781 1 10 . 1 1 44 44 HIS N N 44 114.100 114.100 115.337 -1.237 26060 6782 1 10 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.293 0.058 26060 6783 1 10 . 1 1 44 44 HIS C C 44 175.170 175.170 174.858 0.312 26060 6784 1 10 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.993 0.657 26060 6785 1 10 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.607 -0.237 26060 6786 1 10 . 1 1 44 44 HIS H H 44 8.420 8.420 8.644 -0.224 26060 6787 1 10 . 1 1 45 45 SER N N 45 115.540 115.540 117.585 -2.045 26060 6788 1 10 . 1 1 45 45 SER HA H 45 4.560 4.560 4.686 -0.126 26060 6789 1 10 . 1 1 45 45 SER C C 45 173.700 173.700 173.758 -0.058 26060 6790 1 10 . 1 1 45 45 SER CA C 45 58.710 58.710 57.339 1.371 26060 6791 1 10 . 1 1 45 45 SER CB C 45 65.040 65.040 63.586 1.454 26060 6792 1 10 . 1 1 45 45 SER H H 45 7.870 7.870 7.977 -0.107 26060 6793 1 10 . 1 1 46 46 ASN N N 46 123.900 123.900 124.730 -0.830 26060 6794 1 10 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.910 0.210 26060 6795 1 10 . 1 1 46 46 ASN C C 46 176.300 176.300 175.654 0.646 26060 6796 1 10 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.971 -0.282 26060 6797 1 10 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.318 -1.588 26060 6798 1 10 . 1 1 46 46 ASN H H 46 9.480 9.480 8.702 0.778 26060 6799 1 10 . 1 1 47 47 ILE N N 47 115.240 115.240 121.710 -6.470 26060 6800 1 10 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.311 0.629 26060 6801 1 10 . 1 1 47 47 ILE C C 47 176.000 176.000 176.855 -0.855 26060 6802 1 10 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.121 0.079 26060 6803 1 10 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.129 -1.429 26060 6804 1 10 . 1 1 47 47 ILE H H 47 8.170 8.170 8.608 -0.438 26060 6805 1 10 . 1 1 48 48 GLN N N 48 123.200 123.200 120.016 3.184 26060 6806 1 10 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.139 0.141 26060 6807 1 10 . 1 1 48 48 GLN C C 48 175.670 175.670 176.386 -0.716 26060 6808 1 10 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.150 -0.250 26060 6809 1 10 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.484 -0.494 26060 6810 1 10 . 1 1 48 48 GLN H H 48 8.850 8.850 8.550 0.300 26060 6811 1 10 . 1 1 49 49 HIS N N 49 115.400 115.400 115.286 0.114 26060 6812 1 10 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.419 0.151 26060 6813 1 10 . 1 1 49 49 HIS C C 49 176.380 176.380 177.027 -0.647 26060 6814 1 10 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.386 0.364 26060 6815 1 10 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.735 0.885 26060 6816 1 10 . 1 1 49 49 HIS H H 49 7.400 7.400 7.650 -0.250 26060 6817 1 10 . 1 1 50 50 PHE N N 50 109.800 109.800 113.624 -3.824 26060 6818 1 10 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.916 0.314 26060 6819 1 10 . 1 1 50 50 PHE C C 50 173.800 173.800 174.294 -0.494 26060 6820 1 10 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.796 -0.136 26060 6821 1 10 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.633 1.367 26060 6822 1 10 . 1 1 50 50 PHE H H 50 7.570 7.570 7.620 -0.050 26060 6823 1 10 . 1 1 51 51 VAL N N 51 127.810 127.810 120.493 7.317 26060 6824 1 10 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.911 -0.541 26060 6825 1 10 . 1 1 51 51 VAL C C 51 174.500 174.500 174.456 0.044 26060 6826 1 10 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.280 1.720 26060 6827 1 10 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.957 -1.677 26060 6828 1 10 . 1 1 51 51 VAL H H 51 7.810 7.810 8.055 -0.244 26060 6829 1 10 . 1 1 52 52 GLU N N 52 130.700 130.700 127.427 3.273 26060 6830 1 10 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.459 -0.479 26060 6831 1 10 . 1 1 52 52 GLU C C 52 175.400 175.400 175.833 -0.433 26060 6832 1 10 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.385 0.715 26060 6833 1 10 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.038 -0.458 26060 6834 1 10 . 1 1 52 52 GLU H H 52 9.380 9.380 8.820 0.560 26060 6835 1 10 . 1 1 53 53 LYS N N 53 109.200 109.200 114.613 -5.413 26060 6836 1 10 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.935 -0.135 26060 6837 1 10 . 1 1 53 53 LYS C C 53 172.300 172.300 174.327 -2.027 26060 6838 1 10 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.770 0.070 26060 6839 1 10 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.919 -1.669 26060 6840 1 10 . 1 1 53 53 LYS H H 53 7.190 7.190 7.386 -0.196 26060 6841 1 10 . 1 1 54 54 VAL N N 54 120.380 120.380 117.637 2.743 26060 6842 1 10 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.628 0.142 26060 6843 1 10 . 1 1 54 54 VAL C C 54 173.600 173.600 173.850 -0.250 26060 6844 1 10 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.431 -0.391 26060 6845 1 10 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.647 -1.946 26060 6846 1 10 . 1 1 54 54 VAL H H 54 8.450 8.450 8.284 0.166 26060 6847 1 10 . 1 1 55 55 VAL N N 55 126.920 126.920 122.648 4.272 26060 6848 1 10 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.915 -0.215 26060 6849 1 10 . 1 1 55 55 VAL C C 55 173.800 173.800 173.788 0.012 26060 6850 1 10 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.812 0.058 26060 6851 1 10 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.983 -2.883 26060 6852 1 10 . 1 1 55 55 VAL H H 55 9.260 9.260 8.892 0.368 26060 6853 1 10 . 1 1 56 56 PHE N N 56 126.130 126.130 123.804 2.326 26060 6854 1 10 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.967 -0.277 26060 6855 1 10 . 1 1 56 56 PHE C C 56 174.000 174.000 174.167 -0.167 26060 6856 1 10 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.846 -0.266 26060 6857 1 10 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.160 -1.270 26060 6858 1 10 . 1 1 56 56 PHE H H 56 9.290 9.290 8.827 0.463 26060 6859 1 10 . 1 1 57 57 HIS N N 57 124.180 124.180 124.770 -0.590 26060 6860 1 10 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.907 -0.107 26060 6861 1 10 . 1 1 57 57 HIS C C 57 174.700 174.700 175.065 -0.365 26060 6862 1 10 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.192 0.128 26060 6863 1 10 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.431 1.669 26060 6864 1 10 . 1 1 57 57 HIS H H 57 8.690 8.690 8.544 0.146 26060 6865 1 10 . 1 1 58 58 LEU N N 58 122.050 122.050 122.530 -0.480 26060 6866 1 10 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.394 -0.154 26060 6867 1 10 . 1 1 58 58 LEU C C 58 174.400 174.400 176.934 -2.534 26060 6868 1 10 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.758 0.652 26060 6869 1 10 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.463 -1.303 26060 6870 1 10 . 1 1 58 58 LEU H H 58 9.050 9.050 7.831 1.219 26060 6871 1 10 . 1 1 59 59 HIS N N 59 118.510 118.510 118.591 -0.081 26060 6872 1 10 . 1 1 59 59 HIS C C 59 175.300 175.300 176.705 -1.405 26060 6873 1 10 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.070 3.040 26060 6874 1 10 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.434 0.496 26060 6875 1 10 . 1 1 59 59 HIS H H 59 5.160 5.160 7.671 -2.511 26060 6876 1 10 . 1 1 60 60 GLU N N 60 122.190 122.190 125.621 -3.431 26060 6877 1 10 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.978 -0.018 26060 6878 1 10 . 1 1 60 60 GLU C C 60 175.130 175.130 176.863 -1.733 26060 6879 1 10 . 1 1 60 60 GLU CA C 60 59.010 59.010 58.964 0.046 26060 6880 1 10 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.957 -0.137 26060 6881 1 10 . 1 1 60 60 GLU H H 60 7.960 7.960 8.526 -0.566 26060 6882 1 10 . 1 1 61 61 SER N N 61 116.940 116.940 113.939 3.001 26060 6883 1 10 . 1 1 61 61 SER HA H 61 4.200 4.200 4.315 -0.115 26060 6884 1 10 . 1 1 61 61 SER CA C 61 60.010 60.010 60.086 -0.076 26060 6885 1 10 . 1 1 61 61 SER CB C 61 63.140 63.140 63.527 -0.387 26060 6886 1 10 . 1 1 61 61 SER H H 61 8.540 8.540 7.485 1.055 26060 6887 1 10 . 1 1 62 62 PHE N N 62 123.700 123.700 122.930 0.770 26060 6888 1 10 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.652 -0.102 26060 6889 1 10 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.785 2.155 26060 6890 1 10 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.024 -0.624 26060 6891 1 10 . 1 1 62 62 PHE H H 62 8.640 8.640 8.160 0.480 26060 6892 1 10 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.466 -0.056 26060 6893 1 10 . 1 1 63 63 PRO C C 63 176.400 176.400 176.548 -0.148 26060 6894 1 10 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.227 -0.627 26060 6895 1 10 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.896 -0.036 26060 6896 1 10 . 1 1 64 64 ARG N N 64 116.840 116.840 121.662 -4.822 26060 6897 1 10 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.072 0.028 26060 6898 1 10 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.112 -0.502 26060 6899 1 10 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.741 0.089 26060 6900 1 10 . 1 1 64 64 ARG H H 64 8.890 8.890 8.744 0.146 26060 6901 1 10 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.371 -0.381 26060 6902 1 10 . 1 1 65 65 PRO C C 65 175.800 175.800 177.193 -1.393 26060 6903 1 10 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.951 1.859 26060 6904 1 10 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.918 -0.038 26060 6905 1 10 . 1 1 66 66 LYS N N 66 119.035 119.035 120.381 -1.346 26060 6906 1 10 . 1 1 66 66 LYS HA H 66 4.610 4.610 4.871 -0.261 26060 6907 1 10 . 1 1 66 66 LYS C C 66 175.400 175.400 175.830 -0.430 26060 6908 1 10 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.665 -0.212 26060 6909 1 10 . 1 1 66 66 LYS CB C 66 31.730 31.730 31.866 -0.136 26060 6910 1 10 . 1 1 66 66 LYS H H 66 7.630 7.630 7.863 -0.233 26060 6911 1 10 . 1 1 67 67 ARG N N 67 127.394 127.394 127.852 -0.458 26060 6912 1 10 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.613 0.127 26060 6913 1 10 . 1 1 67 67 ARG C C 67 174.500 174.500 174.925 -0.425 26060 6914 1 10 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.476 0.324 26060 6915 1 10 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.552 -0.838 26060 6916 1 10 . 1 1 67 67 ARG H H 67 8.855 8.855 8.769 0.086 26060 6917 1 10 . 1 1 68 68 VAL N N 68 124.388 124.388 119.938 4.450 26060 6918 1 10 . 1 1 68 68 VAL HA H 68 4.580 4.580 4.887 -0.307 26060 6919 1 10 . 1 1 68 68 VAL C C 68 176.850 176.850 175.414 1.436 26060 6920 1 10 . 1 1 68 68 VAL CA C 68 62.073 62.073 60.141 1.932 26060 6921 1 10 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.391 0.213 26060 6922 1 10 . 1 1 68 68 VAL H H 68 8.681 8.681 8.443 0.238 26060 6923 1 10 . 1 1 69 69 CYS N N 69 127.080 127.080 126.777 0.303 26060 6924 1 10 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.719 0.351 26060 6925 1 10 . 1 1 69 69 CYS CA C 69 58.346 58.346 58.597 -0.251 26060 6926 1 10 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.219 0.551 26060 6927 1 10 . 1 1 69 69 CYS H H 69 9.455 9.455 9.012 0.443 26060 6928 1 10 . 1 1 70 70 LYS N N 70 125.480 125.480 123.417 2.063 26060 6929 1 10 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.548 -0.058 26060 6930 1 10 . 1 1 70 70 LYS C C 70 174.300 174.300 175.463 -1.163 26060 6931 1 10 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.379 1.381 26060 6932 1 10 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.470 -0.300 26060 6933 1 10 . 1 1 70 70 LYS H H 70 9.050 9.050 8.746 0.304 26060 6934 1 10 . 1 1 71 71 ASP N N 71 116.940 116.940 120.289 -3.349 26060 6935 1 10 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.887 0.213 26060 6936 1 10 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.862 -0.782 26060 6937 1 10 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.230 2.150 26060 6938 1 10 . 1 1 71 71 ASP H H 71 7.620 7.620 7.537 0.083 26060 6939 1 10 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.137 -0.877 26060 6940 1 10 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.874 -2.224 26060 6941 1 10 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.170 -1.130 26060 6942 1 10 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.184 -0.084 26060 6943 1 10 . 1 1 73 73 PRO C C 73 174.700 174.700 176.411 -1.711 26060 6944 1 10 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.323 -2.632 26060 6945 1 10 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.203 2.837 26060 6946 1 10 . 1 1 74 74 TYR N N 74 125.400 125.400 125.390 0.010 26060 6947 1 10 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.530 0.320 26060 6948 1 10 . 1 1 74 74 TYR C C 74 172.900 172.900 175.235 -2.335 26060 6949 1 10 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.076 -2.406 26060 6950 1 10 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.683 -3.283 26060 6951 1 10 . 1 1 74 74 TYR H H 74 8.960 8.960 8.355 0.605 26060 6952 1 10 . 1 1 75 75 LYS N N 75 121.400 121.400 119.509 1.891 26060 6953 1 10 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.039 0.551 26060 6954 1 10 . 1 1 75 75 LYS C C 75 173.800 173.800 174.161 -0.361 26060 6955 1 10 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.705 -0.055 26060 6956 1 10 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.417 -0.527 26060 6957 1 10 . 1 1 75 75 LYS H H 75 7.670 7.670 8.069 -0.399 26060 6958 1 10 . 1 1 76 76 VAL N N 76 119.800 119.800 121.311 -1.511 26060 6959 1 10 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.128 -0.238 26060 6960 1 10 . 1 1 76 76 VAL C C 76 173.900 173.900 174.584 -0.684 26060 6961 1 10 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.093 1.637 26060 6962 1 10 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.623 0.917 26060 6963 1 10 . 1 1 76 76 VAL H H 76 8.180 8.180 7.678 0.502 26060 6964 1 10 . 1 1 77 77 GLU N N 77 126.190 126.190 127.845 -1.655 26060 6965 1 10 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.942 0.008 26060 6966 1 10 . 1 1 77 77 GLU C C 77 174.700 174.700 175.136 -0.436 26060 6967 1 10 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.242 -0.302 26060 6968 1 10 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.533 0.017 26060 6969 1 10 . 1 1 77 77 GLU H H 77 8.270 8.270 8.629 -0.359 26060 6970 1 10 . 1 1 78 78 GLU N N 78 126.180 126.180 123.221 2.959 26060 6971 1 10 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.575 -0.125 26060 6972 1 10 . 1 1 78 78 GLU C C 78 175.400 175.400 174.092 1.308 26060 6973 1 10 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.877 0.166 26060 6974 1 10 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.755 3.345 26060 6975 1 10 . 1 1 78 78 GLU H H 78 7.870 7.870 8.457 -0.587 26060 6976 1 10 . 1 1 79 79 SER N N 79 112.109 112.109 113.419 -1.310 26060 6977 1 10 . 1 1 79 79 SER HA H 79 5.560 5.560 5.327 0.233 26060 6978 1 10 . 1 1 79 79 SER C C 79 172.490 172.490 173.127 -0.637 26060 6979 1 10 . 1 1 79 79 SER CA C 79 57.754 57.754 56.733 1.021 26060 6980 1 10 . 1 1 79 79 SER CB C 79 65.861 65.861 65.179 0.682 26060 6981 1 10 . 1 1 79 79 SER H H 79 7.714 7.714 8.265 -0.551 26060 6982 1 10 . 1 1 80 80 GLY N N 80 106.048 106.048 110.950 -4.902 26060 6983 1 10 . 1 1 80 80 GLY C C 80 172.630 172.630 172.102 0.528 26060 6984 1 10 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.141 1.429 26060 6985 1 10 . 1 1 80 80 GLY H H 80 8.828 8.828 8.882 -0.054 26060 6986 1 10 . 1 1 81 81 TYR N N 81 115.280 115.280 117.150 -1.870 26060 6987 1 10 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.327 0.353 26060 6988 1 10 . 1 1 81 81 TYR C C 81 174.100 174.100 173.942 0.158 26060 6989 1 10 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.329 -0.829 26060 6990 1 10 . 1 1 81 81 TYR CB C 81 41.340 41.340 38.685 2.655 26060 6991 1 10 . 1 1 81 81 TYR H H 81 8.770 8.770 8.201 0.569 26060 6992 1 10 . 1 1 82 82 ALA N N 82 122.350 122.350 122.696 -0.346 26060 6993 1 10 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.549 -0.149 26060 6994 1 10 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.850 0.190 26060 6995 1 10 . 1 1 82 82 ALA CB C 82 22.400 22.400 20.974 1.427 26060 6996 1 10 . 1 1 82 82 ALA H H 82 7.160 7.160 7.430 -0.270 26060 6997 1 10 . 1 1 83 83 GLY N N 83 107.100 107.100 106.672 0.428 26060 6998 1 10 . 1 1 83 83 GLY C C 83 172.500 172.500 173.577 -1.077 26060 6999 1 10 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.039 0.570 26060 7000 1 10 . 1 1 83 83 GLY H H 83 8.220 8.220 8.226 -0.006 26060 7001 1 10 . 1 1 84 84 PHE N N 84 111.660 111.660 114.969 -3.309 26060 7002 1 10 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.545 0.145 26060 7003 1 10 . 1 1 84 84 PHE C C 84 172.460 172.460 173.078 -0.618 26060 7004 1 10 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.420 0.080 26060 7005 1 10 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.514 -0.934 26060 7006 1 10 . 1 1 84 84 PHE H H 84 7.700 7.700 7.989 -0.289 26060 7007 1 10 . 1 1 85 85 ILE N N 85 117.810 117.810 121.206 -3.396 26060 7008 1 10 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.127 0.183 26060 7009 1 10 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.023 -1.683 26060 7010 1 10 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.130 -1.870 26060 7011 1 10 . 1 1 85 85 ILE H H 85 8.340 8.340 8.320 0.020 26060 7012 1 10 . 1 1 86 86 LEU N N 86 108.130 108.130 128.924 -20.794 26060 7013 1 10 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.087 -0.107 26060 7014 1 10 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.098 2.102 26060 7015 1 10 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.452 -0.152 26060 7016 1 10 . 1 1 86 86 LEU H H 86 9.900 9.900 8.808 1.092 26060 7017 1 10 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.577 0.523 26060 7018 1 10 . 1 1 87 87 PRO C C 87 175.340 175.340 176.173 -0.833 26060 7019 1 10 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.739 0.371 26060 7020 1 10 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.442 1.118 26060 7021 1 10 . 1 1 88 88 ILE N N 88 126.000 126.000 126.158 -0.158 26060 7022 1 10 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.338 0.452 26060 7023 1 10 . 1 1 88 88 ILE C C 88 176.100 176.100 175.173 0.927 26060 7024 1 10 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.538 0.023 26060 7025 1 10 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.119 1.881 26060 7026 1 10 . 1 1 88 88 ILE H H 88 9.380 9.380 8.928 0.452 26060 7027 1 10 . 1 1 89 89 GLU N N 89 123.900 123.900 124.473 -0.573 26060 7028 1 10 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.203 -0.003 26060 7029 1 10 . 1 1 89 89 GLU C C 89 173.800 173.800 175.549 -1.749 26060 7030 1 10 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.533 -0.563 26060 7031 1 10 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.365 1.015 26060 7032 1 10 . 1 1 89 89 GLU H H 89 9.320 9.320 8.942 0.378 26060 7033 1 10 . 1 1 90 90 VAL N N 90 123.980 123.980 123.480 0.500 26060 7034 1 10 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.178 -0.018 26060 7035 1 10 . 1 1 90 90 VAL C C 90 174.800 174.800 174.631 0.169 26060 7036 1 10 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.228 0.762 26060 7037 1 10 . 1 1 90 90 VAL CB C 90 32.490 32.490 32.033 0.457 26060 7038 1 10 . 1 1 90 90 VAL H H 90 8.630 8.630 8.502 0.128 26060 7039 1 10 . 1 1 91 91 TYR N N 91 124.230 124.230 127.529 -3.299 26060 7040 1 10 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.388 0.272 26060 7041 1 10 . 1 1 91 91 TYR C C 91 176.800 176.800 175.554 1.246 26060 7042 1 10 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.216 -1.516 26060 7043 1 10 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.612 1.628 26060 7044 1 10 . 1 1 91 91 TYR H H 91 8.640 8.640 8.957 -0.317 26060 7045 1 10 . 1 1 92 92 PHE N N 92 121.200 121.200 122.739 -1.539 26060 7046 1 10 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.267 0.393 26060 7047 1 10 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.953 1.557 26060 7048 1 10 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.798 0.902 26060 7049 1 10 . 1 1 92 92 PHE H H 92 8.750 8.750 9.077 -0.327 26060 7050 1 10 . 1 1 93 93 LYS N N 93 123.450 123.450 122.997 0.453 26060 7051 1 10 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.510 0.090 26060 7052 1 10 . 1 1 93 93 LYS C C 93 174.200 174.200 174.832 -0.632 26060 7053 1 10 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.005 -0.826 26060 7054 1 10 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.103 -0.423 26060 7055 1 10 . 1 1 93 93 LYS H H 93 8.560 8.560 8.929 -0.369 26060 7056 1 10 . 1 1 94 94 ASN N N 94 118.800 118.800 121.217 -2.417 26060 7057 1 10 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.703 -0.263 26060 7058 1 10 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.138 -0.928 26060 7059 1 10 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.874 -1.074 26060 7060 1 10 . 1 1 94 94 ASN H H 94 7.820 7.820 8.211 -0.391 26060 7061 1 10 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.484 -0.154 26060 7062 1 10 . 1 1 95 95 LYS C C 95 175.800 175.800 175.564 0.236 26060 7063 1 10 . 1 1 95 95 LYS CA C 95 56.210 56.210 57.089 -0.879 26060 7064 1 10 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.287 -0.277 26060 7065 1 10 . 1 1 96 96 GLU N N 96 118.330 118.330 120.039 -1.709 26060 7066 1 10 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.383 0.127 26060 7067 1 10 . 1 1 96 96 GLU C C 96 173.200 173.200 175.606 -2.406 26060 7068 1 10 . 1 1 96 96 GLU CA C 96 54.100 54.100 54.944 -0.844 26060 7069 1 10 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.382 2.088 26060 7070 1 10 . 1 1 96 96 GLU H H 96 7.120 7.120 7.495 -0.375 26060 7071 1 10 . 1 1 97 97 GLU N N 97 115.630 115.630 119.215 -3.585 26060 7072 1 10 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.131 0.299 26060 7073 1 10 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.755 -0.895 26060 7074 1 10 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.816 0.454 26060 7075 1 10 . 1 1 97 97 GLU H H 97 8.060 8.060 8.263 -0.203 26060 7076 1 10 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.223 0.777 26060 7077 1 10 . 1 1 98 98 PRO C C 98 175.900 175.900 176.254 -0.354 26060 7078 1 10 . 1 1 98 98 PRO CA C 98 62.160 62.160 63.980 -1.820 26060 7079 1 10 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.145 1.855 26060 7080 1 10 . 1 1 99 99 ARG N N 99 122.800 122.800 119.389 3.411 26060 7081 1 10 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.368 0.262 26060 7082 1 10 . 1 1 99 99 ARG C C 99 175.800 175.800 175.530 0.270 26060 7083 1 10 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.274 0.216 26060 7084 1 10 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.567 -0.157 26060 7085 1 10 . 1 1 99 99 ARG H H 99 8.602 8.602 8.653 -0.051 26060 7086 1 10 . 1 1 100 100 LYS N N 100 113.220 113.220 117.104 -3.884 26060 7087 1 10 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.367 0.573 26060 7088 1 10 . 1 1 100 100 LYS C C 100 174.100 174.100 174.392 -0.292 26060 7089 1 10 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.278 -0.368 26060 7090 1 10 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.707 -0.987 26060 7091 1 10 . 1 1 100 100 LYS H H 100 7.650 7.650 7.388 0.262 26060 7092 1 10 . 1 1 101 101 VAL N N 101 116.230 116.230 121.499 -5.269 26060 7093 1 10 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.116 0.154 26060 7094 1 10 . 1 1 101 101 VAL C C 101 171.600 171.600 173.752 -2.152 26060 7095 1 10 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.284 0.976 26060 7096 1 10 . 1 1 101 101 VAL CB C 101 35.180 35.180 34.964 0.216 26060 7097 1 10 . 1 1 101 101 VAL H H 101 8.120 8.120 7.677 0.443 26060 7098 1 10 . 1 1 102 102 ARG N N 102 124.980 124.980 127.938 -2.958 26060 7099 1 10 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.813 0.347 26060 7100 1 10 . 1 1 102 102 ARG C C 102 174.340 174.340 175.137 -0.797 26060 7101 1 10 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.536 -0.786 26060 7102 1 10 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.488 1.862 26060 7103 1 10 . 1 1 102 102 ARG H H 102 7.930 7.930 8.265 -0.335 26060 7104 1 10 . 1 1 103 103 PHE N N 103 124.590 124.590 126.637 -2.047 26060 7105 1 10 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.687 0.105 26060 7106 1 10 . 1 1 103 103 PHE C C 103 174.280 174.280 174.914 -0.634 26060 7107 1 10 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.936 1.044 26060 7108 1 10 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.998 2.252 26060 7109 1 10 . 1 1 103 103 PHE H H 103 9.390 9.390 9.086 0.304 26060 7110 1 10 . 1 1 104 104 ASP N N 104 124.700 124.700 126.761 -2.061 26060 7111 1 10 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.768 0.031 26060 7112 1 10 . 1 1 104 104 ASP C C 104 174.500 174.500 175.286 -0.786 26060 7113 1 10 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.136 0.254 26060 7114 1 10 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.632 0.598 26060 7115 1 10 . 1 1 104 104 ASP H H 104 9.010 9.010 9.021 -0.011 26060 7116 1 10 . 1 1 105 105 TYR N N 105 129.840 129.840 123.953 5.887 26060 7117 1 10 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.477 -0.377 26060 7118 1 10 . 1 1 105 105 TYR C C 105 173.100 173.100 173.538 -0.438 26060 7119 1 10 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.842 0.838 26060 7120 1 10 . 1 1 105 105 TYR CB C 105 41.850 41.850 41.045 0.805 26060 7121 1 10 . 1 1 105 105 TYR H H 105 8.140 8.140 8.181 -0.041 26060 7122 1 10 . 1 1 106 106 ASP N N 106 126.800 126.800 127.066 -0.266 26060 7123 1 10 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.384 -0.164 26060 7124 1 10 . 1 1 106 106 ASP C C 106 172.900 172.900 174.543 -1.643 26060 7125 1 10 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.402 0.108 26060 7126 1 10 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.193 -1.692 26060 7127 1 10 . 1 1 106 106 ASP H H 106 7.730 7.730 8.071 -0.341 26060 7128 1 10 . 1 1 107 107 LEU N N 107 132.150 132.150 128.772 3.378 26060 7129 1 10 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.590 -0.750 26060 7130 1 10 . 1 1 107 107 LEU C C 107 172.100 172.100 174.844 -2.744 26060 7131 1 10 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.785 -0.085 26060 7132 1 10 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.427 -2.187 26060 7133 1 10 . 1 1 107 107 LEU H H 107 7.770 7.770 7.686 0.084 26060 7134 1 10 . 1 1 108 108 PHE N N 108 118.960 118.960 121.846 -2.886 26060 7135 1 10 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.877 -0.187 26060 7136 1 10 . 1 1 108 108 PHE C C 108 174.300 174.300 173.499 0.801 26060 7137 1 10 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.245 -0.555 26060 7138 1 10 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.050 -0.760 26060 7139 1 10 . 1 1 108 108 PHE H H 108 6.060 6.060 7.203 -1.143 26060 7140 1 10 . 1 1 109 109 LEU N N 109 118.900 118.900 122.694 -3.794 26060 7141 1 10 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.649 -0.249 26060 7142 1 10 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.228 -1.068 26060 7143 1 10 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.836 -1.756 26060 7144 1 10 . 1 1 109 109 LEU H H 109 8.388 8.388 8.329 0.059 26060 7145 1 10 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.496 -0.056 26060 7146 1 10 . 1 1 111 111 LEU C C 111 177.300 177.300 177.155 0.145 26060 7147 1 10 . 1 1 111 111 LEU CA C 111 54.220 54.220 54.905 -0.685 26060 7148 1 10 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.893 0.977 26060 7149 1 10 . 1 1 112 112 GLU N N 112 120.660 120.660 123.091 -2.431 26060 7150 1 10 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.113 0.057 26060 7151 1 10 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.525 -0.065 26060 7152 1 10 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.991 -0.301 26060 7153 1 10 . 1 1 112 112 GLU H H 112 8.780 8.780 8.822 -0.042 26060 7154 1 10 . 1 1 113 113 GLY C C 113 173.900 173.900 173.469 0.431 26060 7155 1 10 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.063 -0.113 26060 7156 1 10 . 1 1 114 114 HIS N N 114 120.890 120.890 121.379 -0.489 26060 7157 1 10 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.094 -0.188 26060 7158 1 10 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.114 0.656 26060 7159 1 10 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.412 -0.822 26060 7160 1 10 . 1 1 114 114 HIS H H 114 7.934 7.934 7.784 0.150 26060 7161 1 10 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.000 -0.200 26060 7162 1 10 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.016 1.074 26060 7163 1 10 . 1 1 115 115 PRO CB C 115 30.680 30.680 32.056 -1.375 26060 7164 1 10 . 1 1 116 116 PRO C C 116 176.600 176.600 175.632 0.968 26060 7165 1 10 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.303 -0.004 26060 7166 1 10 . 1 1 117 117 VAL N N 117 127.480 127.480 127.314 0.166 26060 7167 1 10 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.312 -0.522 26060 7168 1 10 . 1 1 117 117 VAL CA C 117 62.700 62.700 62.005 0.695 26060 7169 1 10 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.556 -0.356 26060 7170 1 10 . 1 1 117 117 VAL H H 117 8.890 8.890 7.937 0.953 26060 7171 1 10 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.869 0.121 26060 7172 1 10 . 1 1 118 118 ASN C C 118 172.700 172.700 173.608 -0.908 26060 7173 1 10 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.392 -0.032 26060 7174 1 10 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.974 -0.774 26060 7175 1 10 . 1 1 119 119 HIS N N 119 124.930 124.930 125.971 -1.041 26060 7176 1 10 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.061 -0.241 26060 7177 1 10 . 1 1 119 119 HIS C C 119 173.500 173.500 172.790 0.710 26060 7178 1 10 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.105 1.865 26060 7179 1 10 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.012 0.658 26060 7180 1 10 . 1 1 119 119 HIS H H 119 8.790 8.790 8.916 -0.126 26060 7181 1 10 . 1 1 120 120 LEU N N 120 128.280 128.280 123.950 4.330 26060 7182 1 10 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.084 -0.134 26060 7183 1 10 . 1 1 120 120 LEU C C 120 174.030 174.030 174.663 -0.633 26060 7184 1 10 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.617 0.823 26060 7185 1 10 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.375 0.225 26060 7186 1 10 . 1 1 120 120 LEU H H 120 7.460 7.460 8.128 -0.668 26060 7187 1 10 . 1 1 121 121 ARG N N 121 128.060 128.060 121.832 6.228 26060 7188 1 10 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.541 0.099 26060 7189 1 10 . 1 1 121 121 ARG C C 121 173.400 173.400 173.194 0.206 26060 7190 1 10 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.187 0.173 26060 7191 1 10 . 1 1 121 121 ARG CB C 121 34.260 34.260 33.910 0.349 26060 7192 1 10 . 1 1 121 121 ARG H H 121 9.860 9.860 9.095 0.765 26060 7193 1 10 . 1 1 122 122 CYS N N 122 125.290 125.290 122.541 2.749 26060 7194 1 10 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.377 -0.357 26060 7195 1 10 . 1 1 122 122 CYS C C 122 174.600 174.600 175.432 -0.832 26060 7196 1 10 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.318 1.972 26060 7197 1 10 . 1 1 122 122 CYS CB C 122 28.030 28.030 28.387 -0.357 26060 7198 1 10 . 1 1 122 122 CYS H H 122 8.835 8.835 8.573 0.262 26060 7199 1 10 . 1 1 123 123 GLU N N 123 125.920 125.920 124.490 1.430 26060 7200 1 10 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.489 0.191 26060 7201 1 10 . 1 1 123 123 GLU C C 123 174.500 174.500 174.760 -0.260 26060 7202 1 10 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.975 -0.555 26060 7203 1 10 . 1 1 123 123 GLU CB C 123 32.583 32.583 30.998 1.585 26060 7204 1 10 . 1 1 123 123 GLU H H 123 8.970 8.970 8.772 0.198 26060 7205 1 10 . 1 1 124 124 LYS N N 124 121.837 121.837 121.351 0.486 26060 7206 1 10 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.905 0.055 26060 7207 1 10 . 1 1 124 124 LYS C C 124 175.700 175.700 175.573 0.127 26060 7208 1 10 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.073 0.284 26060 7209 1 10 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.725 -0.536 26060 7210 1 10 . 1 1 124 124 LYS H H 124 8.652 8.652 8.259 0.393 26060 7211 1 10 . 1 1 125 125 LEU N N 125 127.000 127.000 129.070 -2.070 26060 7212 1 10 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.634 0.016 26060 7213 1 10 . 1 1 125 125 LEU C C 125 175.110 175.110 175.424 -0.314 26060 7214 1 10 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.926 -0.072 26060 7215 1 10 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.898 0.369 26060 7216 1 10 . 1 1 125 125 LEU H H 125 9.175 9.175 9.118 0.057 26060 7217 1 10 . 1 1 126 126 THR N N 126 117.779 117.779 119.687 -1.908 26060 7218 1 10 . 1 1 126 126 THR HA H 126 4.650 4.650 4.610 0.040 26060 7219 1 10 . 1 1 126 126 THR C C 126 173.200 173.200 173.498 -0.298 26060 7220 1 10 . 1 1 126 126 THR CA C 126 62.036 62.036 61.428 0.608 26060 7221 1 10 . 1 1 126 126 THR CB C 126 70.284 70.284 69.303 0.981 26060 7222 1 10 . 1 1 126 126 THR H H 126 8.331 8.331 8.417 -0.086 26060 7223 1 10 . 1 1 127 127 PHE N N 127 126.576 126.576 127.135 -0.559 26060 7224 1 10 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.696 -0.106 26060 7225 1 10 . 1 1 127 127 PHE C C 127 174.860 174.860 174.638 0.222 26060 7226 1 10 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.777 0.087 26060 7227 1 10 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.773 -0.773 26060 7228 1 10 . 1 1 127 127 PHE H H 127 9.051 9.051 8.683 0.368 26060 7229 1 10 . 1 1 128 128 ASN N N 128 123.040 123.040 124.197 -1.157 26060 7230 1 10 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.752 -0.132 26060 7231 1 10 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.956 0.524 26060 7232 1 10 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.827 0.633 26060 7233 1 10 . 1 1 128 128 ASN H H 128 8.880 8.880 8.797 0.083 26060 7234 1 10 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.540 0.220 26060 7235 1 10 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.614 -0.714 26060 7236 1 10 . 1 1 129 129 ASN CB C 129 38.730 38.730 36.910 1.820 26060 7237 1 10 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.754 0.036 26060 7238 1 10 . 1 1 130 130 PRO C C 130 177.470 177.470 175.310 2.160 26060 7239 1 10 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.330 0.244 26060 7240 1 10 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.919 -1.609 26060 7241 1 10 . 1 1 131 131 THR N N 131 113.400 113.400 114.130 -0.730 26060 7242 1 10 . 1 1 131 131 THR HA H 131 4.300 4.300 4.290 0.010 26060 7243 1 10 . 1 1 131 131 THR C C 131 175.200 175.200 176.287 -1.087 26060 7244 1 10 . 1 1 131 131 THR CA C 131 62.200 62.200 61.758 0.442 26060 7245 1 10 . 1 1 131 131 THR CB C 131 70.600 70.600 71.209 -0.609 26060 7246 1 10 . 1 1 131 131 THR H H 131 8.950 8.950 9.213 -0.263 26060 7247 1 10 . 1 1 132 132 GLU N N 132 122.199 122.199 125.973 -3.774 26060 7248 1 10 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.033 -0.023 26060 7249 1 10 . 1 1 132 132 GLU C C 132 178.700 178.700 178.302 0.398 26060 7250 1 10 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.324 -0.030 26060 7251 1 10 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.664 -0.503 26060 7252 1 10 . 1 1 132 132 GLU H H 132 8.932 8.932 9.048 -0.116 26060 7253 1 10 . 1 1 133 133 ASP N N 133 116.324 116.324 119.791 -3.467 26060 7254 1 10 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.360 -0.030 26060 7255 1 10 . 1 1 133 133 ASP C C 133 177.800 177.800 178.890 -1.090 26060 7256 1 10 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.764 -0.217 26060 7257 1 10 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.616 1.207 26060 7258 1 10 . 1 1 133 133 ASP H H 133 8.490 8.490 8.092 0.398 26060 7259 1 10 . 1 1 134 134 PHE N N 134 119.914 119.914 121.142 -1.228 26060 7260 1 10 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.287 0.323 26060 7261 1 10 . 1 1 134 134 PHE C C 134 177.300 177.300 177.001 0.299 26060 7262 1 10 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.620 -0.082 26060 7263 1 10 . 1 1 134 134 PHE CB C 134 39.200 39.200 39.027 0.173 26060 7264 1 10 . 1 1 134 134 PHE H H 134 7.787 7.787 7.453 0.334 26060 7265 1 10 . 1 1 135 135 ARG N N 135 119.794 119.794 120.746 -0.952 26060 7266 1 10 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.497 -0.147 26060 7267 1 10 . 1 1 135 135 ARG C C 135 177.370 177.370 178.285 -0.915 26060 7268 1 10 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.102 0.274 26060 7269 1 10 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.974 0.421 26060 7270 1 10 . 1 1 135 135 ARG H H 135 9.087 9.087 8.435 0.652 26060 7271 1 10 . 1 1 136 136 ARG N N 136 114.554 114.554 118.411 -3.857 26060 7272 1 10 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.957 -0.137 26060 7273 1 10 . 1 1 136 136 ARG C C 136 178.950 178.950 178.568 0.382 26060 7274 1 10 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.765 0.035 26060 7275 1 10 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.009 0.208 26060 7276 1 10 . 1 1 136 136 ARG H H 136 7.747 7.747 8.752 -1.005 26060 7277 1 10 . 1 1 137 137 LYS N N 137 118.298 118.298 118.984 -0.686 26060 7278 1 10 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.017 -0.117 26060 7279 1 10 . 1 1 137 137 LYS C C 137 177.980 177.980 179.020 -1.040 26060 7280 1 10 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.395 1.000 26060 7281 1 10 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.302 0.145 26060 7282 1 10 . 1 1 137 137 LYS H H 137 7.154 7.154 7.471 -0.317 26060 7283 1 10 . 1 1 138 138 LEU N N 138 117.159 117.159 118.970 -1.811 26060 7284 1 10 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.747 -0.327 26060 7285 1 10 . 1 1 138 138 LEU C C 138 179.100 179.100 178.477 0.623 26060 7286 1 10 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.246 -0.015 26060 7287 1 10 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.461 0.867 26060 7288 1 10 . 1 1 138 138 LEU H H 138 7.709 7.709 7.912 -0.203 26060 7289 1 10 . 1 1 139 139 LEU N N 139 115.158 115.158 116.246 -1.088 26060 7290 1 10 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.152 -0.002 26060 7291 1 10 . 1 1 139 139 LEU C C 139 177.600 177.600 178.551 -0.951 26060 7292 1 10 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.293 -0.764 26060 7293 1 10 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.930 -0.186 26060 7294 1 10 . 1 1 139 139 LEU H H 139 7.507 7.507 7.957 -0.450 26060 7295 1 10 . 1 1 140 140 LYS N N 140 120.256 120.256 118.690 1.566 26060 7296 1 10 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.073 0.037 26060 7297 1 10 . 1 1 140 140 LYS C C 140 175.800 175.800 177.184 -1.384 26060 7298 1 10 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.322 -0.270 26060 7299 1 10 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.564 0.082 26060 7300 1 10 . 1 1 140 140 LYS H H 140 7.304 7.304 7.538 -0.234 26060 7301 1 11 . 1 1 4 4 MET C C 4 175.800 175.800 175.564 0.236 26060 7302 1 11 . 1 1 4 4 MET CA C 4 55.350 55.350 57.059 -1.708 26060 7303 1 11 . 1 1 4 4 MET CB C 4 32.880 32.880 33.278 -0.398 26060 7304 1 11 . 1 1 5 5 ALA N N 5 125.230 125.230 121.670 3.560 26060 7305 1 11 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.493 -0.143 26060 7306 1 11 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.313 1.117 26060 7307 1 11 . 1 1 5 5 ALA CB C 5 19.370 19.370 20.422 -1.052 26060 7308 1 11 . 1 1 5 5 ALA H H 5 8.320 8.320 7.823 0.497 26060 7309 1 11 . 1 1 6 6 SER HA H 6 4.490 4.490 4.624 -0.134 26060 7310 1 11 . 1 1 6 6 SER CA C 6 58.200 58.200 57.788 0.412 26060 7311 1 11 . 1 1 6 6 SER CB C 6 63.700 63.700 64.654 -0.954 26060 7312 1 11 . 1 1 7 7 SER HA H 7 4.530 4.530 4.635 -0.105 26060 7313 1 11 . 1 1 7 7 SER CA C 7 58.200 58.200 58.369 -0.169 26060 7314 1 11 . 1 1 7 7 SER CB C 7 63.700 63.700 64.003 -0.303 26060 7315 1 11 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.823 -0.213 26060 7316 1 11 . 1 1 8 8 CYS C C 8 173.500 173.500 173.303 0.197 26060 7317 1 11 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.458 1.882 26060 7318 1 11 . 1 1 8 8 CYS CB C 8 28.490 28.490 30.281 -1.791 26060 7319 1 11 . 1 1 9 9 ALA N N 9 124.700 124.700 123.813 0.887 26060 7320 1 11 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.721 0.069 26060 7321 1 11 . 1 1 9 9 ALA C C 9 177.400 177.400 177.208 0.192 26060 7322 1 11 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.874 0.196 26060 7323 1 11 . 1 1 9 9 ALA CB C 9 20.629 20.629 18.964 1.665 26060 7324 1 11 . 1 1 9 9 ALA H H 9 7.960 7.960 8.261 -0.301 26060 7325 1 11 . 1 1 10 10 VAL N N 10 120.124 120.124 125.378 -5.254 26060 7326 1 11 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.208 0.082 26060 7327 1 11 . 1 1 10 10 VAL C C 10 173.900 173.900 175.045 -1.145 26060 7328 1 11 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.761 -0.211 26060 7329 1 11 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.828 2.072 26060 7330 1 11 . 1 1 10 10 VAL H H 10 8.424 8.424 8.599 -0.175 26060 7331 1 11 . 1 1 11 11 GLN N N 11 125.818 125.818 126.481 -0.663 26060 7332 1 11 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.397 0.163 26060 7333 1 11 . 1 1 11 11 GLN C C 11 175.400 175.400 175.160 0.240 26060 7334 1 11 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.568 -0.445 26060 7335 1 11 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.292 1.737 26060 7336 1 11 . 1 1 11 11 GLN H H 11 8.636 8.636 8.567 0.069 26060 7337 1 11 . 1 1 12 12 VAL N N 12 119.106 119.106 120.550 -1.444 26060 7338 1 11 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.370 0.260 26060 7339 1 11 . 1 1 12 12 VAL C C 12 173.800 173.800 175.055 -1.255 26060 7340 1 11 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.846 -0.046 26060 7341 1 11 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.319 2.393 26060 7342 1 11 . 1 1 12 12 VAL H H 12 8.827 8.827 8.774 0.053 26060 7343 1 11 . 1 1 13 13 LYS N N 13 121.700 121.700 125.305 -3.605 26060 7344 1 11 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.241 -0.041 26060 7345 1 11 . 1 1 13 13 LYS C C 13 175.030 175.030 175.898 -0.868 26060 7346 1 11 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.096 0.334 26060 7347 1 11 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.346 1.574 26060 7348 1 11 . 1 1 13 13 LYS H H 13 8.234 8.234 8.527 -0.293 26060 7349 1 11 . 1 1 14 14 LEU N N 14 119.100 119.100 124.746 -5.646 26060 7350 1 11 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.193 -0.243 26060 7351 1 11 . 1 1 14 14 LEU C C 14 175.110 175.110 175.349 -0.239 26060 7352 1 11 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.491 -0.134 26060 7353 1 11 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.644 1.277 26060 7354 1 11 . 1 1 14 14 LEU H H 14 8.840 8.840 8.377 0.463 26060 7355 1 11 . 1 1 15 15 GLU N N 15 120.978 120.978 122.858 -1.880 26060 7356 1 11 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.005 -0.015 26060 7357 1 11 . 1 1 15 15 GLU C C 15 173.800 173.800 174.978 -1.178 26060 7358 1 11 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.751 0.677 26060 7359 1 11 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.618 -0.792 26060 7360 1 11 . 1 1 15 15 GLU H H 15 9.181 9.181 9.325 -0.144 26060 7361 1 11 . 1 1 16 16 LEU N N 16 124.438 124.438 126.768 -2.330 26060 7362 1 11 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.317 -0.207 26060 7363 1 11 . 1 1 16 16 LEU C C 16 174.700 174.700 176.285 -1.585 26060 7364 1 11 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.734 0.342 26060 7365 1 11 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.857 2.035 26060 7366 1 11 . 1 1 16 16 LEU H H 16 8.891 8.891 8.967 -0.076 26060 7367 1 11 . 1 1 17 17 GLY N N 17 108.067 108.067 108.366 -0.299 26060 7368 1 11 . 1 1 17 17 GLY C C 17 170.350 170.350 172.277 -1.927 26060 7369 1 11 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.365 1.619 26060 7370 1 11 . 1 1 17 17 GLY H H 17 7.227 7.227 8.271 -1.044 26060 7371 1 11 . 1 1 18 18 HIS N N 18 111.200 111.200 118.847 -7.647 26060 7372 1 11 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.995 -0.375 26060 7373 1 11 . 1 1 18 18 HIS C C 18 172.400 172.400 172.799 -0.399 26060 7374 1 11 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.440 -0.500 26060 7375 1 11 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.604 1.556 26060 7376 1 11 . 1 1 18 18 HIS H H 18 8.150 8.150 9.247 -1.097 26060 7377 1 11 . 1 1 19 19 ARG N N 19 117.800 117.800 121.664 -3.864 26060 7378 1 11 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.820 0.280 26060 7379 1 11 . 1 1 19 19 ARG C C 19 175.800 175.800 174.083 1.717 26060 7380 1 11 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.235 -0.735 26060 7381 1 11 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.325 -0.675 26060 7382 1 11 . 1 1 19 19 ARG H H 19 9.010 9.010 8.825 0.185 26060 7383 1 11 . 1 1 20 20 ALA N N 20 120.390 120.390 122.446 -2.056 26060 7384 1 11 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.603 -0.073 26060 7385 1 11 . 1 1 20 20 ALA C C 20 175.800 175.800 175.114 0.686 26060 7386 1 11 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.873 1.317 26060 7387 1 11 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.088 0.662 26060 7388 1 11 . 1 1 20 20 ALA H H 20 8.070 8.070 8.547 -0.477 26060 7389 1 11 . 1 1 21 21 GLN N N 21 121.790 121.790 122.322 -0.532 26060 7390 1 11 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.906 0.324 26060 7391 1 11 . 1 1 21 21 GLN CA C 21 54.330 54.330 53.717 0.613 26060 7392 1 11 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.278 -0.377 26060 7393 1 11 . 1 1 21 21 GLN H H 21 9.240 9.240 8.796 0.444 26060 7394 1 11 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.489 -0.859 26060 7395 1 11 . 1 1 22 22 VAL C C 22 176.500 176.500 174.760 1.740 26060 7396 1 11 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.884 3.146 26060 7397 1 11 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.841 -2.241 26060 7398 1 11 . 1 1 23 23 ARG N N 23 127.840 127.840 127.161 0.679 26060 7399 1 11 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.648 -0.518 26060 7400 1 11 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.006 1.594 26060 7401 1 11 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.956 1.194 26060 7402 1 11 . 1 1 23 23 ARG H H 23 8.720 8.720 8.537 0.183 26060 7403 1 11 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.181 -0.141 26060 7404 1 11 . 1 1 24 24 LYS C C 24 176.960 176.960 176.593 0.367 26060 7405 1 11 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.606 1.194 26060 7406 1 11 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.306 -0.246 26060 7407 1 11 . 1 1 25 25 LYS N N 25 115.870 115.870 120.455 -4.585 26060 7408 1 11 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.720 0.110 26060 7409 1 11 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.574 -0.614 26060 7410 1 11 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.630 1.450 26060 7411 1 11 . 1 1 25 25 LYS H H 25 7.720 7.720 7.604 0.116 26060 7412 1 11 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.901 -0.071 26060 7413 1 11 . 1 1 26 26 PRO C C 26 177.400 177.400 177.095 0.305 26060 7414 1 11 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.679 -0.029 26060 7415 1 11 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.450 -0.060 26060 7416 1 11 . 1 1 27 27 THR N N 27 111.270 111.270 114.287 -3.017 26060 7417 1 11 . 1 1 27 27 THR HA H 27 4.530 4.530 4.235 0.295 26060 7418 1 11 . 1 1 27 27 THR C C 27 177.300 177.300 176.858 0.442 26060 7419 1 11 . 1 1 27 27 THR CA C 27 61.300 61.300 60.907 0.393 26060 7420 1 11 . 1 1 27 27 THR CB C 27 71.460 71.460 69.913 1.547 26060 7421 1 11 . 1 1 27 27 THR H H 27 8.380 8.380 8.009 0.371 26060 7422 1 11 . 1 1 28 28 VAL N N 28 121.170 121.170 122.592 -1.422 26060 7423 1 11 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.823 0.060 26060 7424 1 11 . 1 1 28 28 VAL C C 28 177.030 177.030 176.090 0.940 26060 7425 1 11 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.072 0.128 26060 7426 1 11 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.648 -0.248 26060 7427 1 11 . 1 1 28 28 VAL H H 28 8.910 8.910 8.519 0.391 26060 7428 1 11 . 1 1 29 29 GLU N N 29 116.800 116.800 116.831 -0.031 26060 7429 1 11 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.200 -0.280 26060 7430 1 11 . 1 1 29 29 GLU C C 29 176.200 176.200 176.065 0.135 26060 7431 1 11 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.500 1.750 26060 7432 1 11 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.487 -1.317 26060 7433 1 11 . 1 1 29 29 GLU H H 29 7.990 7.990 7.893 0.097 26060 7434 1 11 . 1 1 30 30 GLY N N 30 105.500 105.500 107.818 -2.318 26060 7435 1 11 . 1 1 30 30 GLY C C 30 174.900 174.900 174.072 0.828 26060 7436 1 11 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.212 -0.752 26060 7437 1 11 . 1 1 30 30 GLY H H 30 7.950 7.950 7.789 0.161 26060 7438 1 11 . 1 1 31 31 PHE N N 31 119.300 119.300 119.187 0.113 26060 7439 1 11 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.985 -0.225 26060 7440 1 11 . 1 1 31 31 PHE C C 31 176.400 176.400 175.880 0.520 26060 7441 1 11 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.625 1.275 26060 7442 1 11 . 1 1 31 31 PHE CB C 31 35.500 35.500 38.851 -3.351 26060 7443 1 11 . 1 1 31 31 PHE H H 31 7.520 7.520 7.450 0.070 26060 7444 1 11 . 1 1 32 32 THR N N 32 112.300 112.300 115.961 -3.661 26060 7445 1 11 . 1 1 32 32 THR HA H 32 4.330 4.330 4.452 -0.121 26060 7446 1 11 . 1 1 32 32 THR C C 32 175.200 175.200 174.352 0.848 26060 7447 1 11 . 1 1 32 32 THR CA C 32 62.780 62.780 62.734 0.046 26060 7448 1 11 . 1 1 32 32 THR CB C 32 70.350 70.350 70.116 0.234 26060 7449 1 11 . 1 1 32 32 THR H H 32 7.770 7.770 9.158 -1.388 26060 7450 1 11 . 1 1 33 33 HIS N N 33 121.900 121.900 122.052 -0.152 26060 7451 1 11 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.340 0.160 26060 7452 1 11 . 1 1 33 33 HIS C C 33 173.880 173.880 173.701 0.179 26060 7453 1 11 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.495 0.285 26060 7454 1 11 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.272 3.368 26060 7455 1 11 . 1 1 33 33 HIS H H 33 9.110 9.110 8.776 0.334 26060 7456 1 11 . 1 1 34 34 ASP N N 34 120.300 120.300 124.613 -4.313 26060 7457 1 11 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.359 0.041 26060 7458 1 11 . 1 1 34 34 ASP C C 34 175.100 175.100 175.037 0.063 26060 7459 1 11 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.974 -0.664 26060 7460 1 11 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.431 -0.331 26060 7461 1 11 . 1 1 34 34 ASP H H 34 8.810 8.810 8.700 0.110 26060 7462 1 11 . 1 1 35 35 TRP N N 35 119.800 119.800 120.422 -0.622 26060 7463 1 11 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.646 0.084 26060 7464 1 11 . 1 1 35 35 TRP C C 35 174.900 174.900 173.415 1.485 26060 7465 1 11 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.745 0.155 26060 7466 1 11 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.072 1.998 26060 7467 1 11 . 1 1 35 35 TRP H H 35 9.250 9.250 8.743 0.507 26060 7468 1 11 . 1 1 36 36 MET N N 36 120.980 120.980 122.226 -1.246 26060 7469 1 11 . 1 1 36 36 MET HA H 36 5.750 5.750 5.872 -0.122 26060 7470 1 11 . 1 1 36 36 MET C C 36 173.700 173.700 174.251 -0.551 26060 7471 1 11 . 1 1 36 36 MET CA C 36 54.830 54.830 54.090 0.740 26060 7472 1 11 . 1 1 36 36 MET CB C 36 35.220 35.220 36.626 -1.405 26060 7473 1 11 . 1 1 36 36 MET H H 36 9.080 9.080 8.772 0.308 26060 7474 1 11 . 1 1 37 37 VAL N N 37 126.220 126.220 121.547 4.673 26060 7475 1 11 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.175 0.135 26060 7476 1 11 . 1 1 37 37 VAL C C 37 172.300 172.300 174.474 -2.174 26060 7477 1 11 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.934 -1.394 26060 7478 1 11 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.444 1.627 26060 7479 1 11 . 1 1 37 37 VAL H H 37 9.080 9.080 8.834 0.246 26060 7480 1 11 . 1 1 38 38 PHE N N 38 120.640 120.640 122.474 -1.834 26060 7481 1 11 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.326 0.644 26060 7482 1 11 . 1 1 38 38 PHE C C 38 172.960 172.960 175.289 -2.329 26060 7483 1 11 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.825 -0.695 26060 7484 1 11 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.216 -0.216 26060 7485 1 11 . 1 1 38 38 PHE H H 38 8.320 8.320 8.994 -0.674 26060 7486 1 11 . 1 1 39 39 VAL N N 39 116.500 116.500 120.653 -4.153 26060 7487 1 11 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.582 -0.572 26060 7488 1 11 . 1 1 39 39 VAL C C 39 174.700 174.700 174.515 0.185 26060 7489 1 11 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.443 1.197 26060 7490 1 11 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.884 1.516 26060 7491 1 11 . 1 1 39 39 VAL H H 39 8.580 8.580 9.390 -0.810 26060 7492 1 11 . 1 1 40 40 ARG N N 40 124.100 124.100 125.045 -0.945 26060 7493 1 11 . 1 1 40 40 ARG HA H 40 5.080 5.080 5.034 0.046 26060 7494 1 11 . 1 1 40 40 ARG C C 40 173.800 173.800 174.415 -0.615 26060 7495 1 11 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.598 -0.668 26060 7496 1 11 . 1 1 40 40 ARG CB C 40 33.580 33.580 33.056 0.524 26060 7497 1 11 . 1 1 40 40 ARG H H 40 9.880 9.880 8.663 1.217 26060 7498 1 11 . 1 1 41 41 GLY N N 41 107.640 107.640 106.664 0.976 26060 7499 1 11 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.601 1.369 26060 7500 1 11 . 1 1 41 41 GLY H H 41 8.910 8.910 8.644 0.266 26060 7501 1 11 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.404 0.086 26060 7502 1 11 . 1 1 42 42 PRO C C 42 177.300 177.300 176.883 0.417 26060 7503 1 11 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.440 0.000 26060 7504 1 11 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.477 -0.367 26060 7505 1 11 . 1 1 43 43 GLU N N 43 121.050 121.050 121.306 -0.256 26060 7506 1 11 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.104 -0.314 26060 7507 1 11 . 1 1 43 43 GLU C C 43 176.110 176.110 176.704 -0.594 26060 7508 1 11 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.621 -0.771 26060 7509 1 11 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.692 -0.842 26060 7510 1 11 . 1 1 43 43 GLU H H 43 9.060 9.060 8.818 0.242 26060 7511 1 11 . 1 1 44 44 HIS N N 44 114.100 114.100 117.522 -3.422 26060 7512 1 11 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.279 0.072 26060 7513 1 11 . 1 1 44 44 HIS C C 44 175.170 175.170 174.366 0.804 26060 7514 1 11 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.841 0.809 26060 7515 1 11 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.936 -0.566 26060 7516 1 11 . 1 1 44 44 HIS H H 44 8.420 8.420 8.698 -0.278 26060 7517 1 11 . 1 1 45 45 SER N N 45 115.540 115.540 117.519 -1.979 26060 7518 1 11 . 1 1 45 45 SER HA H 45 4.560 4.560 4.391 0.169 26060 7519 1 11 . 1 1 45 45 SER C C 45 173.700 173.700 173.832 -0.132 26060 7520 1 11 . 1 1 45 45 SER CA C 45 58.710 58.710 57.118 1.592 26060 7521 1 11 . 1 1 45 45 SER CB C 45 65.040 65.040 63.763 1.277 26060 7522 1 11 . 1 1 45 45 SER H H 45 7.870 7.870 7.729 0.141 26060 7523 1 11 . 1 1 46 46 ASN N N 46 123.900 123.900 124.260 -0.360 26060 7524 1 11 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.961 0.159 26060 7525 1 11 . 1 1 46 46 ASN C C 46 176.300 176.300 175.604 0.696 26060 7526 1 11 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.429 0.260 26060 7527 1 11 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.383 -1.653 26060 7528 1 11 . 1 1 46 46 ASN H H 46 9.480 9.480 8.516 0.964 26060 7529 1 11 . 1 1 47 47 ILE N N 47 115.240 115.240 121.126 -5.886 26060 7530 1 11 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.331 0.609 26060 7531 1 11 . 1 1 47 47 ILE C C 47 176.000 176.000 176.636 -0.636 26060 7532 1 11 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.998 0.202 26060 7533 1 11 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.213 -1.513 26060 7534 1 11 . 1 1 47 47 ILE H H 47 8.170 8.170 8.410 -0.240 26060 7535 1 11 . 1 1 48 48 GLN N N 48 123.200 123.200 119.906 3.294 26060 7536 1 11 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.127 0.153 26060 7537 1 11 . 1 1 48 48 GLN C C 48 175.670 175.670 176.716 -1.046 26060 7538 1 11 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.947 -0.047 26060 7539 1 11 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.255 -0.265 26060 7540 1 11 . 1 1 48 48 GLN H H 48 8.850 8.850 8.571 0.279 26060 7541 1 11 . 1 1 49 49 HIS N N 49 115.400 115.400 116.267 -0.867 26060 7542 1 11 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.405 0.165 26060 7543 1 11 . 1 1 49 49 HIS C C 49 176.380 176.380 176.861 -0.481 26060 7544 1 11 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.352 0.398 26060 7545 1 11 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.577 1.043 26060 7546 1 11 . 1 1 49 49 HIS H H 49 7.400 7.400 7.533 -0.133 26060 7547 1 11 . 1 1 50 50 PHE N N 50 109.800 109.800 112.970 -3.170 26060 7548 1 11 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.963 0.267 26060 7549 1 11 . 1 1 50 50 PHE C C 50 173.800 173.800 174.108 -0.308 26060 7550 1 11 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.613 0.047 26060 7551 1 11 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.822 1.178 26060 7552 1 11 . 1 1 50 50 PHE H H 50 7.570 7.570 7.579 -0.009 26060 7553 1 11 . 1 1 51 51 VAL N N 51 127.810 127.810 120.417 7.393 26060 7554 1 11 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.823 -0.453 26060 7555 1 11 . 1 1 51 51 VAL C C 51 174.500 174.500 174.304 0.196 26060 7556 1 11 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.365 1.635 26060 7557 1 11 . 1 1 51 51 VAL CB C 51 33.280 33.280 35.114 -1.834 26060 7558 1 11 . 1 1 51 51 VAL H H 51 7.810 7.810 8.057 -0.247 26060 7559 1 11 . 1 1 52 52 GLU N N 52 130.700 130.700 127.551 3.149 26060 7560 1 11 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.515 -0.535 26060 7561 1 11 . 1 1 52 52 GLU C C 52 175.400 175.400 175.708 -0.308 26060 7562 1 11 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.158 0.942 26060 7563 1 11 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.295 -0.715 26060 7564 1 11 . 1 1 52 52 GLU H H 52 9.380 9.380 8.931 0.449 26060 7565 1 11 . 1 1 53 53 LYS N N 53 109.200 109.200 115.244 -6.044 26060 7566 1 11 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.040 -0.240 26060 7567 1 11 . 1 1 53 53 LYS C C 53 172.300 172.300 174.532 -2.232 26060 7568 1 11 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.658 0.181 26060 7569 1 11 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.069 -1.819 26060 7570 1 11 . 1 1 53 53 LYS H H 53 7.190 7.190 7.426 -0.236 26060 7571 1 11 . 1 1 54 54 VAL N N 54 120.380 120.380 117.462 2.918 26060 7572 1 11 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.685 0.085 26060 7573 1 11 . 1 1 54 54 VAL C C 54 173.600 173.600 173.846 -0.246 26060 7574 1 11 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.500 -0.460 26060 7575 1 11 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.660 -1.960 26060 7576 1 11 . 1 1 54 54 VAL H H 54 8.450 8.450 8.228 0.222 26060 7577 1 11 . 1 1 55 55 VAL N N 55 126.920 126.920 122.413 4.507 26060 7578 1 11 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.864 -0.164 26060 7579 1 11 . 1 1 55 55 VAL C C 55 173.800 173.800 173.712 0.088 26060 7580 1 11 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.831 0.039 26060 7581 1 11 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.987 -2.887 26060 7582 1 11 . 1 1 55 55 VAL H H 55 9.260 9.260 8.980 0.280 26060 7583 1 11 . 1 1 56 56 PHE N N 56 126.130 126.130 123.971 2.159 26060 7584 1 11 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.991 -0.301 26060 7585 1 11 . 1 1 56 56 PHE C C 56 174.000 174.000 174.425 -0.425 26060 7586 1 11 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.739 -0.158 26060 7587 1 11 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.023 -1.133 26060 7588 1 11 . 1 1 56 56 PHE H H 56 9.290 9.290 8.777 0.513 26060 7589 1 11 . 1 1 57 57 HIS N N 57 124.180 124.180 124.778 -0.598 26060 7590 1 11 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.924 -0.124 26060 7591 1 11 . 1 1 57 57 HIS C C 57 174.700 174.700 175.132 -0.432 26060 7592 1 11 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.196 0.124 26060 7593 1 11 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.555 1.545 26060 7594 1 11 . 1 1 57 57 HIS H H 57 8.690 8.690 8.554 0.136 26060 7595 1 11 . 1 1 58 58 LEU N N 58 122.050 122.050 123.129 -1.079 26060 7596 1 11 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.404 -0.164 26060 7597 1 11 . 1 1 58 58 LEU C C 58 174.400 174.400 176.954 -2.554 26060 7598 1 11 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.926 0.484 26060 7599 1 11 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.475 -1.315 26060 7600 1 11 . 1 1 58 58 LEU H H 58 9.050 9.050 8.041 1.009 26060 7601 1 11 . 1 1 59 59 HIS N N 59 118.510 118.510 117.816 0.694 26060 7602 1 11 . 1 1 59 59 HIS C C 59 175.300 175.300 176.778 -1.478 26060 7603 1 11 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.457 3.653 26060 7604 1 11 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.506 -0.576 26060 7605 1 11 . 1 1 59 59 HIS H H 59 5.160 5.160 7.948 -2.788 26060 7606 1 11 . 1 1 60 60 GLU N N 60 122.190 122.190 121.950 0.240 26060 7607 1 11 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.086 -0.126 26060 7608 1 11 . 1 1 60 60 GLU C C 60 175.130 175.130 177.755 -2.625 26060 7609 1 11 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.522 -0.512 26060 7610 1 11 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.257 -0.437 26060 7611 1 11 . 1 1 60 60 GLU H H 60 7.960 7.960 8.740 -0.780 26060 7612 1 11 . 1 1 61 61 SER N N 61 116.940 116.940 113.337 3.603 26060 7613 1 11 . 1 1 61 61 SER HA H 61 4.200 4.200 4.321 -0.121 26060 7614 1 11 . 1 1 61 61 SER CA C 61 60.010 60.010 59.412 0.598 26060 7615 1 11 . 1 1 61 61 SER CB C 61 63.140 63.140 63.322 -0.182 26060 7616 1 11 . 1 1 61 61 SER H H 61 8.540 8.540 8.264 0.276 26060 7617 1 11 . 1 1 62 62 PHE N N 62 123.700 123.700 121.701 1.999 26060 7618 1 11 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.718 -0.168 26060 7619 1 11 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.180 2.760 26060 7620 1 11 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.136 -0.736 26060 7621 1 11 . 1 1 62 62 PHE H H 62 8.640 8.640 8.251 0.389 26060 7622 1 11 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.510 -0.100 26060 7623 1 11 . 1 1 63 63 PRO C C 63 176.400 176.400 176.769 -0.369 26060 7624 1 11 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.023 -0.423 26060 7625 1 11 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.217 -0.357 26060 7626 1 11 . 1 1 64 64 ARG N N 64 116.840 116.840 120.038 -3.198 26060 7627 1 11 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.039 0.061 26060 7628 1 11 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.385 -0.775 26060 7629 1 11 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.840 -0.010 26060 7630 1 11 . 1 1 64 64 ARG H H 64 8.890 8.890 8.918 -0.028 26060 7631 1 11 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.394 -0.404 26060 7632 1 11 . 1 1 65 65 PRO C C 65 175.800 175.800 177.230 -1.430 26060 7633 1 11 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.972 1.838 26060 7634 1 11 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.972 -0.092 26060 7635 1 11 . 1 1 66 66 LYS N N 66 119.035 119.035 120.234 -1.199 26060 7636 1 11 . 1 1 66 66 LYS HA H 66 4.610 4.610 4.919 -0.309 26060 7637 1 11 . 1 1 66 66 LYS C C 66 175.400 175.400 175.835 -0.435 26060 7638 1 11 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.597 -0.145 26060 7639 1 11 . 1 1 66 66 LYS CB C 66 31.730 31.730 31.973 -0.242 26060 7640 1 11 . 1 1 66 66 LYS H H 66 7.630 7.630 7.874 -0.244 26060 7641 1 11 . 1 1 67 67 ARG N N 67 127.394 127.394 128.028 -0.634 26060 7642 1 11 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.623 0.117 26060 7643 1 11 . 1 1 67 67 ARG C C 67 174.500 174.500 175.020 -0.520 26060 7644 1 11 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.507 0.293 26060 7645 1 11 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.437 -0.723 26060 7646 1 11 . 1 1 67 67 ARG H H 67 8.855 8.855 8.803 0.052 26060 7647 1 11 . 1 1 68 68 VAL N N 68 124.388 124.388 120.427 3.961 26060 7648 1 11 . 1 1 68 68 VAL HA H 68 4.580 4.580 4.839 -0.259 26060 7649 1 11 . 1 1 68 68 VAL C C 68 176.850 176.850 175.482 1.368 26060 7650 1 11 . 1 1 68 68 VAL CA C 68 62.073 62.073 60.304 1.769 26060 7651 1 11 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.125 0.479 26060 7652 1 11 . 1 1 68 68 VAL H H 68 8.681 8.681 8.413 0.268 26060 7653 1 11 . 1 1 69 69 CYS N N 69 127.080 127.080 126.040 1.040 26060 7654 1 11 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.773 0.297 26060 7655 1 11 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.771 0.575 26060 7656 1 11 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.119 0.651 26060 7657 1 11 . 1 1 69 69 CYS H H 69 9.455 9.455 8.995 0.460 26060 7658 1 11 . 1 1 70 70 LYS N N 70 125.480 125.480 123.058 2.422 26060 7659 1 11 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.526 -0.036 26060 7660 1 11 . 1 1 70 70 LYS C C 70 174.300 174.300 175.577 -1.277 26060 7661 1 11 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.413 1.347 26060 7662 1 11 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.349 -0.180 26060 7663 1 11 . 1 1 70 70 LYS H H 70 9.050 9.050 8.677 0.373 26060 7664 1 11 . 1 1 71 71 ASP N N 71 116.940 116.940 119.946 -3.006 26060 7665 1 11 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.777 0.323 26060 7666 1 11 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.794 -0.714 26060 7667 1 11 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.416 1.964 26060 7668 1 11 . 1 1 71 71 ASP H H 71 7.620 7.620 7.552 0.068 26060 7669 1 11 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.097 -0.837 26060 7670 1 11 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.909 -2.259 26060 7671 1 11 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.216 -1.176 26060 7672 1 11 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.151 -0.051 26060 7673 1 11 . 1 1 73 73 PRO C C 73 174.700 174.700 176.374 -1.674 26060 7674 1 11 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.297 -2.607 26060 7675 1 11 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.214 2.826 26060 7676 1 11 . 1 1 74 74 TYR N N 74 125.400 125.400 125.307 0.093 26060 7677 1 11 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.526 0.324 26060 7678 1 11 . 1 1 74 74 TYR C C 74 172.900 172.900 175.192 -2.292 26060 7679 1 11 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.189 -2.519 26060 7680 1 11 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.776 -3.376 26060 7681 1 11 . 1 1 74 74 TYR H H 74 8.960 8.960 8.348 0.612 26060 7682 1 11 . 1 1 75 75 LYS N N 75 121.400 121.400 119.853 1.547 26060 7683 1 11 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.046 0.544 26060 7684 1 11 . 1 1 75 75 LYS C C 75 173.800 173.800 174.463 -0.663 26060 7685 1 11 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.749 -0.099 26060 7686 1 11 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.623 -0.734 26060 7687 1 11 . 1 1 75 75 LYS H H 75 7.670 7.670 7.934 -0.264 26060 7688 1 11 . 1 1 76 76 VAL N N 76 119.800 119.800 121.598 -1.798 26060 7689 1 11 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.117 -0.227 26060 7690 1 11 . 1 1 76 76 VAL C C 76 173.900 173.900 174.440 -0.540 26060 7691 1 11 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.363 1.367 26060 7692 1 11 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.946 0.594 26060 7693 1 11 . 1 1 76 76 VAL H H 76 8.180 8.180 7.761 0.419 26060 7694 1 11 . 1 1 77 77 GLU N N 77 126.190 126.190 127.821 -1.631 26060 7695 1 11 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.882 0.068 26060 7696 1 11 . 1 1 77 77 GLU C C 77 174.700 174.700 175.285 -0.585 26060 7697 1 11 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.268 -0.328 26060 7698 1 11 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.328 0.222 26060 7699 1 11 . 1 1 77 77 GLU H H 77 8.270 8.270 8.662 -0.392 26060 7700 1 11 . 1 1 78 78 GLU N N 78 126.180 126.180 123.772 2.408 26060 7701 1 11 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.592 -0.142 26060 7702 1 11 . 1 1 78 78 GLU C C 78 175.400 175.400 174.010 1.390 26060 7703 1 11 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.986 0.056 26060 7704 1 11 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.880 3.220 26060 7705 1 11 . 1 1 78 78 GLU H H 78 7.870 7.870 8.577 -0.707 26060 7706 1 11 . 1 1 79 79 SER N N 79 112.109 112.109 113.193 -1.084 26060 7707 1 11 . 1 1 79 79 SER HA H 79 5.560 5.560 5.198 0.362 26060 7708 1 11 . 1 1 79 79 SER C C 79 172.490 172.490 173.099 -0.609 26060 7709 1 11 . 1 1 79 79 SER CA C 79 57.754 57.754 56.754 1.000 26060 7710 1 11 . 1 1 79 79 SER CB C 79 65.861 65.861 65.209 0.652 26060 7711 1 11 . 1 1 79 79 SER H H 79 7.714 7.714 8.241 -0.527 26060 7712 1 11 . 1 1 80 80 GLY N N 80 106.048 106.048 110.867 -4.819 26060 7713 1 11 . 1 1 80 80 GLY C C 80 172.630 172.630 171.813 0.817 26060 7714 1 11 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.639 0.931 26060 7715 1 11 . 1 1 80 80 GLY H H 80 8.828 8.828 8.912 -0.084 26060 7716 1 11 . 1 1 81 81 TYR N N 81 115.280 115.280 114.433 0.847 26060 7717 1 11 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.317 0.363 26060 7718 1 11 . 1 1 81 81 TYR C C 81 174.100 174.100 174.080 0.020 26060 7719 1 11 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.856 -1.357 26060 7720 1 11 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.362 1.978 26060 7721 1 11 . 1 1 81 81 TYR H H 81 8.770 8.770 8.024 0.746 26060 7722 1 11 . 1 1 82 82 ALA N N 82 122.350 122.350 122.721 -0.371 26060 7723 1 11 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.679 -0.279 26060 7724 1 11 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.749 0.291 26060 7725 1 11 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.055 1.345 26060 7726 1 11 . 1 1 82 82 ALA H H 82 7.160 7.160 7.589 -0.429 26060 7727 1 11 . 1 1 83 83 GLY N N 83 107.100 107.100 106.567 0.533 26060 7728 1 11 . 1 1 83 83 GLY C C 83 172.500 172.500 173.508 -1.008 26060 7729 1 11 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.157 0.453 26060 7730 1 11 . 1 1 83 83 GLY H H 83 8.220 8.220 8.303 -0.083 26060 7731 1 11 . 1 1 84 84 PHE N N 84 111.660 111.660 116.083 -4.423 26060 7732 1 11 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.529 0.161 26060 7733 1 11 . 1 1 84 84 PHE C C 84 172.460 172.460 173.340 -0.880 26060 7734 1 11 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.266 0.234 26060 7735 1 11 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.616 -1.036 26060 7736 1 11 . 1 1 84 84 PHE H H 84 7.700 7.700 7.814 -0.114 26060 7737 1 11 . 1 1 85 85 ILE N N 85 117.810 117.810 121.430 -3.620 26060 7738 1 11 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.075 0.235 26060 7739 1 11 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.242 -1.902 26060 7740 1 11 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.136 -1.876 26060 7741 1 11 . 1 1 85 85 ILE H H 85 8.340 8.340 8.617 -0.277 26060 7742 1 11 . 1 1 86 86 LEU N N 86 108.130 108.130 129.406 -21.276 26060 7743 1 11 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.065 -0.085 26060 7744 1 11 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.001 2.199 26060 7745 1 11 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.790 -0.490 26060 7746 1 11 . 1 1 86 86 LEU H H 86 9.900 9.900 9.076 0.824 26060 7747 1 11 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.559 0.541 26060 7748 1 11 . 1 1 87 87 PRO C C 87 175.340 175.340 176.017 -0.677 26060 7749 1 11 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.784 0.326 26060 7750 1 11 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.490 1.070 26060 7751 1 11 . 1 1 88 88 ILE N N 88 126.000 126.000 126.301 -0.301 26060 7752 1 11 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.275 0.515 26060 7753 1 11 . 1 1 88 88 ILE C C 88 176.100 176.100 175.209 0.891 26060 7754 1 11 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.700 -0.140 26060 7755 1 11 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.745 2.255 26060 7756 1 11 . 1 1 88 88 ILE H H 88 9.380 9.380 8.875 0.505 26060 7757 1 11 . 1 1 89 89 GLU N N 89 123.900 123.900 124.477 -0.577 26060 7758 1 11 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.259 -0.059 26060 7759 1 11 . 1 1 89 89 GLU C C 89 173.800 173.800 175.475 -1.675 26060 7760 1 11 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.500 -0.530 26060 7761 1 11 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.646 0.734 26060 7762 1 11 . 1 1 89 89 GLU H H 89 9.320 9.320 8.767 0.553 26060 7763 1 11 . 1 1 90 90 VAL N N 90 123.980 123.980 123.091 0.889 26060 7764 1 11 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.142 0.018 26060 7765 1 11 . 1 1 90 90 VAL C C 90 174.800 174.800 174.453 0.347 26060 7766 1 11 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.068 0.922 26060 7767 1 11 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.320 -0.830 26060 7768 1 11 . 1 1 90 90 VAL H H 90 8.630 8.630 8.602 0.028 26060 7769 1 11 . 1 1 91 91 TYR N N 91 124.230 124.230 126.257 -2.027 26060 7770 1 11 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.391 0.269 26060 7771 1 11 . 1 1 91 91 TYR C C 91 176.800 176.800 175.508 1.292 26060 7772 1 11 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.544 -0.844 26060 7773 1 11 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.958 1.282 26060 7774 1 11 . 1 1 91 91 TYR H H 91 8.640 8.640 9.134 -0.494 26060 7775 1 11 . 1 1 92 92 PHE N N 92 121.200 121.200 122.302 -1.102 26060 7776 1 11 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.222 0.438 26060 7777 1 11 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.183 1.327 26060 7778 1 11 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.711 0.989 26060 7779 1 11 . 1 1 92 92 PHE H H 92 8.750 8.750 8.739 0.011 26060 7780 1 11 . 1 1 93 93 LYS N N 93 123.450 123.450 122.610 0.840 26060 7781 1 11 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.630 -0.030 26060 7782 1 11 . 1 1 93 93 LYS C C 93 174.200 174.200 175.242 -1.042 26060 7783 1 11 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.770 -0.591 26060 7784 1 11 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.174 -0.494 26060 7785 1 11 . 1 1 93 93 LYS H H 93 8.560 8.560 8.832 -0.272 26060 7786 1 11 . 1 1 94 94 ASN N N 94 118.800 118.800 121.172 -2.372 26060 7787 1 11 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.771 -0.331 26060 7788 1 11 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.242 -1.032 26060 7789 1 11 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.043 -0.243 26060 7790 1 11 . 1 1 94 94 ASN H H 94 7.820 7.820 8.022 -0.202 26060 7791 1 11 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.302 0.028 26060 7792 1 11 . 1 1 95 95 LYS C C 95 175.800 175.800 175.256 0.544 26060 7793 1 11 . 1 1 95 95 LYS CA C 95 56.210 56.210 57.327 -1.117 26060 7794 1 11 . 1 1 95 95 LYS CB C 95 33.010 33.010 32.685 0.325 26060 7795 1 11 . 1 1 96 96 GLU N N 96 118.330 118.330 119.525 -1.195 26060 7796 1 11 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.258 0.252 26060 7797 1 11 . 1 1 96 96 GLU C C 96 173.200 173.200 175.861 -2.661 26060 7798 1 11 . 1 1 96 96 GLU CA C 96 54.100 54.100 54.879 -0.779 26060 7799 1 11 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.467 2.003 26060 7800 1 11 . 1 1 96 96 GLU H H 96 7.120 7.120 7.816 -0.696 26060 7801 1 11 . 1 1 97 97 GLU N N 97 115.630 115.630 119.454 -3.824 26060 7802 1 11 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.227 0.203 26060 7803 1 11 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.086 -1.226 26060 7804 1 11 . 1 1 97 97 GLU CB C 97 29.270 29.270 29.085 0.185 26060 7805 1 11 . 1 1 97 97 GLU H H 97 8.060 8.060 8.453 -0.393 26060 7806 1 11 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.234 0.766 26060 7807 1 11 . 1 1 98 98 PRO C C 98 175.900 175.900 176.050 -0.150 26060 7808 1 11 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.401 -2.241 26060 7809 1 11 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.115 1.885 26060 7810 1 11 . 1 1 99 99 ARG N N 99 122.800 122.800 118.922 3.878 26060 7811 1 11 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.565 0.065 26060 7812 1 11 . 1 1 99 99 ARG C C 99 175.800 175.800 175.518 0.282 26060 7813 1 11 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.422 0.068 26060 7814 1 11 . 1 1 99 99 ARG CB C 99 30.410 30.410 31.123 -0.713 26060 7815 1 11 . 1 1 99 99 ARG H H 99 8.602 8.602 8.533 0.069 26060 7816 1 11 . 1 1 100 100 LYS N N 100 113.220 113.220 116.969 -3.749 26060 7817 1 11 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.604 0.336 26060 7818 1 11 . 1 1 100 100 LYS C C 100 174.100 174.100 174.383 -0.283 26060 7819 1 11 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.336 -0.425 26060 7820 1 11 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.613 -0.893 26060 7821 1 11 . 1 1 100 100 LYS H H 100 7.650 7.650 7.349 0.301 26060 7822 1 11 . 1 1 101 101 VAL N N 101 116.230 116.230 121.625 -5.395 26060 7823 1 11 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.166 0.104 26060 7824 1 11 . 1 1 101 101 VAL C C 101 171.600 171.600 173.554 -1.954 26060 7825 1 11 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.218 1.042 26060 7826 1 11 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.194 -0.014 26060 7827 1 11 . 1 1 101 101 VAL H H 101 8.120 8.120 8.281 -0.161 26060 7828 1 11 . 1 1 102 102 ARG N N 102 124.980 124.980 127.916 -2.936 26060 7829 1 11 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.758 0.402 26060 7830 1 11 . 1 1 102 102 ARG C C 102 174.340 174.340 175.078 -0.738 26060 7831 1 11 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.743 -0.994 26060 7832 1 11 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.487 1.863 26060 7833 1 11 . 1 1 102 102 ARG H H 102 7.930 7.930 8.274 -0.344 26060 7834 1 11 . 1 1 103 103 PHE N N 103 124.590 124.590 127.382 -2.792 26060 7835 1 11 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.802 -0.010 26060 7836 1 11 . 1 1 103 103 PHE C C 103 174.280 174.280 174.975 -0.695 26060 7837 1 11 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.764 1.216 26060 7838 1 11 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.243 2.007 26060 7839 1 11 . 1 1 103 103 PHE H H 103 9.390 9.390 9.125 0.265 26060 7840 1 11 . 1 1 104 104 ASP N N 104 124.700 124.700 126.288 -1.588 26060 7841 1 11 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.625 0.174 26060 7842 1 11 . 1 1 104 104 ASP C C 104 174.500 174.500 174.859 -0.359 26060 7843 1 11 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.666 -0.276 26060 7844 1 11 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.964 0.266 26060 7845 1 11 . 1 1 104 104 ASP H H 104 9.010 9.010 8.927 0.083 26060 7846 1 11 . 1 1 105 105 TYR N N 105 129.840 129.840 125.181 4.659 26060 7847 1 11 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.518 -0.418 26060 7848 1 11 . 1 1 105 105 TYR C C 105 173.100 173.100 173.730 -0.630 26060 7849 1 11 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.594 1.085 26060 7850 1 11 . 1 1 105 105 TYR CB C 105 41.850 41.850 41.355 0.495 26060 7851 1 11 . 1 1 105 105 TYR H H 105 8.140 8.140 8.492 -0.352 26060 7852 1 11 . 1 1 106 106 ASP N N 106 126.800 126.800 127.649 -0.849 26060 7853 1 11 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.381 -0.161 26060 7854 1 11 . 1 1 106 106 ASP C C 106 172.900 172.900 174.668 -1.768 26060 7855 1 11 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.150 0.360 26060 7856 1 11 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.631 -2.131 26060 7857 1 11 . 1 1 106 106 ASP H H 106 7.730 7.730 8.026 -0.296 26060 7858 1 11 . 1 1 107 107 LEU N N 107 132.150 132.150 127.106 5.044 26060 7859 1 11 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.345 -0.505 26060 7860 1 11 . 1 1 107 107 LEU C C 107 172.100 172.100 175.916 -3.816 26060 7861 1 11 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.323 0.377 26060 7862 1 11 . 1 1 107 107 LEU CB C 107 39.240 39.240 39.678 -0.438 26060 7863 1 11 . 1 1 107 107 LEU H H 107 7.770 7.770 7.922 -0.152 26060 7864 1 11 . 1 1 108 108 PHE N N 108 118.960 118.960 121.013 -2.053 26060 7865 1 11 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.752 -0.062 26060 7866 1 11 . 1 1 108 108 PHE C C 108 174.300 174.300 174.025 0.275 26060 7867 1 11 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.857 -1.167 26060 7868 1 11 . 1 1 108 108 PHE CB C 108 40.290 40.290 39.554 0.736 26060 7869 1 11 . 1 1 108 108 PHE H H 108 6.060 6.060 7.224 -1.164 26060 7870 1 11 . 1 1 109 109 LEU N N 109 118.900 118.900 124.806 -5.906 26060 7871 1 11 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.677 -0.277 26060 7872 1 11 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.007 -0.847 26060 7873 1 11 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.544 -1.464 26060 7874 1 11 . 1 1 109 109 LEU H H 109 8.388 8.388 8.350 0.038 26060 7875 1 11 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.461 -0.021 26060 7876 1 11 . 1 1 111 111 LEU C C 111 177.300 177.300 176.765 0.535 26060 7877 1 11 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.297 -1.077 26060 7878 1 11 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.945 0.925 26060 7879 1 11 . 1 1 112 112 GLU N N 112 120.660 120.660 125.386 -4.726 26060 7880 1 11 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.137 0.033 26060 7881 1 11 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.410 0.050 26060 7882 1 11 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.593 0.097 26060 7883 1 11 . 1 1 112 112 GLU H H 112 8.780 8.780 8.837 -0.057 26060 7884 1 11 . 1 1 113 113 GLY C C 113 173.900 173.900 173.202 0.698 26060 7885 1 11 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.049 -0.099 26060 7886 1 11 . 1 1 114 114 HIS N N 114 120.890 120.890 122.252 -1.362 26060 7887 1 11 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.075 -0.169 26060 7888 1 11 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.008 0.762 26060 7889 1 11 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.899 -1.310 26060 7890 1 11 . 1 1 114 114 HIS H H 114 7.934 7.934 7.909 0.025 26060 7891 1 11 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.005 -0.205 26060 7892 1 11 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.975 1.115 26060 7893 1 11 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.852 -1.172 26060 7894 1 11 . 1 1 116 116 PRO C C 116 176.600 176.600 175.741 0.859 26060 7895 1 11 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.196 0.104 26060 7896 1 11 . 1 1 117 117 VAL N N 117 127.480 127.480 125.527 1.953 26060 7897 1 11 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.559 -0.768 26060 7898 1 11 . 1 1 117 117 VAL CA C 117 62.700 62.700 62.086 0.614 26060 7899 1 11 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.599 -0.399 26060 7900 1 11 . 1 1 117 117 VAL H H 117 8.890 8.890 7.952 0.938 26060 7901 1 11 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.963 0.027 26060 7902 1 11 . 1 1 118 118 ASN C C 118 172.700 172.700 173.680 -0.980 26060 7903 1 11 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.521 -0.161 26060 7904 1 11 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.051 -0.851 26060 7905 1 11 . 1 1 119 119 HIS N N 119 124.930 124.930 125.915 -0.985 26060 7906 1 11 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.124 -0.304 26060 7907 1 11 . 1 1 119 119 HIS C C 119 173.500 173.500 172.812 0.688 26060 7908 1 11 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.105 1.865 26060 7909 1 11 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.213 0.457 26060 7910 1 11 . 1 1 119 119 HIS H H 119 8.790 8.790 9.149 -0.359 26060 7911 1 11 . 1 1 120 120 LEU N N 120 128.280 128.280 123.764 4.516 26060 7912 1 11 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.116 -0.166 26060 7913 1 11 . 1 1 120 120 LEU C C 120 174.030 174.030 175.089 -1.059 26060 7914 1 11 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.419 1.021 26060 7915 1 11 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.050 0.550 26060 7916 1 11 . 1 1 120 120 LEU H H 120 7.460 7.460 8.247 -0.787 26060 7917 1 11 . 1 1 121 121 ARG N N 121 128.060 128.060 121.333 6.727 26060 7918 1 11 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.694 -0.054 26060 7919 1 11 . 1 1 121 121 ARG C C 121 173.400 173.400 174.329 -0.929 26060 7920 1 11 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.448 -0.088 26060 7921 1 11 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.203 2.057 26060 7922 1 11 . 1 1 121 121 ARG H H 121 9.860 9.860 9.151 0.709 26060 7923 1 11 . 1 1 122 122 CYS N N 122 125.290 125.290 122.865 2.425 26060 7924 1 11 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.157 -0.137 26060 7925 1 11 . 1 1 122 122 CYS C C 122 174.600 174.600 174.839 -0.239 26060 7926 1 11 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.203 1.087 26060 7927 1 11 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.515 -1.484 26060 7928 1 11 . 1 1 122 122 CYS H H 122 8.835 8.835 8.780 0.055 26060 7929 1 11 . 1 1 123 123 GLU N N 123 125.920 125.920 124.233 1.687 26060 7930 1 11 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.416 0.264 26060 7931 1 11 . 1 1 123 123 GLU C C 123 174.500 174.500 174.855 -0.355 26060 7932 1 11 . 1 1 123 123 GLU CA C 123 54.420 54.420 55.228 -0.808 26060 7933 1 11 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.011 0.572 26060 7934 1 11 . 1 1 123 123 GLU H H 123 8.970 8.970 9.112 -0.142 26060 7935 1 11 . 1 1 124 124 LYS N N 124 121.837 121.837 121.901 -0.064 26060 7936 1 11 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.913 0.047 26060 7937 1 11 . 1 1 124 124 LYS C C 124 175.700 175.700 175.674 0.026 26060 7938 1 11 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.021 0.336 26060 7939 1 11 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.647 -0.458 26060 7940 1 11 . 1 1 124 124 LYS H H 124 8.652 8.652 8.369 0.283 26060 7941 1 11 . 1 1 125 125 LEU N N 125 127.000 127.000 129.575 -2.575 26060 7942 1 11 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.615 0.035 26060 7943 1 11 . 1 1 125 125 LEU C C 125 175.110 175.110 175.416 -0.306 26060 7944 1 11 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.915 -0.061 26060 7945 1 11 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.543 0.724 26060 7946 1 11 . 1 1 125 125 LEU H H 125 9.175 9.175 9.129 0.046 26060 7947 1 11 . 1 1 126 126 THR N N 126 117.779 117.779 120.015 -2.236 26060 7948 1 11 . 1 1 126 126 THR HA H 126 4.650 4.650 4.738 -0.088 26060 7949 1 11 . 1 1 126 126 THR C C 126 173.200 173.200 173.603 -0.403 26060 7950 1 11 . 1 1 126 126 THR CA C 126 62.036 62.036 61.367 0.669 26060 7951 1 11 . 1 1 126 126 THR CB C 126 70.284 70.284 69.242 1.042 26060 7952 1 11 . 1 1 126 126 THR H H 126 8.331 8.331 8.373 -0.042 26060 7953 1 11 . 1 1 127 127 PHE N N 127 126.576 126.576 126.401 0.175 26060 7954 1 11 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.643 -0.053 26060 7955 1 11 . 1 1 127 127 PHE C C 127 174.860 174.860 174.708 0.152 26060 7956 1 11 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.532 0.332 26060 7957 1 11 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.168 -1.168 26060 7958 1 11 . 1 1 127 127 PHE H H 127 9.051 9.051 9.029 0.022 26060 7959 1 11 . 1 1 128 128 ASN N N 128 123.040 123.040 124.483 -1.443 26060 7960 1 11 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.690 -0.070 26060 7961 1 11 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.038 0.442 26060 7962 1 11 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.876 0.584 26060 7963 1 11 . 1 1 128 128 ASN H H 128 8.880 8.880 8.812 0.068 26060 7964 1 11 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.595 0.165 26060 7965 1 11 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.523 -0.623 26060 7966 1 11 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.184 1.546 26060 7967 1 11 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.818 -0.028 26060 7968 1 11 . 1 1 130 130 PRO C C 130 177.470 177.470 176.160 1.310 26060 7969 1 11 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.344 0.230 26060 7970 1 11 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.640 -1.330 26060 7971 1 11 . 1 1 131 131 THR N N 131 113.400 113.400 114.327 -0.927 26060 7972 1 11 . 1 1 131 131 THR HA H 131 4.300 4.300 4.311 -0.011 26060 7973 1 11 . 1 1 131 131 THR C C 131 175.200 175.200 176.068 -0.868 26060 7974 1 11 . 1 1 131 131 THR CA C 131 62.200 62.200 61.778 0.422 26060 7975 1 11 . 1 1 131 131 THR CB C 131 70.600 70.600 70.737 -0.137 26060 7976 1 11 . 1 1 131 131 THR H H 131 8.950 8.950 8.310 0.640 26060 7977 1 11 . 1 1 132 132 GLU N N 132 122.199 122.199 124.247 -2.048 26060 7978 1 11 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.987 0.023 26060 7979 1 11 . 1 1 132 132 GLU C C 132 178.700 178.700 178.221 0.479 26060 7980 1 11 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.588 -0.294 26060 7981 1 11 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.683 -0.522 26060 7982 1 11 . 1 1 132 132 GLU H H 132 8.932 8.932 9.014 -0.082 26060 7983 1 11 . 1 1 133 133 ASP N N 133 116.324 116.324 119.426 -3.102 26060 7984 1 11 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.358 -0.028 26060 7985 1 11 . 1 1 133 133 ASP C C 133 177.800 177.800 179.181 -1.381 26060 7986 1 11 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.252 0.294 26060 7987 1 11 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.421 1.402 26060 7988 1 11 . 1 1 133 133 ASP H H 133 8.490 8.490 8.418 0.072 26060 7989 1 11 . 1 1 134 134 PHE N N 134 119.914 119.914 122.463 -2.549 26060 7990 1 11 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.363 0.247 26060 7991 1 11 . 1 1 134 134 PHE C C 134 177.300 177.300 176.894 0.406 26060 7992 1 11 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.217 0.321 26060 7993 1 11 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.801 0.399 26060 7994 1 11 . 1 1 134 134 PHE H H 134 7.787 7.787 7.556 0.231 26060 7995 1 11 . 1 1 135 135 ARG N N 135 119.794 119.794 120.777 -0.983 26060 7996 1 11 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.543 -0.193 26060 7997 1 11 . 1 1 135 135 ARG C C 135 177.370 177.370 178.336 -0.966 26060 7998 1 11 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.133 0.243 26060 7999 1 11 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.041 0.355 26060 8000 1 11 . 1 1 135 135 ARG H H 135 9.087 9.087 8.688 0.399 26060 8001 1 11 . 1 1 136 136 ARG N N 136 114.554 114.554 118.470 -3.916 26060 8002 1 11 . 1 1 136 136 ARG HA H 136 3.820 3.820 4.011 -0.191 26060 8003 1 11 . 1 1 136 136 ARG C C 136 178.950 178.950 178.479 0.471 26060 8004 1 11 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.362 0.438 26060 8005 1 11 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.028 0.189 26060 8006 1 11 . 1 1 136 136 ARG H H 136 7.747 7.747 8.647 -0.900 26060 8007 1 11 . 1 1 137 137 LYS N N 137 118.298 118.298 119.945 -1.647 26060 8008 1 11 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.041 -0.141 26060 8009 1 11 . 1 1 137 137 LYS C C 137 177.980 177.980 178.951 -0.971 26060 8010 1 11 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.504 0.891 26060 8011 1 11 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.460 -0.013 26060 8012 1 11 . 1 1 137 137 LYS H H 137 7.154 7.154 7.447 -0.293 26060 8013 1 11 . 1 1 138 138 LEU N N 138 117.159 117.159 119.013 -1.854 26060 8014 1 11 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.732 -0.312 26060 8015 1 11 . 1 1 138 138 LEU C C 138 179.100 179.100 178.568 0.532 26060 8016 1 11 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.261 -0.030 26060 8017 1 11 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.438 0.890 26060 8018 1 11 . 1 1 138 138 LEU H H 138 7.709 7.709 7.872 -0.163 26060 8019 1 11 . 1 1 139 139 LEU N N 139 115.158 115.158 116.585 -1.427 26060 8020 1 11 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.089 0.061 26060 8021 1 11 . 1 1 139 139 LEU C C 139 177.600 177.600 178.654 -1.054 26060 8022 1 11 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.516 -0.987 26060 8023 1 11 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.888 -0.144 26060 8024 1 11 . 1 1 139 139 LEU H H 139 7.507 7.507 7.950 -0.443 26060 8025 1 11 . 1 1 140 140 LYS N N 140 120.256 120.256 118.369 1.887 26060 8026 1 11 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.046 0.064 26060 8027 1 11 . 1 1 140 140 LYS C C 140 175.800 175.800 177.100 -1.300 26060 8028 1 11 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.182 -0.130 26060 8029 1 11 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.489 0.157 26060 8030 1 11 . 1 1 140 140 LYS H H 140 7.304 7.304 7.495 -0.191 26060 8031 1 12 . 1 1 4 4 MET C C 4 175.800 175.800 175.805 -0.005 26060 8032 1 12 . 1 1 4 4 MET CA C 4 55.350 55.350 55.680 -0.330 26060 8033 1 12 . 1 1 4 4 MET CB C 4 32.880 32.880 33.001 -0.120 26060 8034 1 12 . 1 1 5 5 ALA N N 5 125.230 125.230 121.665 3.565 26060 8035 1 12 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.185 0.165 26060 8036 1 12 . 1 1 5 5 ALA CA C 5 52.430 52.430 53.720 -1.290 26060 8037 1 12 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.239 0.131 26060 8038 1 12 . 1 1 5 5 ALA H H 5 8.320 8.320 8.246 0.074 26060 8039 1 12 . 1 1 6 6 SER HA H 6 4.490 4.490 4.471 0.019 26060 8040 1 12 . 1 1 6 6 SER CA C 6 58.200 58.200 57.183 1.017 26060 8041 1 12 . 1 1 6 6 SER CB C 6 63.700 63.700 63.222 0.478 26060 8042 1 12 . 1 1 7 7 SER HA H 7 4.530 4.530 4.310 0.220 26060 8043 1 12 . 1 1 7 7 SER CA C 7 58.200 58.200 57.668 0.532 26060 8044 1 12 . 1 1 7 7 SER CB C 7 63.700 63.700 62.978 0.722 26060 8045 1 12 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.664 -0.054 26060 8046 1 12 . 1 1 8 8 CYS C C 8 173.500 173.500 172.460 1.040 26060 8047 1 12 . 1 1 8 8 CYS CA C 8 58.340 58.340 58.236 0.104 26060 8048 1 12 . 1 1 8 8 CYS CB C 8 28.490 28.490 30.415 -1.925 26060 8049 1 12 . 1 1 9 9 ALA N N 9 124.700 124.700 131.811 -7.111 26060 8050 1 12 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.226 -0.436 26060 8051 1 12 . 1 1 9 9 ALA C C 9 177.400 177.400 176.363 1.037 26060 8052 1 12 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.391 1.679 26060 8053 1 12 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.663 -0.034 26060 8054 1 12 . 1 1 9 9 ALA H H 9 7.960 7.960 8.442 -0.482 26060 8055 1 12 . 1 1 10 10 VAL N N 10 120.124 120.124 124.748 -4.624 26060 8056 1 12 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.234 0.056 26060 8057 1 12 . 1 1 10 10 VAL C C 10 173.900 173.900 174.872 -0.972 26060 8058 1 12 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.442 0.108 26060 8059 1 12 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.816 2.084 26060 8060 1 12 . 1 1 10 10 VAL H H 10 8.424 8.424 8.418 0.006 26060 8061 1 12 . 1 1 11 11 GLN N N 11 125.818 125.818 125.751 0.067 26060 8062 1 12 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.432 0.128 26060 8063 1 12 . 1 1 11 11 GLN C C 11 175.400 175.400 174.865 0.535 26060 8064 1 12 . 1 1 11 11 GLN CA C 11 54.123 54.123 53.736 0.387 26060 8065 1 12 . 1 1 11 11 GLN CB C 11 32.029 32.029 31.236 0.792 26060 8066 1 12 . 1 1 11 11 GLN H H 11 8.636 8.636 8.486 0.150 26060 8067 1 12 . 1 1 12 12 VAL N N 12 119.106 119.106 117.920 1.186 26060 8068 1 12 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.356 0.274 26060 8069 1 12 . 1 1 12 12 VAL C C 12 173.800 173.800 174.938 -1.138 26060 8070 1 12 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.575 0.225 26060 8071 1 12 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.295 2.416 26060 8072 1 12 . 1 1 12 12 VAL H H 12 8.827 8.827 8.554 0.273 26060 8073 1 12 . 1 1 13 13 LYS N N 13 121.700 121.700 126.020 -4.320 26060 8074 1 12 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.296 -0.096 26060 8075 1 12 . 1 1 13 13 LYS C C 13 175.030 175.030 175.842 -0.812 26060 8076 1 12 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.165 0.265 26060 8077 1 12 . 1 1 13 13 LYS CB C 13 35.920 35.920 33.807 2.113 26060 8078 1 12 . 1 1 13 13 LYS H H 13 8.234 8.234 8.573 -0.339 26060 8079 1 12 . 1 1 14 14 LEU N N 14 119.100 119.100 125.169 -6.069 26060 8080 1 12 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.272 -0.322 26060 8081 1 12 . 1 1 14 14 LEU C C 14 175.110 175.110 175.611 -0.501 26060 8082 1 12 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.459 -0.102 26060 8083 1 12 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.415 1.506 26060 8084 1 12 . 1 1 14 14 LEU H H 14 8.840 8.840 8.623 0.217 26060 8085 1 12 . 1 1 15 15 GLU N N 15 120.978 120.978 123.669 -2.691 26060 8086 1 12 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.307 -0.317 26060 8087 1 12 . 1 1 15 15 GLU C C 15 173.800 173.800 175.015 -1.215 26060 8088 1 12 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.446 0.982 26060 8089 1 12 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.856 -1.030 26060 8090 1 12 . 1 1 15 15 GLU H H 15 9.181 9.181 9.421 -0.240 26060 8091 1 12 . 1 1 16 16 LEU N N 16 124.438 124.438 126.366 -1.928 26060 8092 1 12 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.354 -0.244 26060 8093 1 12 . 1 1 16 16 LEU C C 16 174.700 174.700 176.333 -1.633 26060 8094 1 12 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.764 0.312 26060 8095 1 12 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.432 2.460 26060 8096 1 12 . 1 1 16 16 LEU H H 16 8.891 8.891 8.746 0.145 26060 8097 1 12 . 1 1 17 17 GLY N N 17 108.067 108.067 108.342 -0.275 26060 8098 1 12 . 1 1 17 17 GLY C C 17 170.350 170.350 172.359 -2.009 26060 8099 1 12 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.377 1.607 26060 8100 1 12 . 1 1 17 17 GLY H H 17 7.227 7.227 8.479 -1.252 26060 8101 1 12 . 1 1 18 18 HIS N N 18 111.200 111.200 118.607 -7.407 26060 8102 1 12 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.725 -0.105 26060 8103 1 12 . 1 1 18 18 HIS C C 18 172.400 172.400 172.606 -0.206 26060 8104 1 12 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.926 -0.986 26060 8105 1 12 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.646 1.514 26060 8106 1 12 . 1 1 18 18 HIS H H 18 8.150 8.150 8.967 -0.817 26060 8107 1 12 . 1 1 19 19 ARG N N 19 117.800 117.800 121.447 -3.647 26060 8108 1 12 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.900 0.200 26060 8109 1 12 . 1 1 19 19 ARG C C 19 175.800 175.800 174.125 1.675 26060 8110 1 12 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.925 -0.425 26060 8111 1 12 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.232 -0.582 26060 8112 1 12 . 1 1 19 19 ARG H H 19 9.010 9.010 8.924 0.086 26060 8113 1 12 . 1 1 20 20 ALA N N 20 120.390 120.390 121.505 -1.115 26060 8114 1 12 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.514 0.016 26060 8115 1 12 . 1 1 20 20 ALA C C 20 175.800 175.800 175.062 0.738 26060 8116 1 12 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.975 1.215 26060 8117 1 12 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.100 0.650 26060 8118 1 12 . 1 1 20 20 ALA H H 20 8.070 8.070 8.397 -0.327 26060 8119 1 12 . 1 1 21 21 GLN N N 21 121.790 121.790 120.932 0.858 26060 8120 1 12 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.050 0.180 26060 8121 1 12 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.570 -0.240 26060 8122 1 12 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.947 -0.047 26060 8123 1 12 . 1 1 21 21 GLN H H 21 9.240 9.240 9.232 0.008 26060 8124 1 12 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.314 -0.684 26060 8125 1 12 . 1 1 22 22 VAL C C 22 176.500 176.500 175.257 1.243 26060 8126 1 12 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.997 3.033 26060 8127 1 12 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.952 -2.352 26060 8128 1 12 . 1 1 23 23 ARG N N 23 127.840 127.840 127.030 0.810 26060 8129 1 12 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.566 -0.436 26060 8130 1 12 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.222 1.378 26060 8131 1 12 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.857 1.293 26060 8132 1 12 . 1 1 23 23 ARG H H 23 8.720 8.720 8.325 0.395 26060 8133 1 12 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.121 -0.081 26060 8134 1 12 . 1 1 24 24 LYS C C 24 176.960 176.960 176.251 0.709 26060 8135 1 12 . 1 1 24 24 LYS CA C 24 58.800 58.800 58.014 0.786 26060 8136 1 12 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.592 -0.532 26060 8137 1 12 . 1 1 25 25 LYS N N 25 115.870 115.870 118.639 -2.769 26060 8138 1 12 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.679 0.151 26060 8139 1 12 . 1 1 25 25 LYS CA C 25 52.960 52.960 52.919 0.041 26060 8140 1 12 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.667 1.413 26060 8141 1 12 . 1 1 25 25 LYS H H 25 7.720 7.720 7.558 0.162 26060 8142 1 12 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.691 0.139 26060 8143 1 12 . 1 1 26 26 PRO C C 26 177.400 177.400 176.832 0.568 26060 8144 1 12 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.635 0.015 26060 8145 1 12 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.569 -0.179 26060 8146 1 12 . 1 1 27 27 THR N N 27 111.270 111.270 114.720 -3.450 26060 8147 1 12 . 1 1 27 27 THR HA H 27 4.530 4.530 4.239 0.291 26060 8148 1 12 . 1 1 27 27 THR C C 27 177.300 177.300 176.930 0.370 26060 8149 1 12 . 1 1 27 27 THR CA C 27 61.300 61.300 61.036 0.264 26060 8150 1 12 . 1 1 27 27 THR CB C 27 71.460 71.460 70.038 1.422 26060 8151 1 12 . 1 1 27 27 THR H H 27 8.380 8.380 8.064 0.316 26060 8152 1 12 . 1 1 28 28 VAL N N 28 121.170 121.170 122.946 -1.776 26060 8153 1 12 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.814 0.069 26060 8154 1 12 . 1 1 28 28 VAL C C 28 177.030 177.030 176.030 1.000 26060 8155 1 12 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.063 0.137 26060 8156 1 12 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.669 -0.269 26060 8157 1 12 . 1 1 28 28 VAL H H 28 8.910 8.910 8.562 0.348 26060 8158 1 12 . 1 1 29 29 GLU N N 29 116.800 116.800 116.718 0.082 26060 8159 1 12 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.124 -0.204 26060 8160 1 12 . 1 1 29 29 GLU C C 29 176.200 176.200 175.850 0.350 26060 8161 1 12 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.398 1.852 26060 8162 1 12 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.414 -1.244 26060 8163 1 12 . 1 1 29 29 GLU H H 29 7.990 7.990 7.844 0.146 26060 8164 1 12 . 1 1 30 30 GLY N N 30 105.500 105.500 107.793 -2.293 26060 8165 1 12 . 1 1 30 30 GLY C C 30 174.900 174.900 173.825 1.075 26060 8166 1 12 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.218 -0.758 26060 8167 1 12 . 1 1 30 30 GLY H H 30 7.950 7.950 7.821 0.129 26060 8168 1 12 . 1 1 31 31 PHE N N 31 119.300 119.300 118.676 0.624 26060 8169 1 12 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.955 -0.195 26060 8170 1 12 . 1 1 31 31 PHE C C 31 176.400 176.400 175.848 0.552 26060 8171 1 12 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.436 1.464 26060 8172 1 12 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.553 -4.053 26060 8173 1 12 . 1 1 31 31 PHE H H 31 7.520 7.520 7.352 0.168 26060 8174 1 12 . 1 1 32 32 THR N N 32 112.300 112.300 115.997 -3.697 26060 8175 1 12 . 1 1 32 32 THR HA H 32 4.330 4.330 4.451 -0.121 26060 8176 1 12 . 1 1 32 32 THR C C 32 175.200 175.200 174.400 0.800 26060 8177 1 12 . 1 1 32 32 THR CA C 32 62.780 62.780 62.727 0.053 26060 8178 1 12 . 1 1 32 32 THR CB C 32 70.350 70.350 70.040 0.310 26060 8179 1 12 . 1 1 32 32 THR H H 32 7.770 7.770 9.148 -1.378 26060 8180 1 12 . 1 1 33 33 HIS N N 33 121.900 121.900 121.444 0.456 26060 8181 1 12 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.039 0.461 26060 8182 1 12 . 1 1 33 33 HIS C C 33 173.880 173.880 173.494 0.386 26060 8183 1 12 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.756 0.024 26060 8184 1 12 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.459 3.181 26060 8185 1 12 . 1 1 33 33 HIS H H 33 9.110 9.110 8.863 0.247 26060 8186 1 12 . 1 1 34 34 ASP N N 34 120.300 120.300 123.308 -3.008 26060 8187 1 12 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.511 -0.111 26060 8188 1 12 . 1 1 34 34 ASP C C 34 175.100 175.100 175.308 -0.208 26060 8189 1 12 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.594 -0.284 26060 8190 1 12 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.530 -0.430 26060 8191 1 12 . 1 1 34 34 ASP H H 34 8.810 8.810 9.118 -0.308 26060 8192 1 12 . 1 1 35 35 TRP N N 35 119.800 119.800 119.411 0.389 26060 8193 1 12 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.465 0.265 26060 8194 1 12 . 1 1 35 35 TRP C C 35 174.900 174.900 173.311 1.589 26060 8195 1 12 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.268 -0.368 26060 8196 1 12 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.109 1.961 26060 8197 1 12 . 1 1 35 35 TRP H H 35 9.250 9.250 8.826 0.424 26060 8198 1 12 . 1 1 36 36 MET N N 36 120.980 120.980 121.326 -0.346 26060 8199 1 12 . 1 1 36 36 MET HA H 36 5.750 5.750 5.991 -0.241 26060 8200 1 12 . 1 1 36 36 MET C C 36 173.700 173.700 174.280 -0.580 26060 8201 1 12 . 1 1 36 36 MET CA C 36 54.830 54.830 54.259 0.571 26060 8202 1 12 . 1 1 36 36 MET CB C 36 35.220 35.220 36.895 -1.675 26060 8203 1 12 . 1 1 36 36 MET H H 36 9.080 9.080 8.905 0.175 26060 8204 1 12 . 1 1 37 37 VAL N N 37 126.220 126.220 120.474 5.746 26060 8205 1 12 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.145 0.165 26060 8206 1 12 . 1 1 37 37 VAL C C 37 172.300 172.300 174.315 -2.015 26060 8207 1 12 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.723 -1.183 26060 8208 1 12 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.831 1.239 26060 8209 1 12 . 1 1 37 37 VAL H H 37 9.080 9.080 8.676 0.404 26060 8210 1 12 . 1 1 38 38 PHE N N 38 120.640 120.640 122.035 -1.395 26060 8211 1 12 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.324 0.646 26060 8212 1 12 . 1 1 38 38 PHE C C 38 172.960 172.960 174.984 -2.024 26060 8213 1 12 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.802 -0.672 26060 8214 1 12 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.545 -0.545 26060 8215 1 12 . 1 1 38 38 PHE H H 38 8.320 8.320 9.022 -0.702 26060 8216 1 12 . 1 1 39 39 VAL N N 39 116.500 116.500 121.075 -4.575 26060 8217 1 12 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.691 -0.681 26060 8218 1 12 . 1 1 39 39 VAL C C 39 174.700 174.700 174.401 0.299 26060 8219 1 12 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.978 1.662 26060 8220 1 12 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.708 1.692 26060 8221 1 12 . 1 1 39 39 VAL H H 39 8.580 8.580 9.349 -0.769 26060 8222 1 12 . 1 1 40 40 ARG N N 40 124.100 124.100 123.916 0.184 26060 8223 1 12 . 1 1 40 40 ARG HA H 40 5.080 5.080 5.021 0.059 26060 8224 1 12 . 1 1 40 40 ARG C C 40 173.800 173.800 174.285 -0.485 26060 8225 1 12 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.721 -0.791 26060 8226 1 12 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.605 0.975 26060 8227 1 12 . 1 1 40 40 ARG H H 40 9.880 9.880 8.654 1.226 26060 8228 1 12 . 1 1 41 41 GLY N N 41 107.640 107.640 106.590 1.050 26060 8229 1 12 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.589 1.381 26060 8230 1 12 . 1 1 41 41 GLY H H 41 8.910 8.910 8.615 0.295 26060 8231 1 12 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.342 0.148 26060 8232 1 12 . 1 1 42 42 PRO C C 42 177.300 177.300 176.731 0.569 26060 8233 1 12 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.681 -0.242 26060 8234 1 12 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.344 -0.234 26060 8235 1 12 . 1 1 43 43 GLU N N 43 121.050 121.050 123.549 -2.499 26060 8236 1 12 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.911 -0.121 26060 8237 1 12 . 1 1 43 43 GLU C C 43 176.110 176.110 176.373 -0.263 26060 8238 1 12 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.541 -0.691 26060 8239 1 12 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.742 -0.892 26060 8240 1 12 . 1 1 43 43 GLU H H 43 9.060 9.060 8.770 0.290 26060 8241 1 12 . 1 1 44 44 HIS N N 44 114.100 114.100 116.382 -2.282 26060 8242 1 12 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.314 0.037 26060 8243 1 12 . 1 1 44 44 HIS C C 44 175.170 175.170 175.131 0.039 26060 8244 1 12 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.270 0.380 26060 8245 1 12 . 1 1 44 44 HIS CB C 44 28.370 28.370 29.286 -0.916 26060 8246 1 12 . 1 1 44 44 HIS H H 44 8.420 8.420 8.615 -0.195 26060 8247 1 12 . 1 1 45 45 SER N N 45 115.540 115.540 117.129 -1.589 26060 8248 1 12 . 1 1 45 45 SER HA H 45 4.560 4.560 4.832 -0.272 26060 8249 1 12 . 1 1 45 45 SER C C 45 173.700 173.700 174.004 -0.304 26060 8250 1 12 . 1 1 45 45 SER CA C 45 58.710 58.710 58.505 0.205 26060 8251 1 12 . 1 1 45 45 SER CB C 45 65.040 65.040 63.547 1.493 26060 8252 1 12 . 1 1 45 45 SER H H 45 7.870 7.870 8.323 -0.453 26060 8253 1 12 . 1 1 46 46 ASN N N 46 123.900 123.900 124.835 -0.935 26060 8254 1 12 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.991 0.129 26060 8255 1 12 . 1 1 46 46 ASN C C 46 176.300 176.300 175.575 0.725 26060 8256 1 12 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.966 -0.276 26060 8257 1 12 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.006 -1.276 26060 8258 1 12 . 1 1 46 46 ASN H H 46 9.480 9.480 8.803 0.677 26060 8259 1 12 . 1 1 47 47 ILE N N 47 115.240 115.240 121.459 -6.219 26060 8260 1 12 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.282 0.658 26060 8261 1 12 . 1 1 47 47 ILE C C 47 176.000 176.000 176.712 -0.712 26060 8262 1 12 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.394 -0.194 26060 8263 1 12 . 1 1 47 47 ILE CB C 47 36.700 36.700 37.802 -1.102 26060 8264 1 12 . 1 1 47 47 ILE H H 47 8.170 8.170 8.657 -0.487 26060 8265 1 12 . 1 1 48 48 GLN N N 48 123.200 123.200 119.736 3.464 26060 8266 1 12 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.136 0.144 26060 8267 1 12 . 1 1 48 48 GLN C C 48 175.670 175.670 176.269 -0.599 26060 8268 1 12 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.023 -0.123 26060 8269 1 12 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.803 -0.813 26060 8270 1 12 . 1 1 48 48 GLN H H 48 8.850 8.850 8.566 0.284 26060 8271 1 12 . 1 1 49 49 HIS N N 49 115.400 115.400 116.018 -0.618 26060 8272 1 12 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.415 0.155 26060 8273 1 12 . 1 1 49 49 HIS C C 49 176.380 176.380 177.127 -0.747 26060 8274 1 12 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.718 0.032 26060 8275 1 12 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.990 0.630 26060 8276 1 12 . 1 1 49 49 HIS H H 49 7.400 7.400 7.493 -0.093 26060 8277 1 12 . 1 1 50 50 PHE N N 50 109.800 109.800 113.431 -3.631 26060 8278 1 12 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.925 0.305 26060 8279 1 12 . 1 1 50 50 PHE C C 50 173.800 173.800 174.285 -0.485 26060 8280 1 12 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.758 -0.098 26060 8281 1 12 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.585 1.415 26060 8282 1 12 . 1 1 50 50 PHE H H 50 7.570 7.570 7.540 0.030 26060 8283 1 12 . 1 1 51 51 VAL N N 51 127.810 127.810 120.593 7.217 26060 8284 1 12 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.874 -0.504 26060 8285 1 12 . 1 1 51 51 VAL C C 51 174.500 174.500 174.533 -0.033 26060 8286 1 12 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.432 1.568 26060 8287 1 12 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.844 -1.564 26060 8288 1 12 . 1 1 51 51 VAL H H 51 7.810 7.810 8.006 -0.196 26060 8289 1 12 . 1 1 52 52 GLU N N 52 130.700 130.700 127.858 2.842 26060 8290 1 12 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.469 -0.489 26060 8291 1 12 . 1 1 52 52 GLU C C 52 175.400 175.400 175.619 -0.219 26060 8292 1 12 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.432 0.668 26060 8293 1 12 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.026 -0.446 26060 8294 1 12 . 1 1 52 52 GLU H H 52 9.380 9.380 8.937 0.443 26060 8295 1 12 . 1 1 53 53 LYS N N 53 109.200 109.200 113.896 -4.696 26060 8296 1 12 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.077 -0.277 26060 8297 1 12 . 1 1 53 53 LYS C C 53 172.300 172.300 174.656 -2.356 26060 8298 1 12 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.335 0.505 26060 8299 1 12 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.217 -1.967 26060 8300 1 12 . 1 1 53 53 LYS H H 53 7.190 7.190 7.407 -0.217 26060 8301 1 12 . 1 1 54 54 VAL N N 54 120.380 120.380 117.884 2.496 26060 8302 1 12 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.653 0.117 26060 8303 1 12 . 1 1 54 54 VAL C C 54 173.600 173.600 174.015 -0.415 26060 8304 1 12 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.408 -0.368 26060 8305 1 12 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.562 -1.862 26060 8306 1 12 . 1 1 54 54 VAL H H 54 8.450 8.450 8.222 0.228 26060 8307 1 12 . 1 1 55 55 VAL N N 55 126.920 126.920 122.887 4.033 26060 8308 1 12 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.138 -0.438 26060 8309 1 12 . 1 1 55 55 VAL C C 55 173.800 173.800 173.865 -0.065 26060 8310 1 12 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.849 0.021 26060 8311 1 12 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.987 -2.887 26060 8312 1 12 . 1 1 55 55 VAL H H 55 9.260 9.260 9.185 0.075 26060 8313 1 12 . 1 1 56 56 PHE N N 56 126.130 126.130 123.889 2.241 26060 8314 1 12 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.060 -0.370 26060 8315 1 12 . 1 1 56 56 PHE C C 56 174.000 174.000 174.359 -0.359 26060 8316 1 12 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.646 -0.066 26060 8317 1 12 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.748 -1.858 26060 8318 1 12 . 1 1 56 56 PHE H H 56 9.290 9.290 9.177 0.113 26060 8319 1 12 . 1 1 57 57 HIS N N 57 124.180 124.180 123.842 0.338 26060 8320 1 12 . 1 1 57 57 HIS HA H 57 4.800 4.800 5.018 -0.218 26060 8321 1 12 . 1 1 57 57 HIS C C 57 174.700 174.700 174.876 -0.176 26060 8322 1 12 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.056 0.264 26060 8323 1 12 . 1 1 57 57 HIS CB C 57 30.100 30.100 29.124 0.976 26060 8324 1 12 . 1 1 57 57 HIS H H 57 8.690 8.690 8.621 0.069 26060 8325 1 12 . 1 1 58 58 LEU N N 58 122.050 122.050 122.851 -0.801 26060 8326 1 12 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.406 -0.166 26060 8327 1 12 . 1 1 58 58 LEU C C 58 174.400 174.400 176.915 -2.515 26060 8328 1 12 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.678 0.732 26060 8329 1 12 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.505 -1.345 26060 8330 1 12 . 1 1 58 58 LEU H H 58 9.050 9.050 8.232 0.818 26060 8331 1 12 . 1 1 59 59 HIS N N 59 118.510 118.510 118.986 -0.476 26060 8332 1 12 . 1 1 59 59 HIS C C 59 175.300 175.300 176.775 -1.475 26060 8333 1 12 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.559 3.551 26060 8334 1 12 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.279 -0.349 26060 8335 1 12 . 1 1 59 59 HIS H H 59 5.160 5.160 7.836 -2.676 26060 8336 1 12 . 1 1 60 60 GLU N N 60 122.190 122.190 125.694 -3.504 26060 8337 1 12 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.013 -0.053 26060 8338 1 12 . 1 1 60 60 GLU C C 60 175.130 175.130 177.139 -2.009 26060 8339 1 12 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.308 -0.298 26060 8340 1 12 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.653 0.167 26060 8341 1 12 . 1 1 60 60 GLU H H 60 7.960 7.960 8.579 -0.619 26060 8342 1 12 . 1 1 61 61 SER N N 61 116.940 116.940 112.871 4.069 26060 8343 1 12 . 1 1 61 61 SER HA H 61 4.200 4.200 4.309 -0.109 26060 8344 1 12 . 1 1 61 61 SER CA C 61 60.010 60.010 58.997 1.013 26060 8345 1 12 . 1 1 61 61 SER CB C 61 63.140 63.140 63.581 -0.442 26060 8346 1 12 . 1 1 61 61 SER H H 61 8.540 8.540 7.892 0.648 26060 8347 1 12 . 1 1 62 62 PHE N N 62 123.700 123.700 121.992 1.708 26060 8348 1 12 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.534 0.016 26060 8349 1 12 . 1 1 62 62 PHE CA C 62 57.940 57.940 56.313 1.627 26060 8350 1 12 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.657 -0.257 26060 8351 1 12 . 1 1 62 62 PHE H H 62 8.640 8.640 8.111 0.529 26060 8352 1 12 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.460 -0.050 26060 8353 1 12 . 1 1 63 63 PRO C C 63 176.400 176.400 176.318 0.082 26060 8354 1 12 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.401 -0.801 26060 8355 1 12 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.829 0.031 26060 8356 1 12 . 1 1 64 64 ARG N N 64 116.840 116.840 120.856 -4.016 26060 8357 1 12 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.062 0.038 26060 8358 1 12 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.184 -0.574 26060 8359 1 12 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.355 0.475 26060 8360 1 12 . 1 1 64 64 ARG H H 64 8.890 8.890 8.725 0.165 26060 8361 1 12 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.342 -0.352 26060 8362 1 12 . 1 1 65 65 PRO C C 65 175.800 175.800 177.180 -1.380 26060 8363 1 12 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.095 1.715 26060 8364 1 12 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.905 -0.025 26060 8365 1 12 . 1 1 66 66 LYS N N 66 119.035 119.035 119.960 -0.925 26060 8366 1 12 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.064 -0.454 26060 8367 1 12 . 1 1 66 66 LYS C C 66 175.400 175.400 175.864 -0.464 26060 8368 1 12 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.435 0.018 26060 8369 1 12 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.249 -0.519 26060 8370 1 12 . 1 1 66 66 LYS H H 66 7.630 7.630 7.837 -0.207 26060 8371 1 12 . 1 1 67 67 ARG N N 67 127.394 127.394 127.663 -0.269 26060 8372 1 12 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.644 0.096 26060 8373 1 12 . 1 1 67 67 ARG C C 67 174.500 174.500 174.769 -0.269 26060 8374 1 12 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.411 0.389 26060 8375 1 12 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.480 -1.766 26060 8376 1 12 . 1 1 67 67 ARG H H 67 8.855 8.855 8.737 0.118 26060 8377 1 12 . 1 1 68 68 VAL N N 68 124.388 124.388 119.548 4.840 26060 8378 1 12 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.133 -0.553 26060 8379 1 12 . 1 1 68 68 VAL C C 68 176.850 176.850 175.459 1.391 26060 8380 1 12 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.702 2.371 26060 8381 1 12 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.858 -0.254 26060 8382 1 12 . 1 1 68 68 VAL H H 68 8.681 8.681 8.421 0.260 26060 8383 1 12 . 1 1 69 69 CYS N N 69 127.080 127.080 125.596 1.484 26060 8384 1 12 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.754 0.316 26060 8385 1 12 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.629 0.717 26060 8386 1 12 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.152 1.618 26060 8387 1 12 . 1 1 69 69 CYS H H 69 9.455 9.455 8.976 0.479 26060 8388 1 12 . 1 1 70 70 LYS N N 70 125.480 125.480 122.908 2.572 26060 8389 1 12 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.508 -0.018 26060 8390 1 12 . 1 1 70 70 LYS C C 70 174.300 174.300 175.624 -1.324 26060 8391 1 12 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.526 1.234 26060 8392 1 12 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.103 0.067 26060 8393 1 12 . 1 1 70 70 LYS H H 70 9.050 9.050 8.671 0.379 26060 8394 1 12 . 1 1 71 71 ASP N N 71 116.940 116.940 120.098 -3.158 26060 8395 1 12 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.889 0.211 26060 8396 1 12 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.857 -0.777 26060 8397 1 12 . 1 1 71 71 ASP CB C 71 43.380 43.380 40.883 2.497 26060 8398 1 12 . 1 1 71 71 ASP H H 71 7.620 7.620 7.494 0.126 26060 8399 1 12 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.141 -0.881 26060 8400 1 12 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.800 -2.150 26060 8401 1 12 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.867 -0.827 26060 8402 1 12 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.184 -0.084 26060 8403 1 12 . 1 1 73 73 PRO C C 73 174.700 174.700 176.293 -1.593 26060 8404 1 12 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.276 -2.586 26060 8405 1 12 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.110 2.929 26060 8406 1 12 . 1 1 74 74 TYR N N 74 125.400 125.400 125.126 0.274 26060 8407 1 12 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.533 0.317 26060 8408 1 12 . 1 1 74 74 TYR C C 74 172.900 172.900 175.288 -2.388 26060 8409 1 12 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.218 -2.548 26060 8410 1 12 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.722 -3.322 26060 8411 1 12 . 1 1 74 74 TYR H H 74 8.960 8.960 8.342 0.618 26060 8412 1 12 . 1 1 75 75 LYS N N 75 121.400 121.400 119.964 1.436 26060 8413 1 12 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.099 0.491 26060 8414 1 12 . 1 1 75 75 LYS C C 75 173.800 173.800 174.548 -0.748 26060 8415 1 12 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.665 -0.015 26060 8416 1 12 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.749 -0.859 26060 8417 1 12 . 1 1 75 75 LYS H H 75 7.670 7.670 7.948 -0.278 26060 8418 1 12 . 1 1 76 76 VAL N N 76 119.800 119.800 121.554 -1.754 26060 8419 1 12 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.131 -0.241 26060 8420 1 12 . 1 1 76 76 VAL C C 76 173.900 173.900 174.450 -0.550 26060 8421 1 12 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.289 1.441 26060 8422 1 12 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.755 0.785 26060 8423 1 12 . 1 1 76 76 VAL H H 76 8.180 8.180 7.811 0.369 26060 8424 1 12 . 1 1 77 77 GLU N N 77 126.190 126.190 128.042 -1.852 26060 8425 1 12 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.929 0.021 26060 8426 1 12 . 1 1 77 77 GLU C C 77 174.700 174.700 175.434 -0.734 26060 8427 1 12 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.272 -0.332 26060 8428 1 12 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.049 0.501 26060 8429 1 12 . 1 1 77 77 GLU H H 77 8.270 8.270 8.673 -0.403 26060 8430 1 12 . 1 1 78 78 GLU N N 78 126.180 126.180 123.416 2.764 26060 8431 1 12 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.576 -0.126 26060 8432 1 12 . 1 1 78 78 GLU C C 78 175.400 175.400 173.998 1.402 26060 8433 1 12 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.011 0.031 26060 8434 1 12 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.999 3.101 26060 8435 1 12 . 1 1 78 78 GLU H H 78 7.870 7.870 8.468 -0.598 26060 8436 1 12 . 1 1 79 79 SER N N 79 112.109 112.109 113.271 -1.162 26060 8437 1 12 . 1 1 79 79 SER HA H 79 5.560 5.560 5.397 0.163 26060 8438 1 12 . 1 1 79 79 SER C C 79 172.490 172.490 173.051 -0.561 26060 8439 1 12 . 1 1 79 79 SER CA C 79 57.754 57.754 56.725 1.029 26060 8440 1 12 . 1 1 79 79 SER CB C 79 65.861 65.861 65.303 0.558 26060 8441 1 12 . 1 1 79 79 SER H H 79 7.714 7.714 8.337 -0.623 26060 8442 1 12 . 1 1 80 80 GLY N N 80 106.048 106.048 111.225 -5.177 26060 8443 1 12 . 1 1 80 80 GLY C C 80 172.630 172.630 171.852 0.778 26060 8444 1 12 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.665 0.905 26060 8445 1 12 . 1 1 80 80 GLY H H 80 8.828 8.828 8.983 -0.155 26060 8446 1 12 . 1 1 81 81 TYR N N 81 115.280 115.280 114.221 1.059 26060 8447 1 12 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.320 0.360 26060 8448 1 12 . 1 1 81 81 TYR C C 81 174.100 174.100 174.154 -0.054 26060 8449 1 12 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.067 -1.567 26060 8450 1 12 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.464 1.876 26060 8451 1 12 . 1 1 81 81 TYR H H 81 8.770 8.770 8.161 0.609 26060 8452 1 12 . 1 1 82 82 ALA N N 82 122.350 122.350 122.454 -0.104 26060 8453 1 12 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.522 -0.122 26060 8454 1 12 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.740 0.300 26060 8455 1 12 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.041 1.359 26060 8456 1 12 . 1 1 82 82 ALA H H 82 7.160 7.160 7.373 -0.213 26060 8457 1 12 . 1 1 83 83 GLY N N 83 107.100 107.100 106.650 0.450 26060 8458 1 12 . 1 1 83 83 GLY C C 83 172.500 172.500 173.621 -1.121 26060 8459 1 12 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.105 0.505 26060 8460 1 12 . 1 1 83 83 GLY H H 83 8.220 8.220 8.252 -0.032 26060 8461 1 12 . 1 1 84 84 PHE N N 84 111.660 111.660 116.104 -4.444 26060 8462 1 12 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.565 0.125 26060 8463 1 12 . 1 1 84 84 PHE C C 84 172.460 172.460 173.479 -1.019 26060 8464 1 12 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.573 -0.073 26060 8465 1 12 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.661 -1.081 26060 8466 1 12 . 1 1 84 84 PHE H H 84 7.700 7.700 8.334 -0.634 26060 8467 1 12 . 1 1 85 85 ILE N N 85 117.810 117.810 121.921 -4.111 26060 8468 1 12 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.071 0.239 26060 8469 1 12 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.770 -1.431 26060 8470 1 12 . 1 1 85 85 ILE CB C 85 35.260 35.260 36.957 -1.697 26060 8471 1 12 . 1 1 85 85 ILE H H 85 8.340 8.340 8.437 -0.097 26060 8472 1 12 . 1 1 86 86 LEU N N 86 108.130 108.130 129.217 -21.087 26060 8473 1 12 . 1 1 86 86 LEU HA H 86 4.980 4.980 4.970 0.010 26060 8474 1 12 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.787 2.413 26060 8475 1 12 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.425 -0.125 26060 8476 1 12 . 1 1 86 86 LEU H H 86 9.900 9.900 8.796 1.103 26060 8477 1 12 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.476 0.624 26060 8478 1 12 . 1 1 87 87 PRO C C 87 175.340 175.340 175.874 -0.534 26060 8479 1 12 . 1 1 87 87 PRO CA C 87 63.110 63.110 63.091 0.019 26060 8480 1 12 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.550 1.010 26060 8481 1 12 . 1 1 88 88 ILE N N 88 126.000 126.000 125.825 0.175 26060 8482 1 12 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.220 0.570 26060 8483 1 12 . 1 1 88 88 ILE C C 88 176.100 176.100 175.150 0.950 26060 8484 1 12 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.382 0.178 26060 8485 1 12 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.097 1.903 26060 8486 1 12 . 1 1 88 88 ILE H H 88 9.380 9.380 8.544 0.836 26060 8487 1 12 . 1 1 89 89 GLU N N 89 123.900 123.900 124.437 -0.537 26060 8488 1 12 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.319 -0.119 26060 8489 1 12 . 1 1 89 89 GLU C C 89 173.800 173.800 175.451 -1.651 26060 8490 1 12 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.468 -0.498 26060 8491 1 12 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.712 0.668 26060 8492 1 12 . 1 1 89 89 GLU H H 89 9.320 9.320 8.982 0.338 26060 8493 1 12 . 1 1 90 90 VAL N N 90 123.980 123.980 122.677 1.303 26060 8494 1 12 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.196 -0.036 26060 8495 1 12 . 1 1 90 90 VAL C C 90 174.800 174.800 174.376 0.424 26060 8496 1 12 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.112 0.878 26060 8497 1 12 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.648 -1.158 26060 8498 1 12 . 1 1 90 90 VAL H H 90 8.630 8.630 8.586 0.044 26060 8499 1 12 . 1 1 91 91 TYR N N 91 124.230 124.230 125.668 -1.438 26060 8500 1 12 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.737 -0.077 26060 8501 1 12 . 1 1 91 91 TYR C C 91 176.800 176.800 175.634 1.166 26060 8502 1 12 . 1 1 91 91 TYR CA C 91 56.700 56.700 56.775 -0.075 26060 8503 1 12 . 1 1 91 91 TYR CB C 91 40.240 40.240 39.362 0.878 26060 8504 1 12 . 1 1 91 91 TYR H H 91 8.640 8.640 9.091 -0.451 26060 8505 1 12 . 1 1 92 92 PHE N N 92 121.200 121.200 122.346 -1.146 26060 8506 1 12 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.263 0.397 26060 8507 1 12 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.948 1.562 26060 8508 1 12 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.890 0.810 26060 8509 1 12 . 1 1 92 92 PHE H H 92 8.750 8.750 9.098 -0.348 26060 8510 1 12 . 1 1 93 93 LYS N N 93 123.450 123.450 123.552 -0.102 26060 8511 1 12 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.630 -0.030 26060 8512 1 12 . 1 1 93 93 LYS C C 93 174.200 174.200 175.044 -0.844 26060 8513 1 12 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.868 -0.688 26060 8514 1 12 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.038 -0.358 26060 8515 1 12 . 1 1 93 93 LYS H H 93 8.560 8.560 8.936 -0.376 26060 8516 1 12 . 1 1 94 94 ASN N N 94 118.800 118.800 121.373 -2.573 26060 8517 1 12 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.757 -0.317 26060 8518 1 12 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.301 -1.091 26060 8519 1 12 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.100 -0.300 26060 8520 1 12 . 1 1 94 94 ASN H H 94 7.820 7.820 7.946 -0.126 26060 8521 1 12 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.436 -0.106 26060 8522 1 12 . 1 1 95 95 LYS C C 95 175.800 175.800 176.018 -0.218 26060 8523 1 12 . 1 1 95 95 LYS CA C 95 56.210 56.210 55.974 0.236 26060 8524 1 12 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.306 -0.296 26060 8525 1 12 . 1 1 96 96 GLU N N 96 118.330 118.330 120.354 -2.024 26060 8526 1 12 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.384 0.126 26060 8527 1 12 . 1 1 96 96 GLU C C 96 173.200 173.200 176.148 -2.948 26060 8528 1 12 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.171 -1.071 26060 8529 1 12 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.256 2.214 26060 8530 1 12 . 1 1 96 96 GLU H H 96 7.120 7.120 7.573 -0.453 26060 8531 1 12 . 1 1 97 97 GLU N N 97 115.630 115.630 119.916 -4.286 26060 8532 1 12 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.206 0.224 26060 8533 1 12 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.163 -1.302 26060 8534 1 12 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.856 0.414 26060 8535 1 12 . 1 1 97 97 GLU H H 97 8.060 8.060 8.404 -0.344 26060 8536 1 12 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.207 0.793 26060 8537 1 12 . 1 1 98 98 PRO C C 98 175.900 175.900 176.680 -0.780 26060 8538 1 12 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.088 -1.928 26060 8539 1 12 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.787 2.213 26060 8540 1 12 . 1 1 99 99 ARG N N 99 122.800 122.800 119.533 3.267 26060 8541 1 12 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.552 0.078 26060 8542 1 12 . 1 1 99 99 ARG C C 99 175.800 175.800 175.635 0.165 26060 8543 1 12 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.233 0.257 26060 8544 1 12 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.664 -0.254 26060 8545 1 12 . 1 1 99 99 ARG H H 99 8.602 8.602 8.578 0.024 26060 8546 1 12 . 1 1 100 100 LYS N N 100 113.220 113.220 117.123 -3.903 26060 8547 1 12 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.786 0.154 26060 8548 1 12 . 1 1 100 100 LYS C C 100 174.100 174.100 174.503 -0.403 26060 8549 1 12 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.136 -0.226 26060 8550 1 12 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.830 -1.109 26060 8551 1 12 . 1 1 100 100 LYS H H 100 7.650 7.650 7.313 0.337 26060 8552 1 12 . 1 1 101 101 VAL N N 101 116.230 116.230 121.475 -5.245 26060 8553 1 12 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.167 0.103 26060 8554 1 12 . 1 1 101 101 VAL C C 101 171.600 171.600 173.591 -1.991 26060 8555 1 12 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.197 1.063 26060 8556 1 12 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.340 -0.161 26060 8557 1 12 . 1 1 101 101 VAL H H 101 8.120 8.120 8.308 -0.188 26060 8558 1 12 . 1 1 102 102 ARG N N 102 124.980 124.980 127.472 -2.492 26060 8559 1 12 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.870 0.290 26060 8560 1 12 . 1 1 102 102 ARG C C 102 174.340 174.340 175.174 -0.834 26060 8561 1 12 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.671 -0.921 26060 8562 1 12 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.863 1.487 26060 8563 1 12 . 1 1 102 102 ARG H H 102 7.930 7.930 8.253 -0.323 26060 8564 1 12 . 1 1 103 103 PHE N N 103 124.590 124.590 126.444 -1.854 26060 8565 1 12 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.771 0.021 26060 8566 1 12 . 1 1 103 103 PHE C C 103 174.280 174.280 175.083 -0.803 26060 8567 1 12 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.443 1.537 26060 8568 1 12 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.945 2.305 26060 8569 1 12 . 1 1 103 103 PHE H H 103 9.390 9.390 9.077 0.313 26060 8570 1 12 . 1 1 104 104 ASP N N 104 124.700 124.700 124.690 0.010 26060 8571 1 12 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.606 0.193 26060 8572 1 12 . 1 1 104 104 ASP C C 104 174.500 174.500 175.015 -0.515 26060 8573 1 12 . 1 1 104 104 ASP CA C 104 54.390 54.390 53.721 0.669 26060 8574 1 12 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.230 1.000 26060 8575 1 12 . 1 1 104 104 ASP H H 104 9.010 9.010 8.852 0.158 26060 8576 1 12 . 1 1 105 105 TYR N N 105 129.840 129.840 123.555 6.285 26060 8577 1 12 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.486 -0.386 26060 8578 1 12 . 1 1 105 105 TYR C C 105 173.100 173.100 173.943 -0.843 26060 8579 1 12 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.938 0.742 26060 8580 1 12 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.792 1.058 26060 8581 1 12 . 1 1 105 105 TYR H H 105 8.140 8.140 8.164 -0.024 26060 8582 1 12 . 1 1 106 106 ASP N N 106 126.800 126.800 127.628 -0.828 26060 8583 1 12 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.341 -0.121 26060 8584 1 12 . 1 1 106 106 ASP C C 106 172.900 172.900 174.430 -1.530 26060 8585 1 12 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.746 -0.236 26060 8586 1 12 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.276 -1.776 26060 8587 1 12 . 1 1 106 106 ASP H H 106 7.730 7.730 8.234 -0.504 26060 8588 1 12 . 1 1 107 107 LEU N N 107 132.150 132.150 127.650 4.500 26060 8589 1 12 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.608 -0.768 26060 8590 1 12 . 1 1 107 107 LEU C C 107 172.100 172.100 174.896 -2.796 26060 8591 1 12 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.862 -0.162 26060 8592 1 12 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.972 -2.732 26060 8593 1 12 . 1 1 107 107 LEU H H 107 7.770 7.770 7.777 -0.007 26060 8594 1 12 . 1 1 108 108 PHE N N 108 118.960 118.960 121.807 -2.847 26060 8595 1 12 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.911 -0.221 26060 8596 1 12 . 1 1 108 108 PHE C C 108 174.300 174.300 173.367 0.933 26060 8597 1 12 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.444 -0.754 26060 8598 1 12 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.587 -1.297 26060 8599 1 12 . 1 1 108 108 PHE H H 108 6.060 6.060 7.452 -1.392 26060 8600 1 12 . 1 1 109 109 LEU N N 109 118.900 118.900 121.942 -3.042 26060 8601 1 12 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.730 -0.330 26060 8602 1 12 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.383 -1.223 26060 8603 1 12 . 1 1 109 109 LEU CB C 109 43.080 43.080 45.130 -2.050 26060 8604 1 12 . 1 1 109 109 LEU H H 109 8.388 8.388 8.319 0.069 26060 8605 1 12 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.293 0.147 26060 8606 1 12 . 1 1 111 111 LEU C C 111 177.300 177.300 177.341 -0.041 26060 8607 1 12 . 1 1 111 111 LEU CA C 111 54.220 54.220 54.878 -0.658 26060 8608 1 12 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.588 1.282 26060 8609 1 12 . 1 1 112 112 GLU N N 112 120.660 120.660 123.344 -2.684 26060 8610 1 12 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.016 0.154 26060 8611 1 12 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.488 -0.028 26060 8612 1 12 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.005 -0.315 26060 8613 1 12 . 1 1 112 112 GLU H H 112 8.780 8.780 8.750 0.030 26060 8614 1 12 . 1 1 113 113 GLY C C 113 173.900 173.900 173.838 0.062 26060 8615 1 12 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.986 -0.036 26060 8616 1 12 . 1 1 114 114 HIS N N 114 120.890 120.890 117.104 3.786 26060 8617 1 12 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.086 -0.180 26060 8618 1 12 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.302 1.468 26060 8619 1 12 . 1 1 114 114 HIS CB C 114 30.590 30.590 30.308 0.282 26060 8620 1 12 . 1 1 114 114 HIS H H 114 7.934 7.934 7.805 0.129 26060 8621 1 12 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.015 -0.215 26060 8622 1 12 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.902 1.188 26060 8623 1 12 . 1 1 115 115 PRO CB C 115 30.680 30.680 32.131 -1.451 26060 8624 1 12 . 1 1 116 116 PRO C C 116 176.600 176.600 175.510 1.090 26060 8625 1 12 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.224 0.076 26060 8626 1 12 . 1 1 117 117 VAL N N 117 127.480 127.480 125.820 1.660 26060 8627 1 12 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.155 -0.365 26060 8628 1 12 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.423 1.277 26060 8629 1 12 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.144 0.056 26060 8630 1 12 . 1 1 117 117 VAL H H 117 8.890 8.890 7.864 1.026 26060 8631 1 12 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.065 -0.075 26060 8632 1 12 . 1 1 118 118 ASN C C 118 172.700 172.700 173.612 -0.912 26060 8633 1 12 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.188 0.172 26060 8634 1 12 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.878 -1.678 26060 8635 1 12 . 1 1 119 119 HIS N N 119 124.930 124.930 125.824 -0.894 26060 8636 1 12 . 1 1 119 119 HIS HA H 119 4.820 4.820 4.998 -0.178 26060 8637 1 12 . 1 1 119 119 HIS C C 119 173.500 173.500 172.759 0.741 26060 8638 1 12 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.667 1.303 26060 8639 1 12 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.157 0.512 26060 8640 1 12 . 1 1 119 119 HIS H H 119 8.790 8.790 8.783 0.007 26060 8641 1 12 . 1 1 120 120 LEU N N 120 128.280 128.280 123.876 4.404 26060 8642 1 12 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.340 -0.390 26060 8643 1 12 . 1 1 120 120 LEU C C 120 174.030 174.030 175.329 -1.299 26060 8644 1 12 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.580 0.860 26060 8645 1 12 . 1 1 120 120 LEU CB C 120 46.600 46.600 45.995 0.605 26060 8646 1 12 . 1 1 120 120 LEU H H 120 7.460 7.460 8.242 -0.782 26060 8647 1 12 . 1 1 121 121 ARG N N 121 128.060 128.060 122.729 5.331 26060 8648 1 12 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.564 0.076 26060 8649 1 12 . 1 1 121 121 ARG C C 121 173.400 173.400 173.583 -0.183 26060 8650 1 12 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.803 -0.443 26060 8651 1 12 . 1 1 121 121 ARG CB C 121 34.260 34.260 33.710 0.550 26060 8652 1 12 . 1 1 121 121 ARG H H 121 9.860 9.860 9.148 0.712 26060 8653 1 12 . 1 1 122 122 CYS N N 122 125.290 125.290 123.970 1.320 26060 8654 1 12 . 1 1 122 122 CYS HA H 122 5.020 5.020 4.919 0.101 26060 8655 1 12 . 1 1 122 122 CYS C C 122 174.600 174.600 174.768 -0.168 26060 8656 1 12 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.614 1.676 26060 8657 1 12 . 1 1 122 122 CYS CB C 122 28.030 28.030 27.703 0.327 26060 8658 1 12 . 1 1 122 122 CYS H H 122 8.835 8.835 8.664 0.171 26060 8659 1 12 . 1 1 123 123 GLU N N 123 125.920 125.920 124.611 1.309 26060 8660 1 12 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.437 0.243 26060 8661 1 12 . 1 1 123 123 GLU C C 123 174.500 174.500 174.880 -0.380 26060 8662 1 12 . 1 1 123 123 GLU CA C 123 54.420 54.420 55.047 -0.627 26060 8663 1 12 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.848 0.735 26060 8664 1 12 . 1 1 123 123 GLU H H 123 8.970 8.970 9.103 -0.133 26060 8665 1 12 . 1 1 124 124 LYS N N 124 121.837 121.837 121.405 0.432 26060 8666 1 12 . 1 1 124 124 LYS HA H 124 4.960 4.960 5.025 -0.065 26060 8667 1 12 . 1 1 124 124 LYS C C 124 175.700 175.700 175.689 0.011 26060 8668 1 12 . 1 1 124 124 LYS CA C 124 55.357 55.357 54.834 0.523 26060 8669 1 12 . 1 1 124 124 LYS CB C 124 34.189 34.189 35.071 -0.882 26060 8670 1 12 . 1 1 124 124 LYS H H 124 8.652 8.652 8.340 0.312 26060 8671 1 12 . 1 1 125 125 LEU N N 125 127.000 127.000 129.081 -2.081 26060 8672 1 12 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.570 0.080 26060 8673 1 12 . 1 1 125 125 LEU C C 125 175.110 175.110 175.403 -0.293 26060 8674 1 12 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.684 0.170 26060 8675 1 12 . 1 1 125 125 LEU CB C 125 44.267 44.267 42.985 1.282 26060 8676 1 12 . 1 1 125 125 LEU H H 125 9.175 9.175 9.005 0.170 26060 8677 1 12 . 1 1 126 126 THR N N 126 117.779 117.779 119.574 -1.795 26060 8678 1 12 . 1 1 126 126 THR HA H 126 4.650 4.650 4.418 0.232 26060 8679 1 12 . 1 1 126 126 THR C C 126 173.200 173.200 173.699 -0.499 26060 8680 1 12 . 1 1 126 126 THR CA C 126 62.036 62.036 62.088 -0.052 26060 8681 1 12 . 1 1 126 126 THR CB C 126 70.284 70.284 68.922 1.362 26060 8682 1 12 . 1 1 126 126 THR H H 126 8.331 8.331 8.388 -0.057 26060 8683 1 12 . 1 1 127 127 PHE N N 127 126.576 126.576 126.755 -0.179 26060 8684 1 12 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.625 -0.035 26060 8685 1 12 . 1 1 127 127 PHE C C 127 174.860 174.860 174.560 0.300 26060 8686 1 12 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.597 0.267 26060 8687 1 12 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.670 -0.670 26060 8688 1 12 . 1 1 127 127 PHE H H 127 9.051 9.051 9.134 -0.083 26060 8689 1 12 . 1 1 128 128 ASN N N 128 123.040 123.040 123.838 -0.798 26060 8690 1 12 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.705 -0.085 26060 8691 1 12 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.943 0.537 26060 8692 1 12 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.830 0.630 26060 8693 1 12 . 1 1 128 128 ASN H H 128 8.880 8.880 8.790 0.090 26060 8694 1 12 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.600 0.160 26060 8695 1 12 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.665 -0.765 26060 8696 1 12 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.267 1.463 26060 8697 1 12 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.850 -0.060 26060 8698 1 12 . 1 1 130 130 PRO C C 130 177.470 177.470 176.069 1.401 26060 8699 1 12 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.251 0.323 26060 8700 1 12 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.544 -1.234 26060 8701 1 12 . 1 1 131 131 THR N N 131 113.400 113.400 113.769 -0.369 26060 8702 1 12 . 1 1 131 131 THR HA H 131 4.300 4.300 4.197 0.103 26060 8703 1 12 . 1 1 131 131 THR C C 131 175.200 175.200 176.201 -1.001 26060 8704 1 12 . 1 1 131 131 THR CA C 131 62.200 62.200 62.121 0.079 26060 8705 1 12 . 1 1 131 131 THR CB C 131 70.600 70.600 70.788 -0.188 26060 8706 1 12 . 1 1 131 131 THR H H 131 8.950 8.950 8.098 0.852 26060 8707 1 12 . 1 1 132 132 GLU N N 132 122.199 122.199 124.821 -2.622 26060 8708 1 12 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.055 -0.045 26060 8709 1 12 . 1 1 132 132 GLU C C 132 178.700 178.700 178.308 0.392 26060 8710 1 12 . 1 1 132 132 GLU CA C 132 60.294 60.294 59.884 0.410 26060 8711 1 12 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.688 -0.527 26060 8712 1 12 . 1 1 132 132 GLU H H 132 8.932 8.932 9.031 -0.099 26060 8713 1 12 . 1 1 133 133 ASP N N 133 116.324 116.324 119.810 -3.486 26060 8714 1 12 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.363 -0.033 26060 8715 1 12 . 1 1 133 133 ASP C C 133 177.800 177.800 178.688 -0.888 26060 8716 1 12 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.964 -0.417 26060 8717 1 12 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.462 1.361 26060 8718 1 12 . 1 1 133 133 ASP H H 133 8.490 8.490 8.029 0.461 26060 8719 1 12 . 1 1 134 134 PHE N N 134 119.914 119.914 120.596 -0.682 26060 8720 1 12 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.308 0.302 26060 8721 1 12 . 1 1 134 134 PHE C C 134 177.300 177.300 177.274 0.026 26060 8722 1 12 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.613 -0.075 26060 8723 1 12 . 1 1 134 134 PHE CB C 134 39.200 39.200 39.053 0.146 26060 8724 1 12 . 1 1 134 134 PHE H H 134 7.787 7.787 7.459 0.328 26060 8725 1 12 . 1 1 135 135 ARG N N 135 119.794 119.794 119.837 -0.043 26060 8726 1 12 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.614 -0.264 26060 8727 1 12 . 1 1 135 135 ARG C C 135 177.370 177.370 178.263 -0.893 26060 8728 1 12 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.920 0.456 26060 8729 1 12 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.029 0.367 26060 8730 1 12 . 1 1 135 135 ARG H H 135 9.087 9.087 8.341 0.746 26060 8731 1 12 . 1 1 136 136 ARG N N 136 114.554 114.554 118.890 -4.336 26060 8732 1 12 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.866 -0.046 26060 8733 1 12 . 1 1 136 136 ARG C C 136 178.950 178.950 178.733 0.217 26060 8734 1 12 . 1 1 136 136 ARG CA C 136 59.800 59.800 60.021 -0.221 26060 8735 1 12 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.133 0.084 26060 8736 1 12 . 1 1 136 136 ARG H H 136 7.747 7.747 8.539 -0.792 26060 8737 1 12 . 1 1 137 137 LYS N N 137 118.298 118.298 118.942 -0.644 26060 8738 1 12 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.974 -0.074 26060 8739 1 12 . 1 1 137 137 LYS C C 137 177.980 177.980 179.028 -1.048 26060 8740 1 12 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.583 0.812 26060 8741 1 12 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.418 0.029 26060 8742 1 12 . 1 1 137 137 LYS H H 137 7.154 7.154 7.487 -0.333 26060 8743 1 12 . 1 1 138 138 LEU N N 138 117.159 117.159 118.921 -1.762 26060 8744 1 12 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.685 -0.265 26060 8745 1 12 . 1 1 138 138 LEU C C 138 179.100 179.100 178.750 0.350 26060 8746 1 12 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.350 -0.119 26060 8747 1 12 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.384 0.944 26060 8748 1 12 . 1 1 138 138 LEU H H 138 7.709 7.709 7.838 -0.129 26060 8749 1 12 . 1 1 139 139 LEU N N 139 115.158 115.158 116.223 -1.065 26060 8750 1 12 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.101 0.049 26060 8751 1 12 . 1 1 139 139 LEU C C 139 177.600 177.600 178.714 -1.114 26060 8752 1 12 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.500 -0.971 26060 8753 1 12 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.941 -0.197 26060 8754 1 12 . 1 1 139 139 LEU H H 139 7.507 7.507 7.961 -0.454 26060 8755 1 12 . 1 1 140 140 LYS N N 140 120.256 120.256 118.381 1.875 26060 8756 1 12 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.016 0.094 26060 8757 1 12 . 1 1 140 140 LYS C C 140 175.800 175.800 177.141 -1.341 26060 8758 1 12 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.215 -0.163 26060 8759 1 12 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.390 0.256 26060 8760 1 12 . 1 1 140 140 LYS H H 140 7.304 7.304 7.614 -0.310 26060 8761 1 13 . 1 1 4 4 MET C C 4 175.800 175.800 177.023 -1.223 26060 8762 1 13 . 1 1 4 4 MET CA C 4 55.350 55.350 54.535 0.815 26060 8763 1 13 . 1 1 4 4 MET CB C 4 32.880 32.880 32.814 0.066 26060 8764 1 13 . 1 1 5 5 ALA N N 5 125.230 125.230 123.483 1.747 26060 8765 1 13 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.222 0.128 26060 8766 1 13 . 1 1 5 5 ALA CA C 5 52.430 52.430 53.432 -1.002 26060 8767 1 13 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.148 0.222 26060 8768 1 13 . 1 1 5 5 ALA H H 5 8.320 8.320 8.191 0.129 26060 8769 1 13 . 1 1 6 6 SER HA H 6 4.490 4.490 4.626 -0.136 26060 8770 1 13 . 1 1 6 6 SER CA C 6 58.200 58.200 57.206 0.994 26060 8771 1 13 . 1 1 6 6 SER CB C 6 63.700 63.700 63.854 -0.154 26060 8772 1 13 . 1 1 7 7 SER HA H 7 4.530 4.530 4.642 -0.112 26060 8773 1 13 . 1 1 7 7 SER CA C 7 58.200 58.200 58.704 -0.504 26060 8774 1 13 . 1 1 7 7 SER CB C 7 63.700 63.700 62.650 1.050 26060 8775 1 13 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.785 -0.175 26060 8776 1 13 . 1 1 8 8 CYS C C 8 173.500 173.500 173.177 0.323 26060 8777 1 13 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.746 1.594 26060 8778 1 13 . 1 1 8 8 CYS CB C 8 28.490 28.490 28.934 -0.444 26060 8779 1 13 . 1 1 9 9 ALA N N 9 124.700 124.700 129.042 -4.342 26060 8780 1 13 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.115 -0.325 26060 8781 1 13 . 1 1 9 9 ALA C C 9 177.400 177.400 176.714 0.686 26060 8782 1 13 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.411 1.659 26060 8783 1 13 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.716 -0.087 26060 8784 1 13 . 1 1 9 9 ALA H H 9 7.960 7.960 8.614 -0.654 26060 8785 1 13 . 1 1 10 10 VAL N N 10 120.124 120.124 124.709 -4.585 26060 8786 1 13 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.126 0.164 26060 8787 1 13 . 1 1 10 10 VAL C C 10 173.900 173.900 175.097 -1.197 26060 8788 1 13 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.579 -0.029 26060 8789 1 13 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.265 2.635 26060 8790 1 13 . 1 1 10 10 VAL H H 10 8.424 8.424 8.506 -0.082 26060 8791 1 13 . 1 1 11 11 GLN N N 11 125.818 125.818 127.277 -1.459 26060 8792 1 13 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.310 0.250 26060 8793 1 13 . 1 1 11 11 GLN C C 11 175.400 175.400 175.345 0.055 26060 8794 1 13 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.550 -0.427 26060 8795 1 13 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.106 1.923 26060 8796 1 13 . 1 1 11 11 GLN H H 11 8.636 8.636 8.610 0.026 26060 8797 1 13 . 1 1 12 12 VAL N N 12 119.106 119.106 119.277 -0.171 26060 8798 1 13 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.434 0.196 26060 8799 1 13 . 1 1 12 12 VAL C C 12 173.800 173.800 174.793 -0.993 26060 8800 1 13 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.500 0.300 26060 8801 1 13 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.613 2.098 26060 8802 1 13 . 1 1 12 12 VAL H H 12 8.827 8.827 8.960 -0.133 26060 8803 1 13 . 1 1 13 13 LYS N N 13 121.700 121.700 125.876 -4.176 26060 8804 1 13 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.362 -0.162 26060 8805 1 13 . 1 1 13 13 LYS C C 13 175.030 175.030 175.843 -0.813 26060 8806 1 13 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.017 0.413 26060 8807 1 13 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.189 1.731 26060 8808 1 13 . 1 1 13 13 LYS H H 13 8.234 8.234 8.595 -0.361 26060 8809 1 13 . 1 1 14 14 LEU N N 14 119.100 119.100 124.937 -5.837 26060 8810 1 13 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.306 -0.356 26060 8811 1 13 . 1 1 14 14 LEU C C 14 175.110 175.110 175.666 -0.556 26060 8812 1 13 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.461 -0.104 26060 8813 1 13 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.515 1.406 26060 8814 1 13 . 1 1 14 14 LEU H H 14 8.840 8.840 8.395 0.445 26060 8815 1 13 . 1 1 15 15 GLU N N 15 120.978 120.978 123.734 -2.756 26060 8816 1 13 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.277 -0.287 26060 8817 1 13 . 1 1 15 15 GLU C C 15 173.800 173.800 175.066 -1.266 26060 8818 1 13 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.532 0.896 26060 8819 1 13 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.738 -0.912 26060 8820 1 13 . 1 1 15 15 GLU H H 15 9.181 9.181 9.398 -0.217 26060 8821 1 13 . 1 1 16 16 LEU N N 16 124.438 124.438 126.704 -2.266 26060 8822 1 13 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.364 -0.254 26060 8823 1 13 . 1 1 16 16 LEU C C 16 174.700 174.700 176.354 -1.654 26060 8824 1 13 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.795 0.281 26060 8825 1 13 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.348 2.544 26060 8826 1 13 . 1 1 16 16 LEU H H 16 8.891 8.891 8.650 0.241 26060 8827 1 13 . 1 1 17 17 GLY N N 17 108.067 108.067 108.449 -0.382 26060 8828 1 13 . 1 1 17 17 GLY C C 17 170.350 170.350 172.398 -2.048 26060 8829 1 13 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.259 1.725 26060 8830 1 13 . 1 1 17 17 GLY H H 17 7.227 7.227 8.551 -1.324 26060 8831 1 13 . 1 1 18 18 HIS N N 18 111.200 111.200 118.651 -7.451 26060 8832 1 13 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.737 -0.117 26060 8833 1 13 . 1 1 18 18 HIS C C 18 172.400 172.400 172.652 -0.252 26060 8834 1 13 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.902 -0.962 26060 8835 1 13 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.588 1.572 26060 8836 1 13 . 1 1 18 18 HIS H H 18 8.150 8.150 8.963 -0.813 26060 8837 1 13 . 1 1 19 19 ARG N N 19 117.800 117.800 121.850 -4.050 26060 8838 1 13 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.973 0.127 26060 8839 1 13 . 1 1 19 19 ARG C C 19 175.800 175.800 174.224 1.576 26060 8840 1 13 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.839 -0.339 26060 8841 1 13 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.139 -0.489 26060 8842 1 13 . 1 1 19 19 ARG H H 19 9.010 9.010 9.066 -0.056 26060 8843 1 13 . 1 1 20 20 ALA N N 20 120.390 120.390 122.014 -1.624 26060 8844 1 13 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.460 0.070 26060 8845 1 13 . 1 1 20 20 ALA C C 20 175.800 175.800 175.228 0.572 26060 8846 1 13 . 1 1 20 20 ALA CA C 20 52.190 52.190 51.005 1.185 26060 8847 1 13 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.009 0.741 26060 8848 1 13 . 1 1 20 20 ALA H H 20 8.070 8.070 8.313 -0.243 26060 8849 1 13 . 1 1 21 21 GLN N N 21 121.790 121.790 122.848 -1.058 26060 8850 1 13 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.845 0.385 26060 8851 1 13 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.761 -0.431 26060 8852 1 13 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.445 0.455 26060 8853 1 13 . 1 1 21 21 GLN H H 21 9.240 9.240 9.219 0.021 26060 8854 1 13 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.567 -0.937 26060 8855 1 13 . 1 1 22 22 VAL C C 22 176.500 176.500 176.099 0.401 26060 8856 1 13 . 1 1 22 22 VAL CA C 22 63.030 63.030 61.057 1.973 26060 8857 1 13 . 1 1 22 22 VAL CB C 22 31.600 31.600 32.900 -1.300 26060 8858 1 13 . 1 1 23 23 ARG N N 23 127.840 127.840 125.828 2.012 26060 8859 1 13 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.590 -0.460 26060 8860 1 13 . 1 1 23 23 ARG CA C 23 56.600 56.600 54.973 1.627 26060 8861 1 13 . 1 1 23 23 ARG CB C 23 32.150 32.150 31.037 1.113 26060 8862 1 13 . 1 1 23 23 ARG H H 23 8.720 8.720 8.223 0.497 26060 8863 1 13 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.134 -0.094 26060 8864 1 13 . 1 1 24 24 LYS C C 24 176.960 176.960 176.282 0.678 26060 8865 1 13 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.947 0.853 26060 8866 1 13 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.644 -0.584 26060 8867 1 13 . 1 1 25 25 LYS N N 25 115.870 115.870 118.789 -2.919 26060 8868 1 13 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.662 0.168 26060 8869 1 13 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.231 -0.271 26060 8870 1 13 . 1 1 25 25 LYS CB C 25 35.080 35.080 34.045 1.035 26060 8871 1 13 . 1 1 25 25 LYS H H 25 7.720 7.720 7.601 0.119 26060 8872 1 13 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.621 0.209 26060 8873 1 13 . 1 1 26 26 PRO C C 26 177.400 177.400 176.852 0.548 26060 8874 1 13 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.788 -0.138 26060 8875 1 13 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.375 0.015 26060 8876 1 13 . 1 1 27 27 THR N N 27 111.270 111.270 114.357 -3.087 26060 8877 1 13 . 1 1 27 27 THR HA H 27 4.530 4.530 4.265 0.265 26060 8878 1 13 . 1 1 27 27 THR C C 27 177.300 177.300 176.908 0.392 26060 8879 1 13 . 1 1 27 27 THR CA C 27 61.300 61.300 60.925 0.374 26060 8880 1 13 . 1 1 27 27 THR CB C 27 71.460 71.460 70.065 1.395 26060 8881 1 13 . 1 1 27 27 THR H H 27 8.380 8.380 8.166 0.214 26060 8882 1 13 . 1 1 28 28 VAL N N 28 121.170 121.170 123.221 -2.051 26060 8883 1 13 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.806 0.077 26060 8884 1 13 . 1 1 28 28 VAL C C 28 177.030 177.030 176.062 0.968 26060 8885 1 13 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.141 0.059 26060 8886 1 13 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.661 -0.261 26060 8887 1 13 . 1 1 28 28 VAL H H 28 8.910 8.910 8.558 0.352 26060 8888 1 13 . 1 1 29 29 GLU N N 29 116.800 116.800 118.834 -2.034 26060 8889 1 13 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.080 -0.160 26060 8890 1 13 . 1 1 29 29 GLU C C 29 176.200 176.200 175.901 0.299 26060 8891 1 13 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.355 1.895 26060 8892 1 13 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.149 -0.979 26060 8893 1 13 . 1 1 29 29 GLU H H 29 7.990 7.990 8.009 -0.019 26060 8894 1 13 . 1 1 30 30 GLY N N 30 105.500 105.500 107.006 -1.506 26060 8895 1 13 . 1 1 30 30 GLY C C 30 174.900 174.900 173.667 1.233 26060 8896 1 13 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.157 -0.697 26060 8897 1 13 . 1 1 30 30 GLY H H 30 7.950 7.950 7.681 0.269 26060 8898 1 13 . 1 1 31 31 PHE N N 31 119.300 119.300 118.678 0.622 26060 8899 1 13 . 1 1 31 31 PHE HA H 31 4.760 4.760 5.004 -0.244 26060 8900 1 13 . 1 1 31 31 PHE C C 31 176.400 176.400 175.883 0.517 26060 8901 1 13 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.422 1.478 26060 8902 1 13 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.499 -3.999 26060 8903 1 13 . 1 1 31 31 PHE H H 31 7.520 7.520 7.365 0.155 26060 8904 1 13 . 1 1 32 32 THR N N 32 112.300 112.300 116.263 -3.963 26060 8905 1 13 . 1 1 32 32 THR HA H 32 4.330 4.330 4.478 -0.148 26060 8906 1 13 . 1 1 32 32 THR C C 32 175.200 175.200 174.406 0.794 26060 8907 1 13 . 1 1 32 32 THR CA C 32 62.780 62.780 62.807 -0.027 26060 8908 1 13 . 1 1 32 32 THR CB C 32 70.350 70.350 70.020 0.330 26060 8909 1 13 . 1 1 32 32 THR H H 32 7.770 7.770 9.247 -1.477 26060 8910 1 13 . 1 1 33 33 HIS N N 33 121.900 121.900 121.934 -0.034 26060 8911 1 13 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.040 0.460 26060 8912 1 13 . 1 1 33 33 HIS C C 33 173.880 173.880 173.557 0.323 26060 8913 1 13 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.705 0.075 26060 8914 1 13 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.750 3.890 26060 8915 1 13 . 1 1 33 33 HIS H H 33 9.110 9.110 8.828 0.282 26060 8916 1 13 . 1 1 34 34 ASP N N 34 120.300 120.300 124.743 -4.443 26060 8917 1 13 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.460 -0.060 26060 8918 1 13 . 1 1 34 34 ASP C C 34 175.100 175.100 175.034 0.066 26060 8919 1 13 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.966 -0.656 26060 8920 1 13 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.501 -0.401 26060 8921 1 13 . 1 1 34 34 ASP H H 34 8.810 8.810 8.882 -0.072 26060 8922 1 13 . 1 1 35 35 TRP N N 35 119.800 119.800 121.071 -1.271 26060 8923 1 13 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.516 0.214 26060 8924 1 13 . 1 1 35 35 TRP C C 35 174.900 174.900 173.277 1.623 26060 8925 1 13 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.889 0.011 26060 8926 1 13 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.096 1.974 26060 8927 1 13 . 1 1 35 35 TRP H H 35 9.250 9.250 8.958 0.292 26060 8928 1 13 . 1 1 36 36 MET N N 36 120.980 120.980 121.369 -0.389 26060 8929 1 13 . 1 1 36 36 MET HA H 36 5.750 5.750 5.972 -0.222 26060 8930 1 13 . 1 1 36 36 MET C C 36 173.700 173.700 174.302 -0.602 26060 8931 1 13 . 1 1 36 36 MET CA C 36 54.830 54.830 54.298 0.532 26060 8932 1 13 . 1 1 36 36 MET CB C 36 35.220 35.220 36.773 -1.553 26060 8933 1 13 . 1 1 36 36 MET H H 36 9.080 9.080 9.063 0.017 26060 8934 1 13 . 1 1 37 37 VAL N N 37 126.220 126.220 120.980 5.240 26060 8935 1 13 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.115 0.195 26060 8936 1 13 . 1 1 37 37 VAL C C 37 172.300 172.300 174.252 -1.952 26060 8937 1 13 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.739 -1.199 26060 8938 1 13 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.814 1.256 26060 8939 1 13 . 1 1 37 37 VAL H H 37 9.080 9.080 8.751 0.329 26060 8940 1 13 . 1 1 38 38 PHE N N 38 120.640 120.640 122.011 -1.371 26060 8941 1 13 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.383 0.587 26060 8942 1 13 . 1 1 38 38 PHE C C 38 172.960 172.960 175.044 -2.084 26060 8943 1 13 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.746 -0.616 26060 8944 1 13 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.519 -0.519 26060 8945 1 13 . 1 1 38 38 PHE H H 38 8.320 8.320 9.023 -0.703 26060 8946 1 13 . 1 1 39 39 VAL N N 39 116.500 116.500 120.990 -4.490 26060 8947 1 13 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.696 -0.686 26060 8948 1 13 . 1 1 39 39 VAL C C 39 174.700 174.700 174.430 0.270 26060 8949 1 13 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.886 1.754 26060 8950 1 13 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.875 1.525 26060 8951 1 13 . 1 1 39 39 VAL H H 39 8.580 8.580 9.367 -0.787 26060 8952 1 13 . 1 1 40 40 ARG N N 40 124.100 124.100 123.422 0.678 26060 8953 1 13 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.814 0.266 26060 8954 1 13 . 1 1 40 40 ARG C C 40 173.800 173.800 173.889 -0.089 26060 8955 1 13 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.260 -0.330 26060 8956 1 13 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.204 1.376 26060 8957 1 13 . 1 1 40 40 ARG H H 40 9.880 9.880 8.481 1.399 26060 8958 1 13 . 1 1 41 41 GLY N N 41 107.640 107.640 106.661 0.979 26060 8959 1 13 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.521 1.449 26060 8960 1 13 . 1 1 41 41 GLY H H 41 8.910 8.910 8.576 0.334 26060 8961 1 13 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.503 -0.013 26060 8962 1 13 . 1 1 42 42 PRO C C 42 177.300 177.300 176.629 0.671 26060 8963 1 13 . 1 1 42 42 PRO CA C 42 62.440 62.440 61.908 0.532 26060 8964 1 13 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.781 -0.671 26060 8965 1 13 . 1 1 43 43 GLU N N 43 121.050 121.050 120.272 0.778 26060 8966 1 13 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.101 -0.311 26060 8967 1 13 . 1 1 43 43 GLU C C 43 176.110 176.110 177.329 -1.219 26060 8968 1 13 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.798 -0.948 26060 8969 1 13 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.955 -1.105 26060 8970 1 13 . 1 1 43 43 GLU H H 43 9.060 9.060 8.778 0.282 26060 8971 1 13 . 1 1 44 44 HIS N N 44 114.100 114.100 117.477 -3.377 26060 8972 1 13 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.304 0.047 26060 8973 1 13 . 1 1 44 44 HIS C C 44 175.170 175.170 174.473 0.697 26060 8974 1 13 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.412 0.238 26060 8975 1 13 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.777 -0.407 26060 8976 1 13 . 1 1 44 44 HIS H H 44 8.420 8.420 8.735 -0.315 26060 8977 1 13 . 1 1 45 45 SER N N 45 115.540 115.540 116.665 -1.125 26060 8978 1 13 . 1 1 45 45 SER HA H 45 4.560 4.560 4.531 0.029 26060 8979 1 13 . 1 1 45 45 SER C C 45 173.700 173.700 174.134 -0.434 26060 8980 1 13 . 1 1 45 45 SER CA C 45 58.710 58.710 57.102 1.609 26060 8981 1 13 . 1 1 45 45 SER CB C 45 65.040 65.040 63.798 1.242 26060 8982 1 13 . 1 1 45 45 SER H H 45 7.870 7.870 7.697 0.173 26060 8983 1 13 . 1 1 46 46 ASN N N 46 123.900 123.900 124.539 -0.639 26060 8984 1 13 . 1 1 46 46 ASN HA H 46 5.120 5.120 5.039 0.081 26060 8985 1 13 . 1 1 46 46 ASN C C 46 176.300 176.300 175.565 0.735 26060 8986 1 13 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.610 0.080 26060 8987 1 13 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.825 -2.095 26060 8988 1 13 . 1 1 46 46 ASN H H 46 9.480 9.480 8.675 0.805 26060 8989 1 13 . 1 1 47 47 ILE N N 47 115.240 115.240 122.129 -6.889 26060 8990 1 13 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.272 0.668 26060 8991 1 13 . 1 1 47 47 ILE C C 47 176.000 176.000 176.729 -0.729 26060 8992 1 13 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.135 0.065 26060 8993 1 13 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.061 -1.361 26060 8994 1 13 . 1 1 47 47 ILE H H 47 8.170 8.170 8.669 -0.499 26060 8995 1 13 . 1 1 48 48 GLN N N 48 123.200 123.200 120.358 2.842 26060 8996 1 13 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.125 0.155 26060 8997 1 13 . 1 1 48 48 GLN C C 48 175.670 175.670 177.269 -1.599 26060 8998 1 13 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.345 -0.445 26060 8999 1 13 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.521 -0.531 26060 9000 1 13 . 1 1 48 48 GLN H H 48 8.850 8.850 8.701 0.149 26060 9001 1 13 . 1 1 49 49 HIS N N 49 115.400 115.400 117.613 -2.213 26060 9002 1 13 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.407 0.163 26060 9003 1 13 . 1 1 49 49 HIS C C 49 176.380 176.380 176.800 -0.420 26060 9004 1 13 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.884 -0.134 26060 9005 1 13 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.655 0.965 26060 9006 1 13 . 1 1 49 49 HIS H H 49 7.400 7.400 7.475 -0.075 26060 9007 1 13 . 1 1 50 50 PHE N N 50 109.800 109.800 112.693 -2.893 26060 9008 1 13 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.947 0.283 26060 9009 1 13 . 1 1 50 50 PHE C C 50 173.800 173.800 174.247 -0.447 26060 9010 1 13 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.533 0.127 26060 9011 1 13 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.837 1.163 26060 9012 1 13 . 1 1 50 50 PHE H H 50 7.570 7.570 7.499 0.071 26060 9013 1 13 . 1 1 51 51 VAL N N 51 127.810 127.810 121.543 6.267 26060 9014 1 13 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.836 -0.466 26060 9015 1 13 . 1 1 51 51 VAL C C 51 174.500 174.500 175.048 -0.548 26060 9016 1 13 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.672 1.328 26060 9017 1 13 . 1 1 51 51 VAL CB C 51 33.280 33.280 33.762 -0.482 26060 9018 1 13 . 1 1 51 51 VAL H H 51 7.810 7.810 8.204 -0.394 26060 9019 1 13 . 1 1 52 52 GLU N N 52 130.700 130.700 128.739 1.961 26060 9020 1 13 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.299 -0.319 26060 9021 1 13 . 1 1 52 52 GLU C C 52 175.400 175.400 176.153 -0.753 26060 9022 1 13 . 1 1 52 52 GLU CA C 52 58.100 58.100 58.203 -0.103 26060 9023 1 13 . 1 1 52 52 GLU CB C 52 31.580 31.580 30.899 0.681 26060 9024 1 13 . 1 1 52 52 GLU H H 52 9.380 9.380 8.939 0.441 26060 9025 1 13 . 1 1 53 53 LYS N N 53 109.200 109.200 113.620 -4.420 26060 9026 1 13 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.770 0.030 26060 9027 1 13 . 1 1 53 53 LYS C C 53 172.300 172.300 174.168 -1.868 26060 9028 1 13 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.771 0.069 26060 9029 1 13 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.642 -1.392 26060 9030 1 13 . 1 1 53 53 LYS H H 53 7.190 7.190 7.406 -0.216 26060 9031 1 13 . 1 1 54 54 VAL N N 54 120.380 120.380 117.562 2.818 26060 9032 1 13 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.596 0.174 26060 9033 1 13 . 1 1 54 54 VAL C C 54 173.600 173.600 173.842 -0.242 26060 9034 1 13 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.387 -0.347 26060 9035 1 13 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.602 -1.902 26060 9036 1 13 . 1 1 54 54 VAL H H 54 8.450 8.450 8.300 0.150 26060 9037 1 13 . 1 1 55 55 VAL N N 55 126.920 126.920 122.672 4.248 26060 9038 1 13 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.824 -0.124 26060 9039 1 13 . 1 1 55 55 VAL C C 55 173.800 173.800 173.726 0.074 26060 9040 1 13 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.827 0.043 26060 9041 1 13 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.964 -2.864 26060 9042 1 13 . 1 1 55 55 VAL H H 55 9.260 9.260 9.019 0.241 26060 9043 1 13 . 1 1 56 56 PHE N N 56 126.130 126.130 123.808 2.322 26060 9044 1 13 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.986 -0.296 26060 9045 1 13 . 1 1 56 56 PHE C C 56 174.000 174.000 174.258 -0.258 26060 9046 1 13 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.777 -0.197 26060 9047 1 13 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.543 -1.653 26060 9048 1 13 . 1 1 56 56 PHE H H 56 9.290 9.290 8.686 0.604 26060 9049 1 13 . 1 1 57 57 HIS N N 57 124.180 124.180 124.045 0.135 26060 9050 1 13 . 1 1 57 57 HIS HA H 57 4.800 4.800 5.000 -0.200 26060 9051 1 13 . 1 1 57 57 HIS C C 57 174.700 174.700 174.950 -0.250 26060 9052 1 13 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.151 0.169 26060 9053 1 13 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.950 1.150 26060 9054 1 13 . 1 1 57 57 HIS H H 57 8.690 8.690 8.485 0.205 26060 9055 1 13 . 1 1 58 58 LEU N N 58 122.050 122.050 123.534 -1.484 26060 9056 1 13 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.293 -0.053 26060 9057 1 13 . 1 1 58 58 LEU C C 58 174.400 174.400 176.969 -2.569 26060 9058 1 13 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.937 0.473 26060 9059 1 13 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.303 -1.143 26060 9060 1 13 . 1 1 58 58 LEU H H 58 9.050 9.050 8.310 0.740 26060 9061 1 13 . 1 1 59 59 HIS N N 59 118.510 118.510 118.147 0.363 26060 9062 1 13 . 1 1 59 59 HIS C C 59 175.300 175.300 176.577 -1.277 26060 9063 1 13 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.754 2.357 26060 9064 1 13 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.420 0.510 26060 9065 1 13 . 1 1 59 59 HIS H H 59 5.160 5.160 7.810 -2.650 26060 9066 1 13 . 1 1 60 60 GLU N N 60 122.190 122.190 126.040 -3.850 26060 9067 1 13 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.043 -0.083 26060 9068 1 13 . 1 1 60 60 GLU C C 60 175.130 175.130 176.915 -1.785 26060 9069 1 13 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.182 -0.172 26060 9070 1 13 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.409 0.411 26060 9071 1 13 . 1 1 60 60 GLU H H 60 7.960 7.960 8.505 -0.545 26060 9072 1 13 . 1 1 61 61 SER N N 61 116.940 116.940 113.229 3.711 26060 9073 1 13 . 1 1 61 61 SER HA H 61 4.200 4.200 4.380 -0.180 26060 9074 1 13 . 1 1 61 61 SER CA C 61 60.010 60.010 59.803 0.207 26060 9075 1 13 . 1 1 61 61 SER CB C 61 63.140 63.140 63.646 -0.506 26060 9076 1 13 . 1 1 61 61 SER H H 61 8.540 8.540 8.245 0.295 26060 9077 1 13 . 1 1 62 62 PHE N N 62 123.700 123.700 122.734 0.966 26060 9078 1 13 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.684 -0.134 26060 9079 1 13 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.448 2.492 26060 9080 1 13 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.886 -0.486 26060 9081 1 13 . 1 1 62 62 PHE H H 62 8.640 8.640 8.123 0.517 26060 9082 1 13 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.478 -0.068 26060 9083 1 13 . 1 1 63 63 PRO C C 63 176.400 176.400 176.011 0.389 26060 9084 1 13 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.321 -0.721 26060 9085 1 13 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.141 -0.281 26060 9086 1 13 . 1 1 64 64 ARG N N 64 116.840 116.840 120.220 -3.380 26060 9087 1 13 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.109 -0.009 26060 9088 1 13 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.063 -0.453 26060 9089 1 13 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.658 0.172 26060 9090 1 13 . 1 1 64 64 ARG H H 64 8.890 8.890 8.621 0.269 26060 9091 1 13 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.463 -0.473 26060 9092 1 13 . 1 1 65 65 PRO C C 65 175.800 175.800 176.912 -1.112 26060 9093 1 13 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.811 1.999 26060 9094 1 13 . 1 1 65 65 PRO CB C 65 31.880 31.880 32.102 -0.223 26060 9095 1 13 . 1 1 66 66 LYS N N 66 119.035 119.035 120.506 -1.471 26060 9096 1 13 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.048 -0.438 26060 9097 1 13 . 1 1 66 66 LYS C C 66 175.400 175.400 175.814 -0.414 26060 9098 1 13 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.355 0.098 26060 9099 1 13 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.143 -0.413 26060 9100 1 13 . 1 1 66 66 LYS H H 66 7.630 7.630 7.939 -0.309 26060 9101 1 13 . 1 1 67 67 ARG N N 67 127.394 127.394 127.775 -0.381 26060 9102 1 13 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.595 0.145 26060 9103 1 13 . 1 1 67 67 ARG C C 67 174.500 174.500 175.062 -0.562 26060 9104 1 13 . 1 1 67 67 ARG CA C 67 52.800 52.800 53.002 -0.202 26060 9105 1 13 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.512 -0.798 26060 9106 1 13 . 1 1 67 67 ARG H H 67 8.855 8.855 8.709 0.146 26060 9107 1 13 . 1 1 68 68 VAL N N 68 124.388 124.388 119.918 4.470 26060 9108 1 13 . 1 1 68 68 VAL HA H 68 4.580 4.580 4.793 -0.213 26060 9109 1 13 . 1 1 68 68 VAL C C 68 176.850 176.850 175.405 1.445 26060 9110 1 13 . 1 1 68 68 VAL CA C 68 62.073 62.073 60.157 1.916 26060 9111 1 13 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.372 0.232 26060 9112 1 13 . 1 1 68 68 VAL H H 68 8.681 8.681 8.429 0.252 26060 9113 1 13 . 1 1 69 69 CYS N N 69 127.080 127.080 126.556 0.524 26060 9114 1 13 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.709 0.361 26060 9115 1 13 . 1 1 69 69 CYS CA C 69 58.346 58.346 58.574 -0.228 26060 9116 1 13 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.702 1.068 26060 9117 1 13 . 1 1 69 69 CYS H H 69 9.455 9.455 8.941 0.514 26060 9118 1 13 . 1 1 70 70 LYS N N 70 125.480 125.480 123.631 1.849 26060 9119 1 13 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.512 -0.022 26060 9120 1 13 . 1 1 70 70 LYS C C 70 174.300 174.300 175.544 -1.244 26060 9121 1 13 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.333 1.427 26060 9122 1 13 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.284 -0.114 26060 9123 1 13 . 1 1 70 70 LYS H H 70 9.050 9.050 8.758 0.292 26060 9124 1 13 . 1 1 71 71 ASP N N 71 116.940 116.940 120.140 -3.200 26060 9125 1 13 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.763 0.337 26060 9126 1 13 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.872 -0.792 26060 9127 1 13 . 1 1 71 71 ASP CB C 71 43.380 43.380 40.837 2.542 26060 9128 1 13 . 1 1 71 71 ASP H H 71 7.620 7.620 7.600 0.020 26060 9129 1 13 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.136 -0.876 26060 9130 1 13 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.810 -2.160 26060 9131 1 13 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.956 -0.916 26060 9132 1 13 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.186 -0.086 26060 9133 1 13 . 1 1 73 73 PRO C C 73 174.700 174.700 176.312 -1.612 26060 9134 1 13 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.297 -2.607 26060 9135 1 13 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.110 2.929 26060 9136 1 13 . 1 1 74 74 TYR N N 74 125.400 125.400 125.167 0.233 26060 9137 1 13 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.553 0.297 26060 9138 1 13 . 1 1 74 74 TYR C C 74 172.900 172.900 175.268 -2.368 26060 9139 1 13 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.971 -2.301 26060 9140 1 13 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.825 -3.425 26060 9141 1 13 . 1 1 74 74 TYR H H 74 8.960 8.960 8.341 0.619 26060 9142 1 13 . 1 1 75 75 LYS N N 75 121.400 121.400 119.619 1.781 26060 9143 1 13 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.084 0.506 26060 9144 1 13 . 1 1 75 75 LYS C C 75 173.800 173.800 174.184 -0.384 26060 9145 1 13 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.543 0.107 26060 9146 1 13 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.511 -0.621 26060 9147 1 13 . 1 1 75 75 LYS H H 75 7.670 7.670 8.029 -0.359 26060 9148 1 13 . 1 1 76 76 VAL N N 76 119.800 119.800 121.201 -1.401 26060 9149 1 13 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.156 -0.266 26060 9150 1 13 . 1 1 76 76 VAL C C 76 173.900 173.900 174.452 -0.552 26060 9151 1 13 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.173 1.557 26060 9152 1 13 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.816 0.724 26060 9153 1 13 . 1 1 76 76 VAL H H 76 8.180 8.180 7.746 0.434 26060 9154 1 13 . 1 1 77 77 GLU N N 77 126.190 126.190 127.835 -1.645 26060 9155 1 13 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.986 -0.036 26060 9156 1 13 . 1 1 77 77 GLU C C 77 174.700 174.700 174.945 -0.245 26060 9157 1 13 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.232 -0.292 26060 9158 1 13 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.147 0.403 26060 9159 1 13 . 1 1 77 77 GLU H H 77 8.270 8.270 8.556 -0.286 26060 9160 1 13 . 1 1 78 78 GLU N N 78 126.180 126.180 122.901 3.279 26060 9161 1 13 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.624 -0.174 26060 9162 1 13 . 1 1 78 78 GLU C C 78 175.400 175.400 173.932 1.468 26060 9163 1 13 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.093 -0.051 26060 9164 1 13 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.938 3.162 26060 9165 1 13 . 1 1 78 78 GLU H H 78 7.870 7.870 8.311 -0.441 26060 9166 1 13 . 1 1 79 79 SER N N 79 112.109 112.109 113.329 -1.220 26060 9167 1 13 . 1 1 79 79 SER HA H 79 5.560 5.560 5.391 0.169 26060 9168 1 13 . 1 1 79 79 SER C C 79 172.490 172.490 173.263 -0.773 26060 9169 1 13 . 1 1 79 79 SER CA C 79 57.754 57.754 56.315 1.439 26060 9170 1 13 . 1 1 79 79 SER CB C 79 65.861 65.861 65.424 0.437 26060 9171 1 13 . 1 1 79 79 SER H H 79 7.714 7.714 8.291 -0.577 26060 9172 1 13 . 1 1 80 80 GLY N N 80 106.048 106.048 109.470 -3.422 26060 9173 1 13 . 1 1 80 80 GLY C C 80 172.630 172.630 171.907 0.723 26060 9174 1 13 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.707 0.863 26060 9175 1 13 . 1 1 80 80 GLY H H 80 8.828 8.828 8.963 -0.135 26060 9176 1 13 . 1 1 81 81 TYR N N 81 115.280 115.280 114.256 1.024 26060 9177 1 13 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.301 0.379 26060 9178 1 13 . 1 1 81 81 TYR C C 81 174.100 174.100 173.988 0.112 26060 9179 1 13 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.084 -1.584 26060 9180 1 13 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.290 2.050 26060 9181 1 13 . 1 1 81 81 TYR H H 81 8.770 8.770 8.132 0.638 26060 9182 1 13 . 1 1 82 82 ALA N N 82 122.350 122.350 122.572 -0.222 26060 9183 1 13 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.502 -0.102 26060 9184 1 13 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.761 0.279 26060 9185 1 13 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.144 1.256 26060 9186 1 13 . 1 1 82 82 ALA H H 82 7.160 7.160 7.384 -0.224 26060 9187 1 13 . 1 1 83 83 GLY N N 83 107.100 107.100 106.659 0.441 26060 9188 1 13 . 1 1 83 83 GLY C C 83 172.500 172.500 173.492 -0.992 26060 9189 1 13 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.011 0.599 26060 9190 1 13 . 1 1 83 83 GLY H H 83 8.220 8.220 8.199 0.021 26060 9191 1 13 . 1 1 84 84 PHE N N 84 111.660 111.660 117.417 -5.757 26060 9192 1 13 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.658 0.032 26060 9193 1 13 . 1 1 84 84 PHE C C 84 172.460 172.460 173.605 -1.145 26060 9194 1 13 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.484 0.016 26060 9195 1 13 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.948 -1.368 26060 9196 1 13 . 1 1 84 84 PHE H H 84 7.700 7.700 8.250 -0.550 26060 9197 1 13 . 1 1 85 85 ILE N N 85 117.810 117.810 121.517 -3.707 26060 9198 1 13 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.106 0.204 26060 9199 1 13 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.323 -1.983 26060 9200 1 13 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.293 -2.033 26060 9201 1 13 . 1 1 85 85 ILE H H 85 8.340 8.340 8.634 -0.294 26060 9202 1 13 . 1 1 86 86 LEU N N 86 108.130 108.130 129.357 -21.227 26060 9203 1 13 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.073 -0.093 26060 9204 1 13 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.110 2.090 26060 9205 1 13 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.942 -0.642 26060 9206 1 13 . 1 1 86 86 LEU H H 86 9.900 9.900 8.922 0.978 26060 9207 1 13 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.488 0.612 26060 9208 1 13 . 1 1 87 87 PRO C C 87 175.340 175.340 175.838 -0.498 26060 9209 1 13 . 1 1 87 87 PRO CA C 87 63.110 63.110 63.023 0.087 26060 9210 1 13 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.613 0.947 26060 9211 1 13 . 1 1 88 88 ILE N N 88 126.000 126.000 125.946 0.054 26060 9212 1 13 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.229 0.561 26060 9213 1 13 . 1 1 88 88 ILE C C 88 176.100 176.100 175.025 1.075 26060 9214 1 13 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.373 0.187 26060 9215 1 13 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.062 1.938 26060 9216 1 13 . 1 1 88 88 ILE H H 88 9.380 9.380 8.844 0.536 26060 9217 1 13 . 1 1 89 89 GLU N N 89 123.900 123.900 125.248 -1.348 26060 9218 1 13 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.228 -0.028 26060 9219 1 13 . 1 1 89 89 GLU C C 89 173.800 173.800 175.488 -1.688 26060 9220 1 13 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.436 -0.466 26060 9221 1 13 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.292 1.088 26060 9222 1 13 . 1 1 89 89 GLU H H 89 9.320 9.320 8.916 0.404 26060 9223 1 13 . 1 1 90 90 VAL N N 90 123.980 123.980 123.687 0.293 26060 9224 1 13 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.171 -0.011 26060 9225 1 13 . 1 1 90 90 VAL C C 90 174.800 174.800 174.681 0.119 26060 9226 1 13 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.184 0.806 26060 9227 1 13 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.956 0.534 26060 9228 1 13 . 1 1 90 90 VAL H H 90 8.630 8.630 8.310 0.320 26060 9229 1 13 . 1 1 91 91 TYR N N 91 124.230 124.230 127.584 -3.354 26060 9230 1 13 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.425 0.235 26060 9231 1 13 . 1 1 91 91 TYR C C 91 176.800 176.800 175.742 1.058 26060 9232 1 13 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.865 -1.165 26060 9233 1 13 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.698 1.542 26060 9234 1 13 . 1 1 91 91 TYR H H 91 8.640 8.640 8.945 -0.305 26060 9235 1 13 . 1 1 92 92 PHE N N 92 121.200 121.200 123.060 -1.860 26060 9236 1 13 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.267 0.393 26060 9237 1 13 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.343 1.167 26060 9238 1 13 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.712 0.988 26060 9239 1 13 . 1 1 92 92 PHE H H 92 8.750 8.750 8.952 -0.202 26060 9240 1 13 . 1 1 93 93 LYS N N 93 123.450 123.450 122.378 1.072 26060 9241 1 13 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.733 -0.133 26060 9242 1 13 . 1 1 93 93 LYS C C 93 174.200 174.200 175.298 -1.098 26060 9243 1 13 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.641 -0.461 26060 9244 1 13 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.506 -0.826 26060 9245 1 13 . 1 1 93 93 LYS H H 93 8.560 8.560 9.089 -0.529 26060 9246 1 13 . 1 1 94 94 ASN N N 94 118.800 118.800 122.112 -3.312 26060 9247 1 13 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.804 -0.364 26060 9248 1 13 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.573 -1.363 26060 9249 1 13 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.582 -1.782 26060 9250 1 13 . 1 1 94 94 ASN H H 94 7.820 7.820 8.350 -0.530 26060 9251 1 13 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.323 0.007 26060 9252 1 13 . 1 1 95 95 LYS C C 95 175.800 175.800 175.930 -0.130 26060 9253 1 13 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.846 -0.637 26060 9254 1 13 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.019 -0.009 26060 9255 1 13 . 1 1 96 96 GLU N N 96 118.330 118.330 120.250 -1.920 26060 9256 1 13 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.282 0.228 26060 9257 1 13 . 1 1 96 96 GLU C C 96 173.200 173.200 175.593 -2.393 26060 9258 1 13 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.436 -1.336 26060 9259 1 13 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.285 2.185 26060 9260 1 13 . 1 1 96 96 GLU H H 96 7.120 7.120 7.787 -0.667 26060 9261 1 13 . 1 1 97 97 GLU N N 97 115.630 115.630 120.268 -4.638 26060 9262 1 13 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.128 0.302 26060 9263 1 13 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.814 -0.954 26060 9264 1 13 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.541 0.729 26060 9265 1 13 . 1 1 97 97 GLU H H 97 8.060 8.060 8.225 -0.165 26060 9266 1 13 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.224 0.776 26060 9267 1 13 . 1 1 98 98 PRO C C 98 175.900 175.900 176.391 -0.491 26060 9268 1 13 . 1 1 98 98 PRO CA C 98 62.160 62.160 63.898 -1.738 26060 9269 1 13 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.159 1.841 26060 9270 1 13 . 1 1 99 99 ARG N N 99 122.800 122.800 119.543 3.257 26060 9271 1 13 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.370 0.260 26060 9272 1 13 . 1 1 99 99 ARG C C 99 175.800 175.800 175.582 0.218 26060 9273 1 13 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.316 0.174 26060 9274 1 13 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.539 -0.129 26060 9275 1 13 . 1 1 99 99 ARG H H 99 8.602 8.602 8.647 -0.045 26060 9276 1 13 . 1 1 100 100 LYS N N 100 113.220 113.220 116.793 -3.573 26060 9277 1 13 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.339 0.601 26060 9278 1 13 . 1 1 100 100 LYS C C 100 174.100 174.100 174.235 -0.135 26060 9279 1 13 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.424 -0.514 26060 9280 1 13 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.522 -0.802 26060 9281 1 13 . 1 1 100 100 LYS H H 100 7.650 7.650 7.418 0.232 26060 9282 1 13 . 1 1 101 101 VAL N N 101 116.230 116.230 120.736 -4.506 26060 9283 1 13 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.225 0.045 26060 9284 1 13 . 1 1 101 101 VAL C C 101 171.600 171.600 173.601 -2.001 26060 9285 1 13 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.423 0.837 26060 9286 1 13 . 1 1 101 101 VAL CB C 101 35.180 35.180 34.995 0.185 26060 9287 1 13 . 1 1 101 101 VAL H H 101 8.120 8.120 7.976 0.144 26060 9288 1 13 . 1 1 102 102 ARG N N 102 124.980 124.980 127.491 -2.511 26060 9289 1 13 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.856 0.304 26060 9290 1 13 . 1 1 102 102 ARG C C 102 174.340 174.340 175.107 -0.767 26060 9291 1 13 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.472 -0.722 26060 9292 1 13 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.431 1.919 26060 9293 1 13 . 1 1 102 102 ARG H H 102 7.930 7.930 8.346 -0.416 26060 9294 1 13 . 1 1 103 103 PHE N N 103 124.590 124.590 126.550 -1.960 26060 9295 1 13 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.756 0.036 26060 9296 1 13 . 1 1 103 103 PHE C C 103 174.280 174.280 174.709 -0.429 26060 9297 1 13 . 1 1 103 103 PHE CA C 103 55.980 55.980 55.021 0.959 26060 9298 1 13 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.994 2.256 26060 9299 1 13 . 1 1 103 103 PHE H H 103 9.390 9.390 9.118 0.272 26060 9300 1 13 . 1 1 104 104 ASP N N 104 124.700 124.700 126.768 -2.068 26060 9301 1 13 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.614 0.185 26060 9302 1 13 . 1 1 104 104 ASP C C 104 174.500 174.500 174.927 -0.427 26060 9303 1 13 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.770 -0.380 26060 9304 1 13 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.915 0.315 26060 9305 1 13 . 1 1 104 104 ASP H H 104 9.010 9.010 8.956 0.054 26060 9306 1 13 . 1 1 105 105 TYR N N 105 129.840 129.840 125.399 4.441 26060 9307 1 13 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.505 -0.405 26060 9308 1 13 . 1 1 105 105 TYR C C 105 173.100 173.100 174.011 -0.911 26060 9309 1 13 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.786 0.894 26060 9310 1 13 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.802 1.048 26060 9311 1 13 . 1 1 105 105 TYR H H 105 8.140 8.140 8.310 -0.170 26060 9312 1 13 . 1 1 106 106 ASP N N 106 126.800 126.800 127.986 -1.186 26060 9313 1 13 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.448 -0.228 26060 9314 1 13 . 1 1 106 106 ASP C C 106 172.900 172.900 174.651 -1.751 26060 9315 1 13 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.463 0.047 26060 9316 1 13 . 1 1 106 106 ASP CB C 106 39.500 39.500 40.844 -1.344 26060 9317 1 13 . 1 1 106 106 ASP H H 106 7.730 7.730 8.214 -0.484 26060 9318 1 13 . 1 1 107 107 LEU N N 107 132.150 132.150 128.437 3.713 26060 9319 1 13 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.597 -0.757 26060 9320 1 13 . 1 1 107 107 LEU C C 107 172.100 172.100 174.844 -2.744 26060 9321 1 13 . 1 1 107 107 LEU CA C 107 53.700 53.700 54.013 -0.313 26060 9322 1 13 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.588 -2.348 26060 9323 1 13 . 1 1 107 107 LEU H H 107 7.770 7.770 7.653 0.117 26060 9324 1 13 . 1 1 108 108 PHE N N 108 118.960 118.960 121.900 -2.940 26060 9325 1 13 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.879 -0.189 26060 9326 1 13 . 1 1 108 108 PHE C C 108 174.300 174.300 173.302 0.998 26060 9327 1 13 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.337 -0.647 26060 9328 1 13 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.542 -1.252 26060 9329 1 13 . 1 1 108 108 PHE H H 108 6.060 6.060 7.279 -1.219 26060 9330 1 13 . 1 1 109 109 LEU N N 109 118.900 118.900 121.793 -2.893 26060 9331 1 13 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.691 -0.291 26060 9332 1 13 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.321 -1.161 26060 9333 1 13 . 1 1 109 109 LEU CB C 109 43.080 43.080 45.157 -2.077 26060 9334 1 13 . 1 1 109 109 LEU H H 109 8.388 8.388 8.287 0.101 26060 9335 1 13 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.511 -0.071 26060 9336 1 13 . 1 1 111 111 LEU C C 111 177.300 177.300 177.444 -0.144 26060 9337 1 13 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.076 -0.856 26060 9338 1 13 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.997 0.873 26060 9339 1 13 . 1 1 112 112 GLU N N 112 120.660 120.660 120.661 -0.001 26060 9340 1 13 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.107 0.063 26060 9341 1 13 . 1 1 112 112 GLU CA C 112 58.460 58.460 57.725 0.735 26060 9342 1 13 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.401 0.289 26060 9343 1 13 . 1 1 112 112 GLU H H 112 8.780 8.780 8.784 -0.004 26060 9344 1 13 . 1 1 113 113 GLY C C 113 173.900 173.900 174.096 -0.196 26060 9345 1 13 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.876 0.074 26060 9346 1 13 . 1 1 114 114 HIS N N 114 120.890 120.890 120.501 0.389 26060 9347 1 13 . 1 1 114 114 HIS HA H 114 4.906 4.906 4.921 -0.015 26060 9348 1 13 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.111 0.659 26060 9349 1 13 . 1 1 114 114 HIS CB C 114 30.590 30.590 32.497 -1.907 26060 9350 1 13 . 1 1 114 114 HIS H H 114 7.934 7.934 7.886 0.048 26060 9351 1 13 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.350 0.450 26060 9352 1 13 . 1 1 115 115 PRO CA C 115 62.090 62.090 63.009 -0.919 26060 9353 1 13 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.282 -0.602 26060 9354 1 13 . 1 1 116 116 PRO C C 116 176.600 176.600 176.507 0.093 26060 9355 1 13 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.457 -0.157 26060 9356 1 13 . 1 1 117 117 VAL N N 117 127.480 127.480 119.754 7.726 26060 9357 1 13 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.164 -0.374 26060 9358 1 13 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.447 1.253 26060 9359 1 13 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.206 -0.006 26060 9360 1 13 . 1 1 117 117 VAL H H 117 8.890 8.890 8.398 0.492 26060 9361 1 13 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.982 0.008 26060 9362 1 13 . 1 1 118 118 ASN C C 118 172.700 172.700 173.559 -0.859 26060 9363 1 13 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.183 0.177 26060 9364 1 13 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.951 -0.751 26060 9365 1 13 . 1 1 119 119 HIS N N 119 124.930 124.930 126.147 -1.217 26060 9366 1 13 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.046 -0.226 26060 9367 1 13 . 1 1 119 119 HIS C C 119 173.500 173.500 172.786 0.714 26060 9368 1 13 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.159 1.811 26060 9369 1 13 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.124 0.546 26060 9370 1 13 . 1 1 119 119 HIS H H 119 8.790 8.790 8.846 -0.056 26060 9371 1 13 . 1 1 120 120 LEU N N 120 128.280 128.280 123.127 5.153 26060 9372 1 13 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.176 -0.226 26060 9373 1 13 . 1 1 120 120 LEU C C 120 174.030 174.030 174.729 -0.699 26060 9374 1 13 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.463 0.977 26060 9375 1 13 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.500 0.100 26060 9376 1 13 . 1 1 120 120 LEU H H 120 7.460 7.460 8.036 -0.576 26060 9377 1 13 . 1 1 121 121 ARG N N 121 128.060 128.060 121.819 6.241 26060 9378 1 13 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.533 0.107 26060 9379 1 13 . 1 1 121 121 ARG C C 121 173.400 173.400 173.373 0.027 26060 9380 1 13 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.714 -0.354 26060 9381 1 13 . 1 1 121 121 ARG CB C 121 34.260 34.260 33.462 0.797 26060 9382 1 13 . 1 1 121 121 ARG H H 121 9.860 9.860 9.065 0.795 26060 9383 1 13 . 1 1 122 122 CYS N N 122 125.290 125.290 124.970 0.320 26060 9384 1 13 . 1 1 122 122 CYS HA H 122 5.020 5.020 4.657 0.363 26060 9385 1 13 . 1 1 122 122 CYS C C 122 174.600 174.600 175.210 -0.610 26060 9386 1 13 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.794 0.496 26060 9387 1 13 . 1 1 122 122 CYS CB C 122 28.030 28.030 26.984 1.046 26060 9388 1 13 . 1 1 122 122 CYS H H 122 8.835 8.835 8.645 0.190 26060 9389 1 13 . 1 1 123 123 GLU N N 123 125.920 125.920 124.977 0.943 26060 9390 1 13 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.456 0.224 26060 9391 1 13 . 1 1 123 123 GLU C C 123 174.500 174.500 175.034 -0.534 26060 9392 1 13 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.871 -0.451 26060 9393 1 13 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.637 0.946 26060 9394 1 13 . 1 1 123 123 GLU H H 123 8.970 8.970 9.085 -0.115 26060 9395 1 13 . 1 1 124 124 LYS N N 124 121.837 121.837 122.012 -0.175 26060 9396 1 13 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.864 0.096 26060 9397 1 13 . 1 1 124 124 LYS C C 124 175.700 175.700 175.673 0.027 26060 9398 1 13 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.109 0.248 26060 9399 1 13 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.340 -0.151 26060 9400 1 13 . 1 1 124 124 LYS H H 124 8.652 8.652 8.388 0.264 26060 9401 1 13 . 1 1 125 125 LEU N N 125 127.000 127.000 129.872 -2.872 26060 9402 1 13 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.611 0.039 26060 9403 1 13 . 1 1 125 125 LEU C C 125 175.110 175.110 175.393 -0.283 26060 9404 1 13 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.834 0.020 26060 9405 1 13 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.498 0.768 26060 9406 1 13 . 1 1 125 125 LEU H H 125 9.175 9.175 9.192 -0.017 26060 9407 1 13 . 1 1 126 126 THR N N 126 117.779 117.779 120.008 -2.229 26060 9408 1 13 . 1 1 126 126 THR HA H 126 4.650 4.650 4.396 0.254 26060 9409 1 13 . 1 1 126 126 THR C C 126 173.200 173.200 173.534 -0.334 26060 9410 1 13 . 1 1 126 126 THR CA C 126 62.036 62.036 61.492 0.544 26060 9411 1 13 . 1 1 126 126 THR CB C 126 70.284 70.284 69.066 1.218 26060 9412 1 13 . 1 1 126 126 THR H H 126 8.331 8.331 8.438 -0.107 26060 9413 1 13 . 1 1 127 127 PHE N N 127 126.576 126.576 127.099 -0.523 26060 9414 1 13 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.641 -0.051 26060 9415 1 13 . 1 1 127 127 PHE C C 127 174.860 174.860 174.640 0.220 26060 9416 1 13 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.780 0.084 26060 9417 1 13 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.465 -0.465 26060 9418 1 13 . 1 1 127 127 PHE H H 127 9.051 9.051 8.543 0.508 26060 9419 1 13 . 1 1 128 128 ASN N N 128 123.040 123.040 123.894 -0.854 26060 9420 1 13 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.701 -0.081 26060 9421 1 13 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.069 0.411 26060 9422 1 13 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.730 0.730 26060 9423 1 13 . 1 1 128 128 ASN H H 128 8.880 8.880 8.812 0.068 26060 9424 1 13 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.526 0.234 26060 9425 1 13 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.479 -0.579 26060 9426 1 13 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.390 1.340 26060 9427 1 13 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.641 0.149 26060 9428 1 13 . 1 1 130 130 PRO C C 130 177.470 177.470 176.854 0.616 26060 9429 1 13 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.475 0.099 26060 9430 1 13 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.703 -0.393 26060 9431 1 13 . 1 1 131 131 THR N N 131 113.400 113.400 115.242 -1.842 26060 9432 1 13 . 1 1 131 131 THR HA H 131 4.300 4.300 4.160 0.140 26060 9433 1 13 . 1 1 131 131 THR C C 131 175.200 175.200 176.168 -0.968 26060 9434 1 13 . 1 1 131 131 THR CA C 131 62.200 62.200 61.762 0.438 26060 9435 1 13 . 1 1 131 131 THR CB C 131 70.600 70.600 70.481 0.119 26060 9436 1 13 . 1 1 131 131 THR H H 131 8.950 8.950 8.281 0.669 26060 9437 1 13 . 1 1 132 132 GLU N N 132 122.199 122.199 125.416 -3.217 26060 9438 1 13 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.970 0.040 26060 9439 1 13 . 1 1 132 132 GLU C C 132 178.700 178.700 178.288 0.412 26060 9440 1 13 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.304 -0.010 26060 9441 1 13 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.645 -0.485 26060 9442 1 13 . 1 1 132 132 GLU H H 132 8.932 8.932 9.002 -0.070 26060 9443 1 13 . 1 1 133 133 ASP N N 133 116.324 116.324 119.412 -3.088 26060 9444 1 13 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.374 -0.044 26060 9445 1 13 . 1 1 133 133 ASP C C 133 177.800 177.800 178.607 -0.807 26060 9446 1 13 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.739 -0.193 26060 9447 1 13 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.359 1.464 26060 9448 1 13 . 1 1 133 133 ASP H H 133 8.490 8.490 7.971 0.519 26060 9449 1 13 . 1 1 134 134 PHE N N 134 119.914 119.914 121.359 -1.445 26060 9450 1 13 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.214 0.396 26060 9451 1 13 . 1 1 134 134 PHE C C 134 177.300 177.300 177.284 0.016 26060 9452 1 13 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.834 -0.296 26060 9453 1 13 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.831 0.369 26060 9454 1 13 . 1 1 134 134 PHE H H 134 7.787 7.787 7.546 0.241 26060 9455 1 13 . 1 1 135 135 ARG N N 135 119.794 119.794 120.235 -0.441 26060 9456 1 13 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.581 -0.231 26060 9457 1 13 . 1 1 135 135 ARG C C 135 177.370 177.370 178.310 -0.940 26060 9458 1 13 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.068 0.308 26060 9459 1 13 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.005 0.391 26060 9460 1 13 . 1 1 135 135 ARG H H 135 9.087 9.087 8.877 0.210 26060 9461 1 13 . 1 1 136 136 ARG N N 136 114.554 114.554 118.542 -3.988 26060 9462 1 13 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.891 -0.071 26060 9463 1 13 . 1 1 136 136 ARG C C 136 178.950 178.950 178.801 0.149 26060 9464 1 13 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.892 -0.092 26060 9465 1 13 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.117 0.100 26060 9466 1 13 . 1 1 136 136 ARG H H 136 7.747 7.747 8.378 -0.631 26060 9467 1 13 . 1 1 137 137 LYS N N 137 118.298 118.298 119.421 -1.123 26060 9468 1 13 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.971 -0.071 26060 9469 1 13 . 1 1 137 137 LYS C C 137 177.980 177.980 179.018 -1.038 26060 9470 1 13 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.613 0.782 26060 9471 1 13 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.392 0.055 26060 9472 1 13 . 1 1 137 137 LYS H H 137 7.154 7.154 7.479 -0.325 26060 9473 1 13 . 1 1 138 138 LEU N N 138 117.159 117.159 118.661 -1.502 26060 9474 1 13 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.656 -0.236 26060 9475 1 13 . 1 1 138 138 LEU C C 138 179.100 179.100 178.484 0.616 26060 9476 1 13 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.067 0.164 26060 9477 1 13 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.376 0.952 26060 9478 1 13 . 1 1 138 138 LEU H H 138 7.709 7.709 7.748 -0.039 26060 9479 1 13 . 1 1 139 139 LEU N N 139 115.158 115.158 117.408 -2.250 26060 9480 1 13 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.062 0.088 26060 9481 1 13 . 1 1 139 139 LEU C C 139 177.600 177.600 178.701 -1.101 26060 9482 1 13 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.836 -1.307 26060 9483 1 13 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.838 -0.094 26060 9484 1 13 . 1 1 139 139 LEU H H 139 7.507 7.507 7.780 -0.273 26060 9485 1 13 . 1 1 140 140 LYS N N 140 120.256 120.256 118.012 2.244 26060 9486 1 13 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.997 0.113 26060 9487 1 13 . 1 1 140 140 LYS C C 140 175.800 175.800 176.910 -1.110 26060 9488 1 13 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.211 -0.159 26060 9489 1 13 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.284 0.362 26060 9490 1 13 . 1 1 140 140 LYS H H 140 7.304 7.304 7.544 -0.240 26060 9491 1 14 . 1 1 4 4 MET C C 4 175.800 175.800 176.772 -0.972 26060 9492 1 14 . 1 1 4 4 MET CA C 4 55.350 55.350 56.008 -0.659 26060 9493 1 14 . 1 1 4 4 MET CB C 4 32.880 32.880 33.068 -0.188 26060 9494 1 14 . 1 1 5 5 ALA N N 5 125.230 125.230 121.905 3.325 26060 9495 1 14 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.284 0.066 26060 9496 1 14 . 1 1 5 5 ALA CA C 5 52.430 52.430 52.909 -0.479 26060 9497 1 14 . 1 1 5 5 ALA CB C 5 19.370 19.370 18.987 0.383 26060 9498 1 14 . 1 1 5 5 ALA H H 5 8.320 8.320 8.035 0.285 26060 9499 1 14 . 1 1 6 6 SER HA H 6 4.490 4.490 4.431 0.058 26060 9500 1 14 . 1 1 6 6 SER CA C 6 58.200 58.200 57.837 0.363 26060 9501 1 14 . 1 1 6 6 SER CB C 6 63.700 63.700 63.517 0.183 26060 9502 1 14 . 1 1 7 7 SER HA H 7 4.530 4.530 4.874 -0.344 26060 9503 1 14 . 1 1 7 7 SER CA C 7 58.200 58.200 57.616 0.584 26060 9504 1 14 . 1 1 7 7 SER CB C 7 63.700 63.700 63.041 0.659 26060 9505 1 14 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.798 -0.188 26060 9506 1 14 . 1 1 8 8 CYS C C 8 173.500 173.500 173.323 0.177 26060 9507 1 14 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.576 1.764 26060 9508 1 14 . 1 1 8 8 CYS CB C 8 28.490 28.490 29.587 -1.097 26060 9509 1 14 . 1 1 9 9 ALA N N 9 124.700 124.700 129.759 -5.059 26060 9510 1 14 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.027 -0.237 26060 9511 1 14 . 1 1 9 9 ALA C C 9 177.400 177.400 176.959 0.441 26060 9512 1 14 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.655 1.415 26060 9513 1 14 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.024 0.605 26060 9514 1 14 . 1 1 9 9 ALA H H 9 7.960 7.960 8.712 -0.752 26060 9515 1 14 . 1 1 10 10 VAL N N 10 120.124 120.124 124.868 -4.744 26060 9516 1 14 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.110 0.180 26060 9517 1 14 . 1 1 10 10 VAL C C 10 173.900 173.900 175.088 -1.188 26060 9518 1 14 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.602 -0.052 26060 9519 1 14 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.320 2.580 26060 9520 1 14 . 1 1 10 10 VAL H H 10 8.424 8.424 8.596 -0.172 26060 9521 1 14 . 1 1 11 11 GLN N N 11 125.818 125.818 126.795 -0.977 26060 9522 1 14 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.407 0.153 26060 9523 1 14 . 1 1 11 11 GLN C C 11 175.400 175.400 175.234 0.166 26060 9524 1 14 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.560 -0.437 26060 9525 1 14 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.549 1.480 26060 9526 1 14 . 1 1 11 11 GLN H H 11 8.636 8.636 8.549 0.087 26060 9527 1 14 . 1 1 12 12 VAL N N 12 119.106 119.106 118.741 0.365 26060 9528 1 14 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.393 0.237 26060 9529 1 14 . 1 1 12 12 VAL C C 12 173.800 173.800 174.682 -0.882 26060 9530 1 14 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.261 0.539 26060 9531 1 14 . 1 1 12 12 VAL CB C 12 35.711 35.711 34.011 1.700 26060 9532 1 14 . 1 1 12 12 VAL H H 12 8.827 8.827 8.997 -0.170 26060 9533 1 14 . 1 1 13 13 LYS N N 13 121.700 121.700 124.916 -3.216 26060 9534 1 14 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.329 -0.129 26060 9535 1 14 . 1 1 13 13 LYS C C 13 175.030 175.030 175.905 -0.875 26060 9536 1 14 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.956 0.474 26060 9537 1 14 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.361 1.559 26060 9538 1 14 . 1 1 13 13 LYS H H 13 8.234 8.234 8.527 -0.293 26060 9539 1 14 . 1 1 14 14 LEU N N 14 119.100 119.100 124.604 -5.504 26060 9540 1 14 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.293 -0.343 26060 9541 1 14 . 1 1 14 14 LEU C C 14 175.110 175.110 175.347 -0.237 26060 9542 1 14 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.403 -0.046 26060 9543 1 14 . 1 1 14 14 LEU CB C 14 46.921 46.921 46.052 0.869 26060 9544 1 14 . 1 1 14 14 LEU H H 14 8.840 8.840 8.388 0.452 26060 9545 1 14 . 1 1 15 15 GLU N N 15 120.978 120.978 122.496 -1.518 26060 9546 1 14 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.294 -0.304 26060 9547 1 14 . 1 1 15 15 GLU C C 15 173.800 173.800 175.004 -1.204 26060 9548 1 14 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.490 0.938 26060 9549 1 14 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.962 -1.136 26060 9550 1 14 . 1 1 15 15 GLU H H 15 9.181 9.181 9.281 -0.100 26060 9551 1 14 . 1 1 16 16 LEU N N 16 124.438 124.438 126.637 -2.199 26060 9552 1 14 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.384 -0.274 26060 9553 1 14 . 1 1 16 16 LEU C C 16 174.700 174.700 176.309 -1.609 26060 9554 1 14 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.786 0.290 26060 9555 1 14 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.449 2.443 26060 9556 1 14 . 1 1 16 16 LEU H H 16 8.891 8.891 8.555 0.336 26060 9557 1 14 . 1 1 17 17 GLY N N 17 108.067 108.067 108.554 -0.487 26060 9558 1 14 . 1 1 17 17 GLY C C 17 170.350 170.350 172.379 -2.029 26060 9559 1 14 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.308 1.676 26060 9560 1 14 . 1 1 17 17 GLY H H 17 7.227 7.227 8.554 -1.327 26060 9561 1 14 . 1 1 18 18 HIS N N 18 111.200 111.200 118.541 -7.341 26060 9562 1 14 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.772 -0.152 26060 9563 1 14 . 1 1 18 18 HIS C C 18 172.400 172.400 172.685 -0.285 26060 9564 1 14 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.790 -0.850 26060 9565 1 14 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.468 1.692 26060 9566 1 14 . 1 1 18 18 HIS H H 18 8.150 8.150 9.066 -0.916 26060 9567 1 14 . 1 1 19 19 ARG N N 19 117.800 117.800 122.388 -4.588 26060 9568 1 14 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.740 0.360 26060 9569 1 14 . 1 1 19 19 ARG C C 19 175.800 175.800 174.064 1.736 26060 9570 1 14 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.124 -0.624 26060 9571 1 14 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.000 -0.350 26060 9572 1 14 . 1 1 19 19 ARG H H 19 9.010 9.010 8.995 0.015 26060 9573 1 14 . 1 1 20 20 ALA N N 20 120.390 120.390 123.034 -2.644 26060 9574 1 14 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.507 0.023 26060 9575 1 14 . 1 1 20 20 ALA C C 20 175.800 175.800 175.331 0.469 26060 9576 1 14 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.541 1.649 26060 9577 1 14 . 1 1 20 20 ALA CB C 20 23.750 23.750 22.916 0.834 26060 9578 1 14 . 1 1 20 20 ALA H H 20 8.070 8.070 8.249 -0.179 26060 9579 1 14 . 1 1 21 21 GLN N N 21 121.790 121.790 121.962 -0.172 26060 9580 1 14 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.930 0.300 26060 9581 1 14 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.151 0.179 26060 9582 1 14 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.782 0.117 26060 9583 1 14 . 1 1 21 21 GLN H H 21 9.240 9.240 9.213 0.027 26060 9584 1 14 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.532 -0.902 26060 9585 1 14 . 1 1 22 22 VAL C C 22 176.500 176.500 175.375 1.125 26060 9586 1 14 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.035 2.995 26060 9587 1 14 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.540 -1.940 26060 9588 1 14 . 1 1 23 23 ARG N N 23 127.840 127.840 127.005 0.835 26060 9589 1 14 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.693 -0.563 26060 9590 1 14 . 1 1 23 23 ARG CA C 23 56.600 56.600 54.824 1.776 26060 9591 1 14 . 1 1 23 23 ARG CB C 23 32.150 32.150 31.242 0.908 26060 9592 1 14 . 1 1 23 23 ARG H H 23 8.720 8.720 8.579 0.141 26060 9593 1 14 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.135 -0.095 26060 9594 1 14 . 1 1 24 24 LYS C C 24 176.960 176.960 176.181 0.779 26060 9595 1 14 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.934 0.865 26060 9596 1 14 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.718 -0.658 26060 9597 1 14 . 1 1 25 25 LYS N N 25 115.870 115.870 119.482 -3.612 26060 9598 1 14 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.605 0.225 26060 9599 1 14 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.513 -0.553 26060 9600 1 14 . 1 1 25 25 LYS CB C 25 35.080 35.080 32.917 2.163 26060 9601 1 14 . 1 1 25 25 LYS H H 25 7.720 7.720 7.793 -0.073 26060 9602 1 14 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.670 0.160 26060 9603 1 14 . 1 1 26 26 PRO C C 26 177.400 177.400 176.757 0.643 26060 9604 1 14 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.733 -0.083 26060 9605 1 14 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.452 -0.062 26060 9606 1 14 . 1 1 27 27 THR N N 27 111.270 111.270 114.284 -3.014 26060 9607 1 14 . 1 1 27 27 THR HA H 27 4.530 4.530 4.233 0.297 26060 9608 1 14 . 1 1 27 27 THR C C 27 177.300 177.300 176.893 0.407 26060 9609 1 14 . 1 1 27 27 THR CA C 27 61.300 61.300 61.057 0.243 26060 9610 1 14 . 1 1 27 27 THR CB C 27 71.460 71.460 69.934 1.526 26060 9611 1 14 . 1 1 27 27 THR H H 27 8.380 8.380 8.116 0.264 26060 9612 1 14 . 1 1 28 28 VAL N N 28 121.170 121.170 122.737 -1.567 26060 9613 1 14 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.803 0.080 26060 9614 1 14 . 1 1 28 28 VAL C C 28 177.030 177.030 176.103 0.927 26060 9615 1 14 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.168 0.031 26060 9616 1 14 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.642 -0.242 26060 9617 1 14 . 1 1 28 28 VAL H H 28 8.910 8.910 8.524 0.386 26060 9618 1 14 . 1 1 29 29 GLU N N 29 116.800 116.800 116.958 -0.158 26060 9619 1 14 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.169 -0.249 26060 9620 1 14 . 1 1 29 29 GLU C C 29 176.200 176.200 175.963 0.237 26060 9621 1 14 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.419 1.831 26060 9622 1 14 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.314 -1.144 26060 9623 1 14 . 1 1 29 29 GLU H H 29 7.990 7.990 8.018 -0.028 26060 9624 1 14 . 1 1 30 30 GLY N N 30 105.500 105.500 107.816 -2.316 26060 9625 1 14 . 1 1 30 30 GLY C C 30 174.900 174.900 174.014 0.886 26060 9626 1 14 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.260 -0.800 26060 9627 1 14 . 1 1 30 30 GLY H H 30 7.950 7.950 7.788 0.162 26060 9628 1 14 . 1 1 31 31 PHE N N 31 119.300 119.300 118.708 0.592 26060 9629 1 14 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.969 -0.209 26060 9630 1 14 . 1 1 31 31 PHE C C 31 176.400 176.400 175.935 0.465 26060 9631 1 14 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.546 1.354 26060 9632 1 14 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.300 -3.800 26060 9633 1 14 . 1 1 31 31 PHE H H 31 7.520 7.520 7.351 0.169 26060 9634 1 14 . 1 1 32 32 THR N N 32 112.300 112.300 115.675 -3.375 26060 9635 1 14 . 1 1 32 32 THR HA H 32 4.330 4.330 4.491 -0.161 26060 9636 1 14 . 1 1 32 32 THR C C 32 175.200 175.200 174.232 0.968 26060 9637 1 14 . 1 1 32 32 THR CA C 32 62.780 62.780 62.497 0.283 26060 9638 1 14 . 1 1 32 32 THR CB C 32 70.350 70.350 70.232 0.118 26060 9639 1 14 . 1 1 32 32 THR H H 32 7.770 7.770 9.235 -1.465 26060 9640 1 14 . 1 1 33 33 HIS N N 33 121.900 121.900 122.078 -0.178 26060 9641 1 14 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.378 0.122 26060 9642 1 14 . 1 1 33 33 HIS C C 33 173.880 173.880 173.607 0.273 26060 9643 1 14 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.118 0.662 26060 9644 1 14 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.273 3.366 26060 9645 1 14 . 1 1 33 33 HIS H H 33 9.110 9.110 8.812 0.298 26060 9646 1 14 . 1 1 34 34 ASP N N 34 120.300 120.300 125.092 -4.792 26060 9647 1 14 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.037 0.363 26060 9648 1 14 . 1 1 34 34 ASP C C 34 175.100 175.100 175.055 0.045 26060 9649 1 14 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.239 -0.929 26060 9650 1 14 . 1 1 34 34 ASP CB C 34 43.100 43.100 42.756 0.344 26060 9651 1 14 . 1 1 34 34 ASP H H 34 8.810 8.810 9.079 -0.269 26060 9652 1 14 . 1 1 35 35 TRP N N 35 119.800 119.800 121.530 -1.730 26060 9653 1 14 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.705 0.025 26060 9654 1 14 . 1 1 35 35 TRP C C 35 174.900 174.900 173.571 1.329 26060 9655 1 14 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.614 0.286 26060 9656 1 14 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.297 1.773 26060 9657 1 14 . 1 1 35 35 TRP H H 35 9.250 9.250 8.942 0.308 26060 9658 1 14 . 1 1 36 36 MET N N 36 120.980 120.980 121.481 -0.501 26060 9659 1 14 . 1 1 36 36 MET HA H 36 5.750 5.750 6.012 -0.262 26060 9660 1 14 . 1 1 36 36 MET C C 36 173.700 173.700 174.308 -0.608 26060 9661 1 14 . 1 1 36 36 MET CA C 36 54.830 54.830 54.300 0.530 26060 9662 1 14 . 1 1 36 36 MET CB C 36 35.220 35.220 36.728 -1.508 26060 9663 1 14 . 1 1 36 36 MET H H 36 9.080 9.080 9.241 -0.161 26060 9664 1 14 . 1 1 37 37 VAL N N 37 126.220 126.220 121.505 4.715 26060 9665 1 14 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.055 0.255 26060 9666 1 14 . 1 1 37 37 VAL C C 37 172.300 172.300 174.215 -1.915 26060 9667 1 14 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.942 -1.402 26060 9668 1 14 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.509 1.561 26060 9669 1 14 . 1 1 37 37 VAL H H 37 9.080 9.080 8.698 0.382 26060 9670 1 14 . 1 1 38 38 PHE N N 38 120.640 120.640 123.104 -2.464 26060 9671 1 14 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.289 0.681 26060 9672 1 14 . 1 1 38 38 PHE C C 38 172.960 172.960 175.178 -2.218 26060 9673 1 14 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.805 -0.675 26060 9674 1 14 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.241 -0.241 26060 9675 1 14 . 1 1 38 38 PHE H H 38 8.320 8.320 9.084 -0.764 26060 9676 1 14 . 1 1 39 39 VAL N N 39 116.500 116.500 121.071 -4.571 26060 9677 1 14 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.668 -0.658 26060 9678 1 14 . 1 1 39 39 VAL C C 39 174.700 174.700 174.370 0.330 26060 9679 1 14 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.902 1.738 26060 9680 1 14 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.801 1.599 26060 9681 1 14 . 1 1 39 39 VAL H H 39 8.580 8.580 9.169 -0.589 26060 9682 1 14 . 1 1 40 40 ARG N N 40 124.100 124.100 124.247 -0.147 26060 9683 1 14 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.987 0.093 26060 9684 1 14 . 1 1 40 40 ARG C C 40 173.800 173.800 174.190 -0.390 26060 9685 1 14 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.788 -0.859 26060 9686 1 14 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.794 0.786 26060 9687 1 14 . 1 1 40 40 ARG H H 40 9.880 9.880 8.605 1.275 26060 9688 1 14 . 1 1 41 41 GLY N N 41 107.640 107.640 106.929 0.711 26060 9689 1 14 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.621 1.349 26060 9690 1 14 . 1 1 41 41 GLY H H 41 8.910 8.910 8.672 0.238 26060 9691 1 14 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.271 0.219 26060 9692 1 14 . 1 1 42 42 PRO C C 42 177.300 177.300 176.679 0.621 26060 9693 1 14 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.405 0.035 26060 9694 1 14 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.395 -0.285 26060 9695 1 14 . 1 1 43 43 GLU N N 43 121.050 121.050 120.041 1.009 26060 9696 1 14 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.011 -0.221 26060 9697 1 14 . 1 1 43 43 GLU C C 43 176.110 176.110 177.682 -1.572 26060 9698 1 14 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.541 -0.691 26060 9699 1 14 . 1 1 43 43 GLU CB C 43 27.850 27.850 29.133 -1.282 26060 9700 1 14 . 1 1 43 43 GLU H H 43 9.060 9.060 8.799 0.261 26060 9701 1 14 . 1 1 44 44 HIS N N 44 114.100 114.100 115.853 -1.753 26060 9702 1 14 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.233 0.118 26060 9703 1 14 . 1 1 44 44 HIS C C 44 175.170 175.170 174.446 0.724 26060 9704 1 14 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.287 0.363 26060 9705 1 14 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.336 0.034 26060 9706 1 14 . 1 1 44 44 HIS H H 44 8.420 8.420 8.844 -0.424 26060 9707 1 14 . 1 1 45 45 SER N N 45 115.540 115.540 118.362 -2.822 26060 9708 1 14 . 1 1 45 45 SER HA H 45 4.560 4.560 4.781 -0.221 26060 9709 1 14 . 1 1 45 45 SER C C 45 173.700 173.700 173.966 -0.266 26060 9710 1 14 . 1 1 45 45 SER CA C 45 58.710 58.710 57.636 1.074 26060 9711 1 14 . 1 1 45 45 SER CB C 45 65.040 65.040 63.728 1.312 26060 9712 1 14 . 1 1 45 45 SER H H 45 7.870 7.870 7.819 0.051 26060 9713 1 14 . 1 1 46 46 ASN N N 46 123.900 123.900 123.099 0.801 26060 9714 1 14 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.637 0.483 26060 9715 1 14 . 1 1 46 46 ASN C C 46 176.300 176.300 175.658 0.642 26060 9716 1 14 . 1 1 46 46 ASN CA C 46 52.690 52.690 53.425 -0.735 26060 9717 1 14 . 1 1 46 46 ASN CB C 46 38.730 38.730 39.333 -0.603 26060 9718 1 14 . 1 1 46 46 ASN H H 46 9.480 9.480 8.469 1.011 26060 9719 1 14 . 1 1 47 47 ILE N N 47 115.240 115.240 116.805 -1.565 26060 9720 1 14 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.325 0.615 26060 9721 1 14 . 1 1 47 47 ILE C C 47 176.000 176.000 177.079 -1.079 26060 9722 1 14 . 1 1 47 47 ILE CA C 47 63.200 63.200 61.780 1.420 26060 9723 1 14 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.263 -1.563 26060 9724 1 14 . 1 1 47 47 ILE H H 47 8.170 8.170 8.312 -0.142 26060 9725 1 14 . 1 1 48 48 GLN N N 48 123.200 123.200 120.877 2.323 26060 9726 1 14 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.132 0.148 26060 9727 1 14 . 1 1 48 48 GLN C C 48 175.670 175.670 177.138 -1.468 26060 9728 1 14 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.955 -0.055 26060 9729 1 14 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.395 -0.405 26060 9730 1 14 . 1 1 48 48 GLN H H 48 8.850 8.850 8.564 0.286 26060 9731 1 14 . 1 1 49 49 HIS N N 49 115.400 115.400 116.540 -1.140 26060 9732 1 14 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.449 0.121 26060 9733 1 14 . 1 1 49 49 HIS C C 49 176.380 176.380 176.387 -0.007 26060 9734 1 14 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.230 0.520 26060 9735 1 14 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.788 0.832 26060 9736 1 14 . 1 1 49 49 HIS H H 49 7.400 7.400 7.666 -0.266 26060 9737 1 14 . 1 1 50 50 PHE N N 50 109.800 109.800 111.797 -1.997 26060 9738 1 14 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.925 0.305 26060 9739 1 14 . 1 1 50 50 PHE C C 50 173.800 173.800 174.255 -0.455 26060 9740 1 14 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.721 -0.061 26060 9741 1 14 . 1 1 50 50 PHE CB C 50 41.000 41.000 40.247 0.753 26060 9742 1 14 . 1 1 50 50 PHE H H 50 7.570 7.570 7.604 -0.034 26060 9743 1 14 . 1 1 51 51 VAL N N 51 127.810 127.810 121.560 6.250 26060 9744 1 14 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.847 -0.477 26060 9745 1 14 . 1 1 51 51 VAL C C 51 174.500 174.500 174.623 -0.123 26060 9746 1 14 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.532 1.468 26060 9747 1 14 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.271 -0.991 26060 9748 1 14 . 1 1 51 51 VAL H H 51 7.810 7.810 8.136 -0.326 26060 9749 1 14 . 1 1 52 52 GLU N N 52 130.700 130.700 128.278 2.422 26060 9750 1 14 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.355 -0.375 26060 9751 1 14 . 1 1 52 52 GLU C C 52 175.400 175.400 175.874 -0.474 26060 9752 1 14 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.926 0.174 26060 9753 1 14 . 1 1 52 52 GLU CB C 52 31.580 31.580 31.693 -0.113 26060 9754 1 14 . 1 1 52 52 GLU H H 52 9.380 9.380 8.801 0.579 26060 9755 1 14 . 1 1 53 53 LYS N N 53 109.200 109.200 113.044 -3.844 26060 9756 1 14 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.767 0.033 26060 9757 1 14 . 1 1 53 53 LYS C C 53 172.300 172.300 174.099 -1.799 26060 9758 1 14 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.756 0.084 26060 9759 1 14 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.733 -1.483 26060 9760 1 14 . 1 1 53 53 LYS H H 53 7.190 7.190 7.371 -0.181 26060 9761 1 14 . 1 1 54 54 VAL N N 54 120.380 120.380 117.732 2.648 26060 9762 1 14 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.565 0.205 26060 9763 1 14 . 1 1 54 54 VAL C C 54 173.600 173.600 173.868 -0.268 26060 9764 1 14 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.351 -0.311 26060 9765 1 14 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.521 -1.821 26060 9766 1 14 . 1 1 54 54 VAL H H 54 8.450 8.450 8.281 0.169 26060 9767 1 14 . 1 1 55 55 VAL N N 55 126.920 126.920 122.816 4.104 26060 9768 1 14 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.887 -0.187 26060 9769 1 14 . 1 1 55 55 VAL C C 55 173.800 173.800 173.795 0.005 26060 9770 1 14 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.786 0.083 26060 9771 1 14 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.937 -2.837 26060 9772 1 14 . 1 1 55 55 VAL H H 55 9.260 9.260 8.963 0.297 26060 9773 1 14 . 1 1 56 56 PHE N N 56 126.130 126.130 123.863 2.267 26060 9774 1 14 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.955 -0.265 26060 9775 1 14 . 1 1 56 56 PHE C C 56 174.000 174.000 174.127 -0.127 26060 9776 1 14 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.793 -0.213 26060 9777 1 14 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.524 -1.634 26060 9778 1 14 . 1 1 56 56 PHE H H 56 9.290 9.290 8.891 0.399 26060 9779 1 14 . 1 1 57 57 HIS N N 57 124.180 124.180 124.176 0.004 26060 9780 1 14 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.993 -0.193 26060 9781 1 14 . 1 1 57 57 HIS C C 57 174.700 174.700 175.002 -0.302 26060 9782 1 14 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.128 0.192 26060 9783 1 14 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.805 1.295 26060 9784 1 14 . 1 1 57 57 HIS H H 57 8.690 8.690 8.538 0.152 26060 9785 1 14 . 1 1 58 58 LEU N N 58 122.050 122.050 123.252 -1.202 26060 9786 1 14 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.373 -0.133 26060 9787 1 14 . 1 1 58 58 LEU C C 58 174.400 174.400 176.983 -2.583 26060 9788 1 14 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.959 0.451 26060 9789 1 14 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.519 -1.359 26060 9790 1 14 . 1 1 58 58 LEU H H 58 9.050 9.050 8.027 1.023 26060 9791 1 14 . 1 1 59 59 HIS N N 59 118.510 118.510 117.250 1.260 26060 9792 1 14 . 1 1 59 59 HIS C C 59 175.300 175.300 176.763 -1.463 26060 9793 1 14 . 1 1 59 59 HIS CA C 59 59.110 59.110 54.636 4.474 26060 9794 1 14 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.245 -0.315 26060 9795 1 14 . 1 1 59 59 HIS H H 59 5.160 5.160 7.921 -2.761 26060 9796 1 14 . 1 1 60 60 GLU N N 60 122.190 122.190 124.112 -1.922 26060 9797 1 14 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.057 -0.097 26060 9798 1 14 . 1 1 60 60 GLU C C 60 175.130 175.130 177.611 -2.481 26060 9799 1 14 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.223 -0.213 26060 9800 1 14 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.221 -0.401 26060 9801 1 14 . 1 1 60 60 GLU H H 60 7.960 7.960 8.810 -0.850 26060 9802 1 14 . 1 1 61 61 SER N N 61 116.940 116.940 113.459 3.481 26060 9803 1 14 . 1 1 61 61 SER HA H 61 4.200 4.200 4.302 -0.102 26060 9804 1 14 . 1 1 61 61 SER CA C 61 60.010 60.010 59.616 0.394 26060 9805 1 14 . 1 1 61 61 SER CB C 61 63.140 63.140 63.256 -0.116 26060 9806 1 14 . 1 1 61 61 SER H H 61 8.540 8.540 8.246 0.294 26060 9807 1 14 . 1 1 62 62 PHE N N 62 123.700 123.700 121.960 1.740 26060 9808 1 14 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.699 -0.149 26060 9809 1 14 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.336 2.604 26060 9810 1 14 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.209 -0.809 26060 9811 1 14 . 1 1 62 62 PHE H H 62 8.640 8.640 8.235 0.405 26060 9812 1 14 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.492 -0.082 26060 9813 1 14 . 1 1 63 63 PRO C C 63 176.400 176.400 176.299 0.101 26060 9814 1 14 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.148 -0.548 26060 9815 1 14 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.054 -0.194 26060 9816 1 14 . 1 1 64 64 ARG N N 64 116.840 116.840 119.603 -2.763 26060 9817 1 14 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.102 -0.002 26060 9818 1 14 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.050 -0.440 26060 9819 1 14 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.666 0.164 26060 9820 1 14 . 1 1 64 64 ARG H H 64 8.890 8.890 8.608 0.282 26060 9821 1 14 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.347 -0.357 26060 9822 1 14 . 1 1 65 65 PRO C C 65 175.800 175.800 177.290 -1.490 26060 9823 1 14 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.785 2.025 26060 9824 1 14 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.981 -0.101 26060 9825 1 14 . 1 1 66 66 LYS N N 66 119.035 119.035 120.236 -1.201 26060 9826 1 14 . 1 1 66 66 LYS HA H 66 4.610 4.610 4.935 -0.325 26060 9827 1 14 . 1 1 66 66 LYS C C 66 175.400 175.400 175.862 -0.462 26060 9828 1 14 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.603 -0.150 26060 9829 1 14 . 1 1 66 66 LYS CB C 66 31.730 31.730 31.918 -0.188 26060 9830 1 14 . 1 1 66 66 LYS H H 66 7.630 7.630 7.900 -0.270 26060 9831 1 14 . 1 1 67 67 ARG N N 67 127.394 127.394 128.020 -0.626 26060 9832 1 14 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.589 0.151 26060 9833 1 14 . 1 1 67 67 ARG C C 67 174.500 174.500 175.095 -0.595 26060 9834 1 14 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.538 0.262 26060 9835 1 14 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.196 -0.482 26060 9836 1 14 . 1 1 67 67 ARG H H 67 8.855 8.855 8.679 0.176 26060 9837 1 14 . 1 1 68 68 VAL N N 68 124.388 124.388 120.413 3.975 26060 9838 1 14 . 1 1 68 68 VAL HA H 68 4.580 4.580 4.856 -0.276 26060 9839 1 14 . 1 1 68 68 VAL C C 68 176.850 176.850 175.488 1.362 26060 9840 1 14 . 1 1 68 68 VAL CA C 68 62.073 62.073 60.225 1.848 26060 9841 1 14 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.226 0.378 26060 9842 1 14 . 1 1 68 68 VAL H H 68 8.681 8.681 8.400 0.281 26060 9843 1 14 . 1 1 69 69 CYS N N 69 127.080 127.080 126.001 1.079 26060 9844 1 14 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.776 0.294 26060 9845 1 14 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.752 0.594 26060 9846 1 14 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.718 1.052 26060 9847 1 14 . 1 1 69 69 CYS H H 69 9.455 9.455 9.042 0.413 26060 9848 1 14 . 1 1 70 70 LYS N N 70 125.480 125.480 123.624 1.856 26060 9849 1 14 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.509 -0.019 26060 9850 1 14 . 1 1 70 70 LYS C C 70 174.300 174.300 175.820 -1.520 26060 9851 1 14 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.134 1.626 26060 9852 1 14 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.083 0.087 26060 9853 1 14 . 1 1 70 70 LYS H H 70 9.050 9.050 8.562 0.488 26060 9854 1 14 . 1 1 71 71 ASP N N 71 116.940 116.940 119.650 -2.710 26060 9855 1 14 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.911 0.189 26060 9856 1 14 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.152 -1.072 26060 9857 1 14 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.042 2.338 26060 9858 1 14 . 1 1 71 71 ASP H H 71 7.620 7.620 7.576 0.044 26060 9859 1 14 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.100 -0.840 26060 9860 1 14 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.852 -2.202 26060 9861 1 14 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.106 -1.066 26060 9862 1 14 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.106 -0.006 26060 9863 1 14 . 1 1 73 73 PRO C C 73 174.700 174.700 175.876 -1.176 26060 9864 1 14 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.304 -2.614 26060 9865 1 14 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.276 2.764 26060 9866 1 14 . 1 1 74 74 TYR N N 74 125.400 125.400 124.734 0.666 26060 9867 1 14 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.506 0.344 26060 9868 1 14 . 1 1 74 74 TYR C C 74 172.900 172.900 175.371 -2.471 26060 9869 1 14 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.844 -2.174 26060 9870 1 14 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.132 -3.732 26060 9871 1 14 . 1 1 74 74 TYR H H 74 8.960 8.960 8.252 0.708 26060 9872 1 14 . 1 1 75 75 LYS N N 75 121.400 121.400 119.725 1.675 26060 9873 1 14 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.139 0.451 26060 9874 1 14 . 1 1 75 75 LYS C C 75 173.800 173.800 174.574 -0.774 26060 9875 1 14 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.660 -0.010 26060 9876 1 14 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.660 -0.770 26060 9877 1 14 . 1 1 75 75 LYS H H 75 7.670 7.670 7.935 -0.265 26060 9878 1 14 . 1 1 76 76 VAL N N 76 119.800 119.800 121.811 -2.011 26060 9879 1 14 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.147 -0.257 26060 9880 1 14 . 1 1 76 76 VAL C C 76 173.900 173.900 174.476 -0.576 26060 9881 1 14 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.485 1.245 26060 9882 1 14 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.369 1.171 26060 9883 1 14 . 1 1 76 76 VAL H H 76 8.180 8.180 7.819 0.361 26060 9884 1 14 . 1 1 77 77 GLU N N 77 126.190 126.190 127.626 -1.436 26060 9885 1 14 . 1 1 77 77 GLU HA H 77 4.950 4.950 5.027 -0.077 26060 9886 1 14 . 1 1 77 77 GLU C C 77 174.700 174.700 175.169 -0.469 26060 9887 1 14 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.206 -0.267 26060 9888 1 14 . 1 1 77 77 GLU CB C 77 31.550 31.550 30.500 1.050 26060 9889 1 14 . 1 1 77 77 GLU H H 77 8.270 8.270 8.706 -0.436 26060 9890 1 14 . 1 1 78 78 GLU N N 78 126.180 126.180 123.307 2.873 26060 9891 1 14 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.433 0.017 26060 9892 1 14 . 1 1 78 78 GLU C C 78 175.400 175.400 173.551 1.849 26060 9893 1 14 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.949 -0.907 26060 9894 1 14 . 1 1 78 78 GLU CB C 78 37.100 37.100 31.965 5.135 26060 9895 1 14 . 1 1 78 78 GLU H H 78 7.870 7.870 8.563 -0.693 26060 9896 1 14 . 1 1 79 79 SER N N 79 112.109 112.109 114.394 -2.285 26060 9897 1 14 . 1 1 79 79 SER HA H 79 5.560 5.560 5.280 0.280 26060 9898 1 14 . 1 1 79 79 SER C C 79 172.490 172.490 173.539 -1.049 26060 9899 1 14 . 1 1 79 79 SER CA C 79 57.754 57.754 56.175 1.579 26060 9900 1 14 . 1 1 79 79 SER CB C 79 65.861 65.861 65.409 0.452 26060 9901 1 14 . 1 1 79 79 SER H H 79 7.714 7.714 8.362 -0.648 26060 9902 1 14 . 1 1 80 80 GLY N N 80 106.048 106.048 108.000 -1.952 26060 9903 1 14 . 1 1 80 80 GLY C C 80 172.630 172.630 171.894 0.736 26060 9904 1 14 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.574 0.996 26060 9905 1 14 . 1 1 80 80 GLY H H 80 8.828 8.828 8.767 0.061 26060 9906 1 14 . 1 1 81 81 TYR N N 81 115.280 115.280 114.531 0.749 26060 9907 1 14 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.317 0.363 26060 9908 1 14 . 1 1 81 81 TYR C C 81 174.100 174.100 174.120 -0.020 26060 9909 1 14 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.808 -1.308 26060 9910 1 14 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.103 2.237 26060 9911 1 14 . 1 1 81 81 TYR H H 81 8.770 8.770 8.110 0.660 26060 9912 1 14 . 1 1 82 82 ALA N N 82 122.350 122.350 122.676 -0.326 26060 9913 1 14 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.574 -0.174 26060 9914 1 14 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.826 0.214 26060 9915 1 14 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.072 1.328 26060 9916 1 14 . 1 1 82 82 ALA H H 82 7.160 7.160 7.441 -0.281 26060 9917 1 14 . 1 1 83 83 GLY N N 83 107.100 107.100 106.511 0.589 26060 9918 1 14 . 1 1 83 83 GLY C C 83 172.500 172.500 173.904 -1.404 26060 9919 1 14 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.331 0.279 26060 9920 1 14 . 1 1 83 83 GLY H H 83 8.220 8.220 8.340 -0.120 26060 9921 1 14 . 1 1 84 84 PHE N N 84 111.660 111.660 114.672 -3.012 26060 9922 1 14 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.648 0.042 26060 9923 1 14 . 1 1 84 84 PHE C C 84 172.460 172.460 173.285 -0.825 26060 9924 1 14 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.304 0.196 26060 9925 1 14 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.711 -1.131 26060 9926 1 14 . 1 1 84 84 PHE H H 84 7.700 7.700 8.094 -0.394 26060 9927 1 14 . 1 1 85 85 ILE N N 85 117.810 117.810 121.677 -3.867 26060 9928 1 14 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.027 0.283 26060 9929 1 14 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.137 -1.797 26060 9930 1 14 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.070 -1.810 26060 9931 1 14 . 1 1 85 85 ILE H H 85 8.340 8.340 8.624 -0.284 26060 9932 1 14 . 1 1 86 86 LEU N N 86 108.130 108.130 129.632 -21.502 26060 9933 1 14 . 1 1 86 86 LEU HA H 86 4.980 4.980 4.950 0.030 26060 9934 1 14 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.972 2.228 26060 9935 1 14 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.345 -0.045 26060 9936 1 14 . 1 1 86 86 LEU H H 86 9.900 9.900 8.621 1.279 26060 9937 1 14 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.547 0.553 26060 9938 1 14 . 1 1 87 87 PRO C C 87 175.340 175.340 175.888 -0.548 26060 9939 1 14 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.707 0.403 26060 9940 1 14 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.603 0.957 26060 9941 1 14 . 1 1 88 88 ILE N N 88 126.000 126.000 126.224 -0.224 26060 9942 1 14 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.208 0.582 26060 9943 1 14 . 1 1 88 88 ILE C C 88 176.100 176.100 175.187 0.913 26060 9944 1 14 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.563 -0.003 26060 9945 1 14 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.006 1.994 26060 9946 1 14 . 1 1 88 88 ILE H H 88 9.380 9.380 8.809 0.571 26060 9947 1 14 . 1 1 89 89 GLU N N 89 123.900 123.900 125.618 -1.718 26060 9948 1 14 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.268 -0.068 26060 9949 1 14 . 1 1 89 89 GLU C C 89 173.800 173.800 175.592 -1.792 26060 9950 1 14 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.438 -0.468 26060 9951 1 14 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.141 1.239 26060 9952 1 14 . 1 1 89 89 GLU H H 89 9.320 9.320 8.991 0.329 26060 9953 1 14 . 1 1 90 90 VAL N N 90 123.980 123.980 123.757 0.223 26060 9954 1 14 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.185 -0.025 26060 9955 1 14 . 1 1 90 90 VAL C C 90 174.800 174.800 174.682 0.118 26060 9956 1 14 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.156 0.834 26060 9957 1 14 . 1 1 90 90 VAL CB C 90 32.490 32.490 32.008 0.482 26060 9958 1 14 . 1 1 90 90 VAL H H 90 8.630 8.630 8.309 0.321 26060 9959 1 14 . 1 1 91 91 TYR N N 91 124.230 124.230 127.571 -3.341 26060 9960 1 14 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.225 0.435 26060 9961 1 14 . 1 1 91 91 TYR C C 91 176.800 176.800 175.553 1.247 26060 9962 1 14 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.068 -1.368 26060 9963 1 14 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.711 1.529 26060 9964 1 14 . 1 1 91 91 TYR H H 91 8.640 8.640 8.957 -0.317 26060 9965 1 14 . 1 1 92 92 PHE N N 92 121.200 121.200 122.791 -1.591 26060 9966 1 14 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.197 0.463 26060 9967 1 14 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.381 1.129 26060 9968 1 14 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.682 1.018 26060 9969 1 14 . 1 1 92 92 PHE H H 92 8.750 8.750 8.429 0.321 26060 9970 1 14 . 1 1 93 93 LYS N N 93 123.450 123.450 123.728 -0.278 26060 9971 1 14 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.867 -0.267 26060 9972 1 14 . 1 1 93 93 LYS C C 93 174.200 174.200 175.149 -0.949 26060 9973 1 14 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.609 -0.429 26060 9974 1 14 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.146 -0.466 26060 9975 1 14 . 1 1 93 93 LYS H H 93 8.560 8.560 8.913 -0.353 26060 9976 1 14 . 1 1 94 94 ASN N N 94 118.800 118.800 122.005 -3.205 26060 9977 1 14 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.727 -0.287 26060 9978 1 14 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.199 -0.989 26060 9979 1 14 . 1 1 94 94 ASN CB C 94 39.800 39.800 39.468 0.332 26060 9980 1 14 . 1 1 94 94 ASN H H 94 7.820 7.820 7.910 -0.090 26060 9981 1 14 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.340 -0.010 26060 9982 1 14 . 1 1 95 95 LYS C C 95 175.800 175.800 175.792 0.008 26060 9983 1 14 . 1 1 95 95 LYS CA C 95 56.210 56.210 55.924 0.286 26060 9984 1 14 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.186 -0.176 26060 9985 1 14 . 1 1 96 96 GLU N N 96 118.330 118.330 120.045 -1.715 26060 9986 1 14 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.347 0.163 26060 9987 1 14 . 1 1 96 96 GLU C C 96 173.200 173.200 176.545 -3.345 26060 9988 1 14 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.376 -1.276 26060 9989 1 14 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.810 1.660 26060 9990 1 14 . 1 1 96 96 GLU H H 96 7.120 7.120 7.596 -0.476 26060 9991 1 14 . 1 1 97 97 GLU N N 97 115.630 115.630 119.587 -3.957 26060 9992 1 14 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.193 0.237 26060 9993 1 14 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.185 -1.325 26060 9994 1 14 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.977 0.293 26060 9995 1 14 . 1 1 97 97 GLU H H 97 8.060 8.060 8.341 -0.281 26060 9996 1 14 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.287 0.713 26060 9997 1 14 . 1 1 98 98 PRO C C 98 175.900 175.900 175.987 -0.087 26060 9998 1 14 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.368 -2.208 26060 9999 1 14 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.141 1.859 26060 10000 1 14 . 1 1 99 99 ARG N N 99 122.800 122.800 119.839 2.961 26060 10001 1 14 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.543 0.087 26060 10002 1 14 . 1 1 99 99 ARG C C 99 175.800 175.800 175.725 0.075 26060 10003 1 14 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.251 0.239 26060 10004 1 14 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.918 -0.508 26060 10005 1 14 . 1 1 99 99 ARG H H 99 8.602 8.602 8.636 -0.035 26060 10006 1 14 . 1 1 100 100 LYS N N 100 113.220 113.220 116.590 -3.370 26060 10007 1 14 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.225 0.715 26060 10008 1 14 . 1 1 100 100 LYS C C 100 174.100 174.100 174.213 -0.113 26060 10009 1 14 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.507 -0.597 26060 10010 1 14 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.546 -0.826 26060 10011 1 14 . 1 1 100 100 LYS H H 100 7.650 7.650 7.371 0.279 26060 10012 1 14 . 1 1 101 101 VAL N N 101 116.230 116.230 121.176 -4.946 26060 10013 1 14 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.128 0.142 26060 10014 1 14 . 1 1 101 101 VAL C C 101 171.600 171.600 173.670 -2.070 26060 10015 1 14 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.223 1.037 26060 10016 1 14 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.328 -0.148 26060 10017 1 14 . 1 1 101 101 VAL H H 101 8.120 8.120 7.731 0.389 26060 10018 1 14 . 1 1 102 102 ARG N N 102 124.980 124.980 127.110 -2.130 26060 10019 1 14 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.899 0.261 26060 10020 1 14 . 1 1 102 102 ARG C C 102 174.340 174.340 175.221 -0.881 26060 10021 1 14 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.650 -0.900 26060 10022 1 14 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.871 1.479 26060 10023 1 14 . 1 1 102 102 ARG H H 102 7.930 7.930 8.224 -0.294 26060 10024 1 14 . 1 1 103 103 PHE N N 103 124.590 124.590 126.519 -1.929 26060 10025 1 14 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.773 0.019 26060 10026 1 14 . 1 1 103 103 PHE C C 103 174.280 174.280 174.870 -0.590 26060 10027 1 14 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.859 1.121 26060 10028 1 14 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.141 2.109 26060 10029 1 14 . 1 1 103 103 PHE H H 103 9.390 9.390 9.232 0.158 26060 10030 1 14 . 1 1 104 104 ASP N N 104 124.700 124.700 126.974 -2.274 26060 10031 1 14 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.714 0.085 26060 10032 1 14 . 1 1 104 104 ASP C C 104 174.500 174.500 175.115 -0.615 26060 10033 1 14 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.603 -0.213 26060 10034 1 14 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.781 0.449 26060 10035 1 14 . 1 1 104 104 ASP H H 104 9.010 9.010 9.084 -0.074 26060 10036 1 14 . 1 1 105 105 TYR N N 105 129.840 129.840 124.792 5.048 26060 10037 1 14 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.440 -0.340 26060 10038 1 14 . 1 1 105 105 TYR C C 105 173.100 173.100 173.730 -0.630 26060 10039 1 14 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.236 1.444 26060 10040 1 14 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.312 1.538 26060 10041 1 14 . 1 1 105 105 TYR H H 105 8.140 8.140 8.262 -0.122 26060 10042 1 14 . 1 1 106 106 ASP N N 106 126.800 126.800 128.890 -2.090 26060 10043 1 14 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.300 -0.080 26060 10044 1 14 . 1 1 106 106 ASP C C 106 172.900 172.900 174.286 -1.386 26060 10045 1 14 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.821 -0.311 26060 10046 1 14 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.268 -1.768 26060 10047 1 14 . 1 1 106 106 ASP H H 106 7.730 7.730 8.433 -0.703 26060 10048 1 14 . 1 1 107 107 LEU N N 107 132.150 132.150 128.053 4.097 26060 10049 1 14 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.369 -0.529 26060 10050 1 14 . 1 1 107 107 LEU C C 107 172.100 172.100 174.800 -2.700 26060 10051 1 14 . 1 1 107 107 LEU CA C 107 53.700 53.700 54.122 -0.422 26060 10052 1 14 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.014 -1.774 26060 10053 1 14 . 1 1 107 107 LEU H H 107 7.770 7.770 7.626 0.144 26060 10054 1 14 . 1 1 108 108 PHE N N 108 118.960 118.960 121.902 -2.942 26060 10055 1 14 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.912 -0.222 26060 10056 1 14 . 1 1 108 108 PHE C C 108 174.300 174.300 173.495 0.805 26060 10057 1 14 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.243 -0.553 26060 10058 1 14 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.143 -0.853 26060 10059 1 14 . 1 1 108 108 PHE H H 108 6.060 6.060 7.078 -1.018 26060 10060 1 14 . 1 1 109 109 LEU N N 109 118.900 118.900 121.888 -2.988 26060 10061 1 14 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.721 -0.321 26060 10062 1 14 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.370 -1.210 26060 10063 1 14 . 1 1 109 109 LEU CB C 109 43.080 43.080 45.211 -2.131 26060 10064 1 14 . 1 1 109 109 LEU H H 109 8.388 8.388 8.317 0.071 26060 10065 1 14 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.373 0.067 26060 10066 1 14 . 1 1 111 111 LEU C C 111 177.300 177.300 177.667 -0.367 26060 10067 1 14 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.270 -1.050 26060 10068 1 14 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.745 1.125 26060 10069 1 14 . 1 1 112 112 GLU N N 112 120.660 120.660 120.919 -0.259 26060 10070 1 14 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.158 0.012 26060 10071 1 14 . 1 1 112 112 GLU CA C 112 58.460 58.460 57.745 0.716 26060 10072 1 14 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.764 -0.074 26060 10073 1 14 . 1 1 112 112 GLU H H 112 8.780 8.780 8.742 0.038 26060 10074 1 14 . 1 1 113 113 GLY C C 113 173.900 173.900 173.840 0.060 26060 10075 1 14 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.264 -0.314 26060 10076 1 14 . 1 1 114 114 HIS N N 114 120.890 120.890 119.876 1.014 26060 10077 1 14 . 1 1 114 114 HIS HA H 114 4.906 4.906 4.901 0.005 26060 10078 1 14 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.935 0.835 26060 10079 1 14 . 1 1 114 114 HIS CB C 114 30.590 30.590 32.383 -1.792 26060 10080 1 14 . 1 1 114 114 HIS H H 114 7.934 7.934 7.892 0.042 26060 10081 1 14 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.298 0.502 26060 10082 1 14 . 1 1 115 115 PRO CA C 115 62.090 62.090 63.128 -1.038 26060 10083 1 14 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.183 -0.503 26060 10084 1 14 . 1 1 116 116 PRO C C 116 176.600 176.600 176.212 0.388 26060 10085 1 14 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.950 -0.650 26060 10086 1 14 . 1 1 117 117 VAL N N 117 127.480 127.480 120.026 7.454 26060 10087 1 14 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.261 -0.471 26060 10088 1 14 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.934 0.766 26060 10089 1 14 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.523 -0.323 26060 10090 1 14 . 1 1 117 117 VAL H H 117 8.890 8.890 7.991 0.899 26060 10091 1 14 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.859 0.131 26060 10092 1 14 . 1 1 118 118 ASN C C 118 172.700 172.700 173.573 -0.873 26060 10093 1 14 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.298 0.062 26060 10094 1 14 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.961 -0.761 26060 10095 1 14 . 1 1 119 119 HIS N N 119 124.930 124.930 125.860 -0.930 26060 10096 1 14 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.051 -0.231 26060 10097 1 14 . 1 1 119 119 HIS C C 119 173.500 173.500 172.751 0.749 26060 10098 1 14 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.285 1.685 26060 10099 1 14 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.149 0.521 26060 10100 1 14 . 1 1 119 119 HIS H H 119 8.790 8.790 8.699 0.091 26060 10101 1 14 . 1 1 120 120 LEU N N 120 128.280 128.280 123.062 5.218 26060 10102 1 14 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.222 -0.272 26060 10103 1 14 . 1 1 120 120 LEU C C 120 174.030 174.030 175.005 -0.975 26060 10104 1 14 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.656 0.784 26060 10105 1 14 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.068 0.532 26060 10106 1 14 . 1 1 120 120 LEU H H 120 7.460 7.460 7.977 -0.517 26060 10107 1 14 . 1 1 121 121 ARG N N 121 128.060 128.060 121.862 6.198 26060 10108 1 14 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.555 0.085 26060 10109 1 14 . 1 1 121 121 ARG C C 121 173.400 173.400 173.647 -0.247 26060 10110 1 14 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.407 -0.047 26060 10111 1 14 . 1 1 121 121 ARG CB C 121 34.260 34.260 33.498 0.762 26060 10112 1 14 . 1 1 121 121 ARG H H 121 9.860 9.860 9.183 0.677 26060 10113 1 14 . 1 1 122 122 CYS N N 122 125.290 125.290 124.983 0.307 26060 10114 1 14 . 1 1 122 122 CYS HA H 122 5.020 5.020 4.859 0.161 26060 10115 1 14 . 1 1 122 122 CYS C C 122 174.600 174.600 175.293 -0.693 26060 10116 1 14 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.579 0.711 26060 10117 1 14 . 1 1 122 122 CYS CB C 122 28.030 28.030 27.245 0.785 26060 10118 1 14 . 1 1 122 122 CYS H H 122 8.835 8.835 8.830 0.005 26060 10119 1 14 . 1 1 123 123 GLU N N 123 125.920 125.920 125.428 0.492 26060 10120 1 14 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.560 0.120 26060 10121 1 14 . 1 1 123 123 GLU C C 123 174.500 174.500 174.718 -0.218 26060 10122 1 14 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.857 -0.437 26060 10123 1 14 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.706 0.877 26060 10124 1 14 . 1 1 123 123 GLU H H 123 8.970 8.970 9.179 -0.209 26060 10125 1 14 . 1 1 124 124 LYS N N 124 121.837 121.837 122.119 -0.282 26060 10126 1 14 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.964 -0.004 26060 10127 1 14 . 1 1 124 124 LYS C C 124 175.700 175.700 175.725 -0.025 26060 10128 1 14 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.035 0.322 26060 10129 1 14 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.500 -0.311 26060 10130 1 14 . 1 1 124 124 LYS H H 124 8.652 8.652 8.384 0.268 26060 10131 1 14 . 1 1 125 125 LEU N N 125 127.000 127.000 129.211 -2.211 26060 10132 1 14 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.641 0.009 26060 10133 1 14 . 1 1 125 125 LEU C C 125 175.110 175.110 175.383 -0.273 26060 10134 1 14 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.957 -0.103 26060 10135 1 14 . 1 1 125 125 LEU CB C 125 44.267 44.267 44.135 0.132 26060 10136 1 14 . 1 1 125 125 LEU H H 125 9.175 9.175 9.137 0.038 26060 10137 1 14 . 1 1 126 126 THR N N 126 117.779 117.779 119.135 -1.356 26060 10138 1 14 . 1 1 126 126 THR HA H 126 4.650 4.650 4.400 0.250 26060 10139 1 14 . 1 1 126 126 THR C C 126 173.200 173.200 173.367 -0.167 26060 10140 1 14 . 1 1 126 126 THR CA C 126 62.036 62.036 61.351 0.685 26060 10141 1 14 . 1 1 126 126 THR CB C 126 70.284 70.284 69.462 0.822 26060 10142 1 14 . 1 1 126 126 THR H H 126 8.331 8.331 8.355 -0.024 26060 10143 1 14 . 1 1 127 127 PHE N N 127 126.576 126.576 125.693 0.883 26060 10144 1 14 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.655 -0.065 26060 10145 1 14 . 1 1 127 127 PHE C C 127 174.860 174.860 174.488 0.372 26060 10146 1 14 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.537 0.327 26060 10147 1 14 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.275 -1.275 26060 10148 1 14 . 1 1 127 127 PHE H H 127 9.051 9.051 8.569 0.482 26060 10149 1 14 . 1 1 128 128 ASN N N 128 123.040 123.040 123.830 -0.790 26060 10150 1 14 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.748 -0.128 26060 10151 1 14 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.891 0.589 26060 10152 1 14 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.800 0.660 26060 10153 1 14 . 1 1 128 128 ASN H H 128 8.880 8.880 8.865 0.015 26060 10154 1 14 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.499 0.261 26060 10155 1 14 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.575 -0.675 26060 10156 1 14 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.503 1.227 26060 10157 1 14 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.679 0.111 26060 10158 1 14 . 1 1 130 130 PRO C C 130 177.470 177.470 177.019 0.451 26060 10159 1 14 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.469 0.105 26060 10160 1 14 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.740 -0.430 26060 10161 1 14 . 1 1 131 131 THR N N 131 113.400 113.400 116.202 -2.802 26060 10162 1 14 . 1 1 131 131 THR HA H 131 4.300 4.300 4.158 0.142 26060 10163 1 14 . 1 1 131 131 THR C C 131 175.200 175.200 176.121 -0.921 26060 10164 1 14 . 1 1 131 131 THR CA C 131 62.200 62.200 61.994 0.206 26060 10165 1 14 . 1 1 131 131 THR CB C 131 70.600 70.600 70.454 0.146 26060 10166 1 14 . 1 1 131 131 THR H H 131 8.950 8.950 8.385 0.565 26060 10167 1 14 . 1 1 132 132 GLU N N 132 122.199 122.199 125.717 -3.518 26060 10168 1 14 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.991 0.019 26060 10169 1 14 . 1 1 132 132 GLU C C 132 178.700 178.700 178.346 0.354 26060 10170 1 14 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.352 -0.058 26060 10171 1 14 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.690 -0.529 26060 10172 1 14 . 1 1 132 132 GLU H H 132 8.932 8.932 9.013 -0.081 26060 10173 1 14 . 1 1 133 133 ASP N N 133 116.324 116.324 119.701 -3.377 26060 10174 1 14 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.351 -0.021 26060 10175 1 14 . 1 1 133 133 ASP C C 133 177.800 177.800 178.743 -0.943 26060 10176 1 14 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.936 -0.390 26060 10177 1 14 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.535 1.288 26060 10178 1 14 . 1 1 133 133 ASP H H 133 8.490 8.490 8.265 0.225 26060 10179 1 14 . 1 1 134 134 PHE N N 134 119.914 119.914 120.568 -0.654 26060 10180 1 14 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.279 0.331 26060 10181 1 14 . 1 1 134 134 PHE C C 134 177.300 177.300 177.213 0.087 26060 10182 1 14 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.468 0.070 26060 10183 1 14 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.912 0.288 26060 10184 1 14 . 1 1 134 134 PHE H H 134 7.787 7.787 7.485 0.302 26060 10185 1 14 . 1 1 135 135 ARG N N 135 119.794 119.794 120.727 -0.933 26060 10186 1 14 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.551 -0.201 26060 10187 1 14 . 1 1 135 135 ARG C C 135 177.370 177.370 178.256 -0.886 26060 10188 1 14 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.034 0.342 26060 10189 1 14 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.956 0.440 26060 10190 1 14 . 1 1 135 135 ARG H H 135 9.087 9.087 8.700 0.387 26060 10191 1 14 . 1 1 136 136 ARG N N 136 114.554 114.554 118.679 -4.125 26060 10192 1 14 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.948 -0.128 26060 10193 1 14 . 1 1 136 136 ARG C C 136 178.950 178.950 178.755 0.195 26060 10194 1 14 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.592 0.208 26060 10195 1 14 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.037 0.180 26060 10196 1 14 . 1 1 136 136 ARG H H 136 7.747 7.747 8.610 -0.863 26060 10197 1 14 . 1 1 137 137 LYS N N 137 118.298 118.298 119.386 -1.088 26060 10198 1 14 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.068 -0.168 26060 10199 1 14 . 1 1 137 137 LYS C C 137 177.980 177.980 178.958 -0.978 26060 10200 1 14 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.455 0.941 26060 10201 1 14 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.586 -0.139 26060 10202 1 14 . 1 1 137 137 LYS H H 137 7.154 7.154 7.463 -0.309 26060 10203 1 14 . 1 1 138 138 LEU N N 138 117.159 117.159 119.167 -2.008 26060 10204 1 14 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.776 -0.356 26060 10205 1 14 . 1 1 138 138 LEU C C 138 179.100 179.100 178.404 0.696 26060 10206 1 14 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.220 0.011 26060 10207 1 14 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.398 0.930 26060 10208 1 14 . 1 1 138 138 LEU H H 138 7.709 7.709 7.950 -0.241 26060 10209 1 14 . 1 1 139 139 LEU N N 139 115.158 115.158 117.430 -2.272 26060 10210 1 14 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.104 0.046 26060 10211 1 14 . 1 1 139 139 LEU C C 139 177.600 177.600 178.646 -1.046 26060 10212 1 14 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.729 -1.200 26060 10213 1 14 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.898 -0.154 26060 10214 1 14 . 1 1 139 139 LEU H H 139 7.507 7.507 7.950 -0.443 26060 10215 1 14 . 1 1 140 140 LYS N N 140 120.256 120.256 118.072 2.184 26060 10216 1 14 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.001 0.109 26060 10217 1 14 . 1 1 140 140 LYS C C 140 175.800 175.800 176.884 -1.084 26060 10218 1 14 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.842 -0.790 26060 10219 1 14 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.456 0.190 26060 10220 1 14 . 1 1 140 140 LYS H H 140 7.304 7.304 7.533 -0.229 26060 10221 1 15 . 1 1 4 4 MET C C 4 175.800 175.800 176.200 -0.400 26060 10222 1 15 . 1 1 4 4 MET CA C 4 55.350 55.350 55.633 -0.284 26060 10223 1 15 . 1 1 4 4 MET CB C 4 32.880 32.880 34.036 -1.156 26060 10224 1 15 . 1 1 5 5 ALA N N 5 125.230 125.230 121.489 3.741 26060 10225 1 15 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.127 0.223 26060 10226 1 15 . 1 1 5 5 ALA CA C 5 52.430 52.430 52.118 0.312 26060 10227 1 15 . 1 1 5 5 ALA CB C 5 19.370 19.370 18.775 0.595 26060 10228 1 15 . 1 1 5 5 ALA H H 5 8.320 8.320 8.148 0.172 26060 10229 1 15 . 1 1 6 6 SER HA H 6 4.490 4.490 4.618 -0.128 26060 10230 1 15 . 1 1 6 6 SER CA C 6 58.200 58.200 57.638 0.562 26060 10231 1 15 . 1 1 6 6 SER CB C 6 63.700 63.700 63.231 0.469 26060 10232 1 15 . 1 1 7 7 SER HA H 7 4.530 4.530 4.620 -0.090 26060 10233 1 15 . 1 1 7 7 SER CA C 7 58.200 58.200 58.151 0.049 26060 10234 1 15 . 1 1 7 7 SER CB C 7 63.700 63.700 64.068 -0.368 26060 10235 1 15 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.655 -0.045 26060 10236 1 15 . 1 1 8 8 CYS C C 8 173.500 173.500 173.473 0.027 26060 10237 1 15 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.303 1.037 26060 10238 1 15 . 1 1 8 8 CYS CB C 8 28.490 28.490 30.841 -2.351 26060 10239 1 15 . 1 1 9 9 ALA N N 9 124.700 124.700 123.934 0.766 26060 10240 1 15 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.840 -0.050 26060 10241 1 15 . 1 1 9 9 ALA C C 9 177.400 177.400 176.851 0.549 26060 10242 1 15 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.781 0.289 26060 10243 1 15 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.279 1.350 26060 10244 1 15 . 1 1 9 9 ALA H H 9 7.960 7.960 8.301 -0.341 26060 10245 1 15 . 1 1 10 10 VAL N N 10 120.124 120.124 124.597 -4.473 26060 10246 1 15 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.151 0.139 26060 10247 1 15 . 1 1 10 10 VAL C C 10 173.900 173.900 175.097 -1.197 26060 10248 1 15 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.565 -0.015 26060 10249 1 15 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.839 2.061 26060 10250 1 15 . 1 1 10 10 VAL H H 10 8.424 8.424 8.556 -0.133 26060 10251 1 15 . 1 1 11 11 GLN N N 11 125.818 125.818 126.297 -0.479 26060 10252 1 15 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.509 0.051 26060 10253 1 15 . 1 1 11 11 GLN C C 11 175.400 175.400 175.467 -0.067 26060 10254 1 15 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.647 -0.524 26060 10255 1 15 . 1 1 11 11 GLN CB C 11 32.029 32.029 31.049 0.980 26060 10256 1 15 . 1 1 11 11 GLN H H 11 8.636 8.636 8.658 -0.022 26060 10257 1 15 . 1 1 12 12 VAL N N 12 119.106 119.106 120.191 -1.085 26060 10258 1 15 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.401 0.229 26060 10259 1 15 . 1 1 12 12 VAL C C 12 173.800 173.800 174.947 -1.147 26060 10260 1 15 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.949 -0.149 26060 10261 1 15 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.717 1.994 26060 10262 1 15 . 1 1 12 12 VAL H H 12 8.827 8.827 8.811 0.016 26060 10263 1 15 . 1 1 13 13 LYS N N 13 121.700 121.700 124.707 -3.007 26060 10264 1 15 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.449 -0.249 26060 10265 1 15 . 1 1 13 13 LYS C C 13 175.030 175.030 176.312 -1.282 26060 10266 1 15 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.973 0.457 26060 10267 1 15 . 1 1 13 13 LYS CB C 13 35.920 35.920 33.782 2.139 26060 10268 1 15 . 1 1 13 13 LYS H H 13 8.234 8.234 8.523 -0.289 26060 10269 1 15 . 1 1 14 14 LEU N N 14 119.100 119.100 124.136 -5.036 26060 10270 1 15 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.166 -0.216 26060 10271 1 15 . 1 1 14 14 LEU C C 14 175.110 175.110 175.445 -0.335 26060 10272 1 15 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.595 -0.238 26060 10273 1 15 . 1 1 14 14 LEU CB C 14 46.921 46.921 46.050 0.871 26060 10274 1 15 . 1 1 14 14 LEU H H 14 8.840 8.840 8.344 0.496 26060 10275 1 15 . 1 1 15 15 GLU N N 15 120.978 120.978 122.168 -1.190 26060 10276 1 15 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.273 -0.283 26060 10277 1 15 . 1 1 15 15 GLU C C 15 173.800 173.800 174.999 -1.199 26060 10278 1 15 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.507 0.921 26060 10279 1 15 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.026 -1.200 26060 10280 1 15 . 1 1 15 15 GLU H H 15 9.181 9.181 9.326 -0.145 26060 10281 1 15 . 1 1 16 16 LEU N N 16 124.438 124.438 126.374 -1.936 26060 10282 1 15 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.301 -0.191 26060 10283 1 15 . 1 1 16 16 LEU C C 16 174.700 174.700 176.286 -1.586 26060 10284 1 15 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.799 0.277 26060 10285 1 15 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.340 2.552 26060 10286 1 15 . 1 1 16 16 LEU H H 16 8.891 8.891 8.696 0.195 26060 10287 1 15 . 1 1 17 17 GLY N N 17 108.067 108.067 108.527 -0.460 26060 10288 1 15 . 1 1 17 17 GLY C C 17 170.350 170.350 172.346 -1.996 26060 10289 1 15 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.329 1.655 26060 10290 1 15 . 1 1 17 17 GLY H H 17 7.227 7.227 8.675 -1.448 26060 10291 1 15 . 1 1 18 18 HIS N N 18 111.200 111.200 118.106 -6.906 26060 10292 1 15 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.744 -0.124 26060 10293 1 15 . 1 1 18 18 HIS C C 18 172.400 172.400 172.644 -0.244 26060 10294 1 15 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.832 -0.892 26060 10295 1 15 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.403 1.757 26060 10296 1 15 . 1 1 18 18 HIS H H 18 8.150 8.150 8.939 -0.789 26060 10297 1 15 . 1 1 19 19 ARG N N 19 117.800 117.800 120.908 -3.108 26060 10298 1 15 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.778 0.322 26060 10299 1 15 . 1 1 19 19 ARG C C 19 175.800 175.800 174.255 1.545 26060 10300 1 15 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.767 -0.267 26060 10301 1 15 . 1 1 19 19 ARG CB C 19 34.650 34.650 34.593 0.057 26060 10302 1 15 . 1 1 19 19 ARG H H 19 9.010 9.010 8.999 0.011 26060 10303 1 15 . 1 1 20 20 ALA N N 20 120.390 120.390 122.217 -1.827 26060 10304 1 15 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.498 0.032 26060 10305 1 15 . 1 1 20 20 ALA C C 20 175.800 175.800 175.154 0.646 26060 10306 1 15 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.815 1.375 26060 10307 1 15 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.055 0.695 26060 10308 1 15 . 1 1 20 20 ALA H H 20 8.070 8.070 8.229 -0.159 26060 10309 1 15 . 1 1 21 21 GLN N N 21 121.790 121.790 121.451 0.339 26060 10310 1 15 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.905 0.325 26060 10311 1 15 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.316 0.014 26060 10312 1 15 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.878 0.022 26060 10313 1 15 . 1 1 21 21 GLN H H 21 9.240 9.240 9.165 0.075 26060 10314 1 15 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.599 -0.969 26060 10315 1 15 . 1 1 22 22 VAL C C 22 176.500 176.500 175.346 1.154 26060 10316 1 15 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.862 3.168 26060 10317 1 15 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.985 -2.385 26060 10318 1 15 . 1 1 23 23 ARG N N 23 127.840 127.840 127.075 0.765 26060 10319 1 15 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.591 -0.461 26060 10320 1 15 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.178 1.422 26060 10321 1 15 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.932 1.218 26060 10322 1 15 . 1 1 23 23 ARG H H 23 8.720 8.720 8.589 0.131 26060 10323 1 15 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.161 -0.121 26060 10324 1 15 . 1 1 24 24 LYS C C 24 176.960 176.960 176.514 0.446 26060 10325 1 15 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.664 1.135 26060 10326 1 15 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.710 -0.650 26060 10327 1 15 . 1 1 25 25 LYS N N 25 115.870 115.870 118.822 -2.952 26060 10328 1 15 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.694 0.136 26060 10329 1 15 . 1 1 25 25 LYS CA C 25 52.960 52.960 52.926 0.034 26060 10330 1 15 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.630 1.450 26060 10331 1 15 . 1 1 25 25 LYS H H 25 7.720 7.720 7.533 0.187 26060 10332 1 15 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.708 0.122 26060 10333 1 15 . 1 1 26 26 PRO C C 26 177.400 177.400 176.904 0.496 26060 10334 1 15 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.578 0.072 26060 10335 1 15 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.605 -0.214 26060 10336 1 15 . 1 1 27 27 THR N N 27 111.270 111.270 114.364 -3.094 26060 10337 1 15 . 1 1 27 27 THR HA H 27 4.530 4.530 4.257 0.273 26060 10338 1 15 . 1 1 27 27 THR C C 27 177.300 177.300 176.876 0.424 26060 10339 1 15 . 1 1 27 27 THR CA C 27 61.300 61.300 60.932 0.368 26060 10340 1 15 . 1 1 27 27 THR CB C 27 71.460 71.460 69.983 1.477 26060 10341 1 15 . 1 1 27 27 THR H H 27 8.380 8.380 8.072 0.308 26060 10342 1 15 . 1 1 28 28 VAL N N 28 121.170 121.170 122.772 -1.602 26060 10343 1 15 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.814 0.069 26060 10344 1 15 . 1 1 28 28 VAL C C 28 177.030 177.030 176.090 0.940 26060 10345 1 15 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.115 0.085 26060 10346 1 15 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.658 -0.258 26060 10347 1 15 . 1 1 28 28 VAL H H 28 8.910 8.910 8.538 0.372 26060 10348 1 15 . 1 1 29 29 GLU N N 29 116.800 116.800 116.945 -0.145 26060 10349 1 15 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.137 -0.217 26060 10350 1 15 . 1 1 29 29 GLU C C 29 176.200 176.200 175.926 0.274 26060 10351 1 15 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.417 1.833 26060 10352 1 15 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.296 -1.126 26060 10353 1 15 . 1 1 29 29 GLU H H 29 7.990 7.990 8.014 -0.024 26060 10354 1 15 . 1 1 30 30 GLY N N 30 105.500 105.500 107.692 -2.192 26060 10355 1 15 . 1 1 30 30 GLY C C 30 174.900 174.900 173.928 0.972 26060 10356 1 15 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.219 -0.759 26060 10357 1 15 . 1 1 30 30 GLY H H 30 7.950 7.950 7.811 0.139 26060 10358 1 15 . 1 1 31 31 PHE N N 31 119.300 119.300 118.941 0.359 26060 10359 1 15 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.929 -0.169 26060 10360 1 15 . 1 1 31 31 PHE C C 31 176.400 176.400 175.910 0.490 26060 10361 1 15 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.564 1.336 26060 10362 1 15 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.275 -3.775 26060 10363 1 15 . 1 1 31 31 PHE H H 31 7.520 7.520 7.379 0.141 26060 10364 1 15 . 1 1 32 32 THR N N 32 112.300 112.300 116.105 -3.805 26060 10365 1 15 . 1 1 32 32 THR HA H 32 4.330 4.330 4.453 -0.123 26060 10366 1 15 . 1 1 32 32 THR C C 32 175.200 175.200 174.303 0.897 26060 10367 1 15 . 1 1 32 32 THR CA C 32 62.780 62.780 62.729 0.051 26060 10368 1 15 . 1 1 32 32 THR CB C 32 70.350 70.350 70.077 0.273 26060 10369 1 15 . 1 1 32 32 THR H H 32 7.770 7.770 9.183 -1.413 26060 10370 1 15 . 1 1 33 33 HIS N N 33 121.900 121.900 122.122 -0.222 26060 10371 1 15 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.253 0.247 26060 10372 1 15 . 1 1 33 33 HIS C C 33 173.880 173.880 173.611 0.269 26060 10373 1 15 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.419 0.361 26060 10374 1 15 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.111 3.529 26060 10375 1 15 . 1 1 33 33 HIS H H 33 9.110 9.110 8.800 0.310 26060 10376 1 15 . 1 1 34 34 ASP N N 34 120.300 120.300 125.443 -5.143 26060 10377 1 15 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.380 0.020 26060 10378 1 15 . 1 1 34 34 ASP C C 34 175.100 175.100 175.116 -0.016 26060 10379 1 15 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.246 -0.936 26060 10380 1 15 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.103 -0.003 26060 10381 1 15 . 1 1 34 34 ASP H H 34 8.810 8.810 9.057 -0.247 26060 10382 1 15 . 1 1 35 35 TRP N N 35 119.800 119.800 121.576 -1.776 26060 10383 1 15 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.567 0.163 26060 10384 1 15 . 1 1 35 35 TRP C C 35 174.900 174.900 173.310 1.590 26060 10385 1 15 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.707 0.193 26060 10386 1 15 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.024 2.046 26060 10387 1 15 . 1 1 35 35 TRP H H 35 9.250 9.250 8.936 0.314 26060 10388 1 15 . 1 1 36 36 MET N N 36 120.980 120.980 121.895 -0.915 26060 10389 1 15 . 1 1 36 36 MET HA H 36 5.750 5.750 5.937 -0.187 26060 10390 1 15 . 1 1 36 36 MET C C 36 173.700 173.700 174.394 -0.694 26060 10391 1 15 . 1 1 36 36 MET CA C 36 54.830 54.830 53.926 0.904 26060 10392 1 15 . 1 1 36 36 MET CB C 36 35.220 35.220 36.831 -1.611 26060 10393 1 15 . 1 1 36 36 MET H H 36 9.080 9.080 9.005 0.075 26060 10394 1 15 . 1 1 37 37 VAL N N 37 126.220 126.220 120.862 5.358 26060 10395 1 15 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.011 0.299 26060 10396 1 15 . 1 1 37 37 VAL C C 37 172.300 172.300 174.293 -1.993 26060 10397 1 15 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.897 -1.357 26060 10398 1 15 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.525 1.545 26060 10399 1 15 . 1 1 37 37 VAL H H 37 9.080 9.080 8.818 0.262 26060 10400 1 15 . 1 1 38 38 PHE N N 38 120.640 120.640 122.825 -2.185 26060 10401 1 15 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.321 0.649 26060 10402 1 15 . 1 1 38 38 PHE C C 38 172.960 172.960 175.001 -2.041 26060 10403 1 15 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.768 -0.638 26060 10404 1 15 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.315 -0.315 26060 10405 1 15 . 1 1 38 38 PHE H H 38 8.320 8.320 9.136 -0.816 26060 10406 1 15 . 1 1 39 39 VAL N N 39 116.500 116.500 121.186 -4.686 26060 10407 1 15 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.683 -0.673 26060 10408 1 15 . 1 1 39 39 VAL C C 39 174.700 174.700 174.506 0.194 26060 10409 1 15 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.811 1.829 26060 10410 1 15 . 1 1 39 39 VAL CB C 39 35.400 35.400 34.114 1.286 26060 10411 1 15 . 1 1 39 39 VAL H H 39 8.580 8.580 9.303 -0.723 26060 10412 1 15 . 1 1 40 40 ARG N N 40 124.100 124.100 123.640 0.460 26060 10413 1 15 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.930 0.150 26060 10414 1 15 . 1 1 40 40 ARG C C 40 173.800 173.800 173.829 -0.029 26060 10415 1 15 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.364 -0.434 26060 10416 1 15 . 1 1 40 40 ARG CB C 40 33.580 33.580 31.933 1.647 26060 10417 1 15 . 1 1 40 40 ARG H H 40 9.880 9.880 8.534 1.346 26060 10418 1 15 . 1 1 41 41 GLY N N 41 107.640 107.640 106.709 0.931 26060 10419 1 15 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.689 1.281 26060 10420 1 15 . 1 1 41 41 GLY H H 41 8.910 8.910 8.642 0.268 26060 10421 1 15 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.364 0.126 26060 10422 1 15 . 1 1 42 42 PRO C C 42 177.300 177.300 176.882 0.418 26060 10423 1 15 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.581 -0.141 26060 10424 1 15 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.465 -0.355 26060 10425 1 15 . 1 1 43 43 GLU N N 43 121.050 121.050 120.198 0.852 26060 10426 1 15 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.121 -0.331 26060 10427 1 15 . 1 1 43 43 GLU C C 43 176.110 176.110 177.589 -1.479 26060 10428 1 15 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.734 -0.884 26060 10429 1 15 . 1 1 43 43 GLU CB C 43 27.850 27.850 29.043 -1.193 26060 10430 1 15 . 1 1 43 43 GLU H H 43 9.060 9.060 8.839 0.221 26060 10431 1 15 . 1 1 44 44 HIS N N 44 114.100 114.100 117.972 -3.872 26060 10432 1 15 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.251 0.100 26060 10433 1 15 . 1 1 44 44 HIS C C 44 175.170 175.170 174.268 0.902 26060 10434 1 15 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.418 0.232 26060 10435 1 15 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.500 -0.130 26060 10436 1 15 . 1 1 44 44 HIS H H 44 8.420 8.420 8.770 -0.350 26060 10437 1 15 . 1 1 45 45 SER N N 45 115.540 115.540 117.259 -1.719 26060 10438 1 15 . 1 1 45 45 SER HA H 45 4.560 4.560 4.297 0.263 26060 10439 1 15 . 1 1 45 45 SER C C 45 173.700 173.700 174.391 -0.691 26060 10440 1 15 . 1 1 45 45 SER CA C 45 58.710 58.710 57.720 0.990 26060 10441 1 15 . 1 1 45 45 SER CB C 45 65.040 65.040 63.255 1.785 26060 10442 1 15 . 1 1 45 45 SER H H 45 7.870 7.870 7.548 0.322 26060 10443 1 15 . 1 1 46 46 ASN N N 46 123.900 123.900 124.346 -0.446 26060 10444 1 15 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.989 0.131 26060 10445 1 15 . 1 1 46 46 ASN C C 46 176.300 176.300 175.613 0.687 26060 10446 1 15 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.406 0.284 26060 10447 1 15 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.169 -1.439 26060 10448 1 15 . 1 1 46 46 ASN H H 46 9.480 9.480 8.090 1.390 26060 10449 1 15 . 1 1 47 47 ILE N N 47 115.240 115.240 121.313 -6.073 26060 10450 1 15 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.436 0.504 26060 10451 1 15 . 1 1 47 47 ILE C C 47 176.000 176.000 176.647 -0.647 26060 10452 1 15 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.834 0.366 26060 10453 1 15 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.252 -1.552 26060 10454 1 15 . 1 1 47 47 ILE H H 47 8.170 8.170 8.418 -0.248 26060 10455 1 15 . 1 1 48 48 GLN N N 48 123.200 123.200 119.975 3.225 26060 10456 1 15 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.130 0.150 26060 10457 1 15 . 1 1 48 48 GLN C C 48 175.670 175.670 176.731 -1.061 26060 10458 1 15 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.104 -0.204 26060 10459 1 15 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.379 -0.389 26060 10460 1 15 . 1 1 48 48 GLN H H 48 8.850 8.850 8.574 0.276 26060 10461 1 15 . 1 1 49 49 HIS N N 49 115.400 115.400 116.654 -1.254 26060 10462 1 15 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.393 0.177 26060 10463 1 15 . 1 1 49 49 HIS C C 49 176.380 176.380 176.999 -0.619 26060 10464 1 15 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.760 -0.010 26060 10465 1 15 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.619 1.001 26060 10466 1 15 . 1 1 49 49 HIS H H 49 7.400 7.400 7.597 -0.197 26060 10467 1 15 . 1 1 50 50 PHE N N 50 109.800 109.800 113.240 -3.440 26060 10468 1 15 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.918 0.312 26060 10469 1 15 . 1 1 50 50 PHE C C 50 173.800 173.800 174.224 -0.424 26060 10470 1 15 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.628 0.032 26060 10471 1 15 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.515 1.485 26060 10472 1 15 . 1 1 50 50 PHE H H 50 7.570 7.570 7.553 0.017 26060 10473 1 15 . 1 1 51 51 VAL N N 51 127.810 127.810 120.448 7.362 26060 10474 1 15 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.897 -0.527 26060 10475 1 15 . 1 1 51 51 VAL C C 51 174.500 174.500 174.615 -0.115 26060 10476 1 15 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.473 1.527 26060 10477 1 15 . 1 1 51 51 VAL CB C 51 33.280 33.280 35.052 -1.772 26060 10478 1 15 . 1 1 51 51 VAL H H 51 7.810 7.810 8.022 -0.212 26060 10479 1 15 . 1 1 52 52 GLU N N 52 130.700 130.700 127.231 3.469 26060 10480 1 15 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.515 -0.535 26060 10481 1 15 . 1 1 52 52 GLU C C 52 175.400 175.400 175.547 -0.147 26060 10482 1 15 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.153 0.947 26060 10483 1 15 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.343 -0.763 26060 10484 1 15 . 1 1 52 52 GLU H H 52 9.380 9.380 8.919 0.461 26060 10485 1 15 . 1 1 53 53 LYS N N 53 109.200 109.200 113.595 -4.395 26060 10486 1 15 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.093 -0.293 26060 10487 1 15 . 1 1 53 53 LYS C C 53 172.300 172.300 174.497 -2.197 26060 10488 1 15 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.511 0.329 26060 10489 1 15 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.117 -1.867 26060 10490 1 15 . 1 1 53 53 LYS H H 53 7.190 7.190 7.368 -0.178 26060 10491 1 15 . 1 1 54 54 VAL N N 54 120.380 120.380 117.626 2.754 26060 10492 1 15 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.662 0.108 26060 10493 1 15 . 1 1 54 54 VAL C C 54 173.600 173.600 173.923 -0.323 26060 10494 1 15 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.233 -0.193 26060 10495 1 15 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.657 -1.958 26060 10496 1 15 . 1 1 54 54 VAL H H 54 8.450 8.450 8.611 -0.161 26060 10497 1 15 . 1 1 55 55 VAL N N 55 126.920 126.920 122.450 4.470 26060 10498 1 15 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.086 -0.386 26060 10499 1 15 . 1 1 55 55 VAL C C 55 173.800 173.800 173.850 -0.050 26060 10500 1 15 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.718 0.152 26060 10501 1 15 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.995 -2.895 26060 10502 1 15 . 1 1 55 55 VAL H H 55 9.260 9.260 9.012 0.248 26060 10503 1 15 . 1 1 56 56 PHE N N 56 126.130 126.130 123.830 2.300 26060 10504 1 15 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.988 -0.298 26060 10505 1 15 . 1 1 56 56 PHE C C 56 174.000 174.000 174.208 -0.208 26060 10506 1 15 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.756 -0.176 26060 10507 1 15 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.663 -1.774 26060 10508 1 15 . 1 1 56 56 PHE H H 56 9.290 9.290 8.968 0.322 26060 10509 1 15 . 1 1 57 57 HIS N N 57 124.180 124.180 124.230 -0.050 26060 10510 1 15 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.997 -0.197 26060 10511 1 15 . 1 1 57 57 HIS C C 57 174.700 174.700 175.025 -0.325 26060 10512 1 15 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.050 0.270 26060 10513 1 15 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.740 1.360 26060 10514 1 15 . 1 1 57 57 HIS H H 57 8.690 8.690 8.547 0.143 26060 10515 1 15 . 1 1 58 58 LEU N N 58 122.050 122.050 122.574 -0.524 26060 10516 1 15 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.430 -0.190 26060 10517 1 15 . 1 1 58 58 LEU C C 58 174.400 174.400 176.943 -2.543 26060 10518 1 15 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.788 0.622 26060 10519 1 15 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.525 -1.365 26060 10520 1 15 . 1 1 58 58 LEU H H 58 9.050 9.050 7.966 1.084 26060 10521 1 15 . 1 1 59 59 HIS N N 59 118.510 118.510 118.906 -0.396 26060 10522 1 15 . 1 1 59 59 HIS C C 59 175.300 175.300 176.759 -1.459 26060 10523 1 15 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.723 3.387 26060 10524 1 15 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.188 -0.258 26060 10525 1 15 . 1 1 59 59 HIS H H 59 5.160 5.160 7.920 -2.760 26060 10526 1 15 . 1 1 60 60 GLU N N 60 122.190 122.190 125.334 -3.144 26060 10527 1 15 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.923 0.037 26060 10528 1 15 . 1 1 60 60 GLU C C 60 175.130 175.130 176.991 -1.861 26060 10529 1 15 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.338 -0.328 26060 10530 1 15 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.998 -0.178 26060 10531 1 15 . 1 1 60 60 GLU H H 60 7.960 7.960 8.479 -0.519 26060 10532 1 15 . 1 1 61 61 SER N N 61 116.940 116.940 114.080 2.860 26060 10533 1 15 . 1 1 61 61 SER HA H 61 4.200 4.200 4.268 -0.068 26060 10534 1 15 . 1 1 61 61 SER CA C 61 60.010 60.010 60.214 -0.204 26060 10535 1 15 . 1 1 61 61 SER CB C 61 63.140 63.140 63.461 -0.320 26060 10536 1 15 . 1 1 61 61 SER H H 61 8.540 8.540 7.417 1.123 26060 10537 1 15 . 1 1 62 62 PHE N N 62 123.700 123.700 122.949 0.751 26060 10538 1 15 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.677 -0.127 26060 10539 1 15 . 1 1 62 62 PHE CA C 62 57.940 57.940 56.062 1.878 26060 10540 1 15 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.856 -0.456 26060 10541 1 15 . 1 1 62 62 PHE H H 62 8.640 8.640 8.135 0.505 26060 10542 1 15 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.440 -0.030 26060 10543 1 15 . 1 1 63 63 PRO C C 63 176.400 176.400 176.522 -0.122 26060 10544 1 15 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.227 -0.627 26060 10545 1 15 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.020 -0.160 26060 10546 1 15 . 1 1 64 64 ARG N N 64 116.840 116.840 119.785 -2.945 26060 10547 1 15 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.029 0.071 26060 10548 1 15 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.215 -0.605 26060 10549 1 15 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.548 0.282 26060 10550 1 15 . 1 1 64 64 ARG H H 64 8.890 8.890 8.909 -0.019 26060 10551 1 15 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.377 -0.387 26060 10552 1 15 . 1 1 65 65 PRO C C 65 175.800 175.800 177.250 -1.450 26060 10553 1 15 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.992 1.818 26060 10554 1 15 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.955 -0.075 26060 10555 1 15 . 1 1 66 66 LYS N N 66 119.035 119.035 120.232 -1.197 26060 10556 1 15 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.136 -0.526 26060 10557 1 15 . 1 1 66 66 LYS C C 66 175.400 175.400 175.824 -0.424 26060 10558 1 15 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.244 0.209 26060 10559 1 15 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.101 -0.371 26060 10560 1 15 . 1 1 66 66 LYS H H 66 7.630 7.630 7.843 -0.213 26060 10561 1 15 . 1 1 67 67 ARG N N 67 127.394 127.394 127.606 -0.212 26060 10562 1 15 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.621 0.119 26060 10563 1 15 . 1 1 67 67 ARG C C 67 174.500 174.500 174.828 -0.328 26060 10564 1 15 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.611 0.189 26060 10565 1 15 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.979 -1.265 26060 10566 1 15 . 1 1 67 67 ARG H H 67 8.855 8.855 8.534 0.321 26060 10567 1 15 . 1 1 68 68 VAL N N 68 124.388 124.388 120.368 4.020 26060 10568 1 15 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.115 -0.535 26060 10569 1 15 . 1 1 68 68 VAL C C 68 176.850 176.850 175.446 1.404 26060 10570 1 15 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.520 2.553 26060 10571 1 15 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.693 -0.089 26060 10572 1 15 . 1 1 68 68 VAL H H 68 8.681 8.681 8.443 0.238 26060 10573 1 15 . 1 1 69 69 CYS N N 69 127.080 127.080 126.165 0.915 26060 10574 1 15 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.798 0.273 26060 10575 1 15 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.331 1.014 26060 10576 1 15 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.387 0.383 26060 10577 1 15 . 1 1 69 69 CYS H H 69 9.455 9.455 8.917 0.538 26060 10578 1 15 . 1 1 70 70 LYS N N 70 125.480 125.480 126.987 -1.507 26060 10579 1 15 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.667 -0.177 26060 10580 1 15 . 1 1 70 70 LYS C C 70 174.300 174.300 175.815 -1.515 26060 10581 1 15 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.029 1.731 26060 10582 1 15 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.206 -0.036 26060 10583 1 15 . 1 1 70 70 LYS H H 70 9.050 9.050 8.761 0.289 26060 10584 1 15 . 1 1 71 71 ASP N N 71 116.940 116.940 120.930 -3.990 26060 10585 1 15 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.972 0.128 26060 10586 1 15 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.305 -1.225 26060 10587 1 15 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.702 1.679 26060 10588 1 15 . 1 1 71 71 ASP H H 71 7.620 7.620 7.613 0.007 26060 10589 1 15 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.097 -0.837 26060 10590 1 15 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.918 -2.268 26060 10591 1 15 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.872 -0.832 26060 10592 1 15 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.141 -0.041 26060 10593 1 15 . 1 1 73 73 PRO C C 73 174.700 174.700 176.022 -1.322 26060 10594 1 15 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.367 -2.677 26060 10595 1 15 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.099 2.941 26060 10596 1 15 . 1 1 74 74 TYR N N 74 125.400 125.400 124.815 0.585 26060 10597 1 15 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.605 0.245 26060 10598 1 15 . 1 1 74 74 TYR C C 74 172.900 172.900 175.538 -2.638 26060 10599 1 15 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.197 -2.527 26060 10600 1 15 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.671 -4.271 26060 10601 1 15 . 1 1 74 74 TYR H H 74 8.960 8.960 8.382 0.578 26060 10602 1 15 . 1 1 75 75 LYS N N 75 121.400 121.400 119.444 1.956 26060 10603 1 15 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.181 0.409 26060 10604 1 15 . 1 1 75 75 LYS C C 75 173.800 173.800 174.063 -0.263 26060 10605 1 15 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.315 0.335 26060 10606 1 15 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.592 -0.702 26060 10607 1 15 . 1 1 75 75 LYS H H 75 7.670 7.670 8.195 -0.525 26060 10608 1 15 . 1 1 76 76 VAL N N 76 119.800 119.800 119.993 -0.193 26060 10609 1 15 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.155 -0.265 26060 10610 1 15 . 1 1 76 76 VAL C C 76 173.900 173.900 174.483 -0.583 26060 10611 1 15 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.247 1.483 26060 10612 1 15 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.718 -0.178 26060 10613 1 15 . 1 1 76 76 VAL H H 76 8.180 8.180 7.906 0.274 26060 10614 1 15 . 1 1 77 77 GLU N N 77 126.190 126.190 127.211 -1.021 26060 10615 1 15 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.951 -0.001 26060 10616 1 15 . 1 1 77 77 GLU C C 77 174.700 174.700 175.297 -0.597 26060 10617 1 15 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.010 -0.070 26060 10618 1 15 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.059 0.491 26060 10619 1 15 . 1 1 77 77 GLU H H 77 8.270 8.270 8.598 -0.328 26060 10620 1 15 . 1 1 78 78 GLU N N 78 126.180 126.180 123.607 2.573 26060 10621 1 15 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.602 -0.152 26060 10622 1 15 . 1 1 78 78 GLU C C 78 175.400 175.400 173.919 1.481 26060 10623 1 15 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.182 -0.140 26060 10624 1 15 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.104 2.996 26060 10625 1 15 . 1 1 78 78 GLU H H 78 7.870 7.870 8.596 -0.726 26060 10626 1 15 . 1 1 79 79 SER N N 79 112.109 112.109 113.237 -1.128 26060 10627 1 15 . 1 1 79 79 SER HA H 79 5.560 5.560 5.337 0.223 26060 10628 1 15 . 1 1 79 79 SER C C 79 172.490 172.490 173.072 -0.582 26060 10629 1 15 . 1 1 79 79 SER CA C 79 57.754 57.754 56.360 1.394 26060 10630 1 15 . 1 1 79 79 SER CB C 79 65.861 65.861 65.404 0.457 26060 10631 1 15 . 1 1 79 79 SER H H 79 7.714 7.714 8.315 -0.601 26060 10632 1 15 . 1 1 80 80 GLY N N 80 106.048 106.048 110.592 -4.544 26060 10633 1 15 . 1 1 80 80 GLY C C 80 172.630 172.630 172.125 0.505 26060 10634 1 15 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.331 1.239 26060 10635 1 15 . 1 1 80 80 GLY H H 80 8.828 8.828 8.829 -0.001 26060 10636 1 15 . 1 1 81 81 TYR N N 81 115.280 115.280 116.831 -1.551 26060 10637 1 15 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.384 0.296 26060 10638 1 15 . 1 1 81 81 TYR C C 81 174.100 174.100 173.989 0.111 26060 10639 1 15 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.441 -0.941 26060 10640 1 15 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.234 2.106 26060 10641 1 15 . 1 1 81 81 TYR H H 81 8.770 8.770 8.207 0.563 26060 10642 1 15 . 1 1 82 82 ALA N N 82 122.350 122.350 122.566 -0.216 26060 10643 1 15 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.567 -0.167 26060 10644 1 15 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.547 0.493 26060 10645 1 15 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.262 1.138 26060 10646 1 15 . 1 1 82 82 ALA H H 82 7.160 7.160 7.349 -0.189 26060 10647 1 15 . 1 1 83 83 GLY N N 83 107.100 107.100 106.559 0.541 26060 10648 1 15 . 1 1 83 83 GLY C C 83 172.500 172.500 173.622 -1.122 26060 10649 1 15 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.095 0.515 26060 10650 1 15 . 1 1 83 83 GLY H H 83 8.220 8.220 8.258 -0.038 26060 10651 1 15 . 1 1 84 84 PHE N N 84 111.660 111.660 115.152 -3.492 26060 10652 1 15 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.556 0.134 26060 10653 1 15 . 1 1 84 84 PHE C C 84 172.460 172.460 173.457 -0.997 26060 10654 1 15 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.702 -0.202 26060 10655 1 15 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.568 -0.988 26060 10656 1 15 . 1 1 84 84 PHE H H 84 7.700 7.700 7.944 -0.244 26060 10657 1 15 . 1 1 85 85 ILE N N 85 117.810 117.810 121.936 -4.126 26060 10658 1 15 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.110 0.200 26060 10659 1 15 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.538 -1.198 26060 10660 1 15 . 1 1 85 85 ILE CB C 85 35.260 35.260 36.969 -1.710 26060 10661 1 15 . 1 1 85 85 ILE H H 85 8.340 8.340 8.444 -0.104 26060 10662 1 15 . 1 1 86 86 LEU N N 86 108.130 108.130 129.433 -21.303 26060 10663 1 15 . 1 1 86 86 LEU HA H 86 4.980 4.980 4.990 -0.010 26060 10664 1 15 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.029 2.171 26060 10665 1 15 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.072 0.228 26060 10666 1 15 . 1 1 86 86 LEU H H 86 9.900 9.900 8.724 1.176 26060 10667 1 15 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.525 0.575 26060 10668 1 15 . 1 1 87 87 PRO C C 87 175.340 175.340 175.822 -0.482 26060 10669 1 15 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.827 0.284 26060 10670 1 15 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.574 0.986 26060 10671 1 15 . 1 1 88 88 ILE N N 88 126.000 126.000 126.141 -0.141 26060 10672 1 15 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.320 0.470 26060 10673 1 15 . 1 1 88 88 ILE C C 88 176.100 176.100 175.145 0.955 26060 10674 1 15 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.408 0.152 26060 10675 1 15 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.179 1.821 26060 10676 1 15 . 1 1 88 88 ILE H H 88 9.380 9.380 8.805 0.575 26060 10677 1 15 . 1 1 89 89 GLU N N 89 123.900 123.900 125.181 -1.281 26060 10678 1 15 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.312 -0.112 26060 10679 1 15 . 1 1 89 89 GLU C C 89 173.800 173.800 175.574 -1.774 26060 10680 1 15 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.342 -0.372 26060 10681 1 15 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.162 1.218 26060 10682 1 15 . 1 1 89 89 GLU H H 89 9.320 9.320 8.983 0.337 26060 10683 1 15 . 1 1 90 90 VAL N N 90 123.980 123.980 123.638 0.342 26060 10684 1 15 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.129 0.031 26060 10685 1 15 . 1 1 90 90 VAL C C 90 174.800 174.800 174.749 0.051 26060 10686 1 15 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.200 0.790 26060 10687 1 15 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.949 0.541 26060 10688 1 15 . 1 1 90 90 VAL H H 90 8.630 8.630 8.383 0.247 26060 10689 1 15 . 1 1 91 91 TYR N N 91 124.230 124.230 127.841 -3.611 26060 10690 1 15 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.386 0.274 26060 10691 1 15 . 1 1 91 91 TYR C C 91 176.800 176.800 175.533 1.267 26060 10692 1 15 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.606 -1.906 26060 10693 1 15 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.831 1.409 26060 10694 1 15 . 1 1 91 91 TYR H H 91 8.640 8.640 8.903 -0.263 26060 10695 1 15 . 1 1 92 92 PHE N N 92 121.200 121.200 122.741 -1.541 26060 10696 1 15 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.260 0.400 26060 10697 1 15 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.971 1.540 26060 10698 1 15 . 1 1 92 92 PHE CB C 92 42.700 42.700 42.097 0.603 26060 10699 1 15 . 1 1 92 92 PHE H H 92 8.750 8.750 9.019 -0.269 26060 10700 1 15 . 1 1 93 93 LYS N N 93 123.450 123.450 122.842 0.608 26060 10701 1 15 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.522 0.078 26060 10702 1 15 . 1 1 93 93 LYS C C 93 174.200 174.200 174.866 -0.666 26060 10703 1 15 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.000 -0.820 26060 10704 1 15 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.096 -0.416 26060 10705 1 15 . 1 1 93 93 LYS H H 93 8.560 8.560 8.961 -0.401 26060 10706 1 15 . 1 1 94 94 ASN N N 94 118.800 118.800 122.133 -3.333 26060 10707 1 15 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.777 -0.337 26060 10708 1 15 . 1 1 94 94 ASN CA C 94 51.210 51.210 51.945 -0.735 26060 10709 1 15 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.230 -1.430 26060 10710 1 15 . 1 1 94 94 ASN H H 94 7.820 7.820 8.036 -0.215 26060 10711 1 15 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.411 -0.081 26060 10712 1 15 . 1 1 95 95 LYS C C 95 175.800 175.800 175.739 0.061 26060 10713 1 15 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.765 -0.555 26060 10714 1 15 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.273 -0.263 26060 10715 1 15 . 1 1 96 96 GLU N N 96 118.330 118.330 120.398 -2.068 26060 10716 1 15 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.313 0.197 26060 10717 1 15 . 1 1 96 96 GLU C C 96 173.200 173.200 175.425 -2.225 26060 10718 1 15 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.025 -0.925 26060 10719 1 15 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.564 1.906 26060 10720 1 15 . 1 1 96 96 GLU H H 96 7.120 7.120 7.568 -0.448 26060 10721 1 15 . 1 1 97 97 GLU N N 97 115.630 115.630 119.417 -3.787 26060 10722 1 15 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.179 0.251 26060 10723 1 15 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.653 -0.793 26060 10724 1 15 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.608 0.662 26060 10725 1 15 . 1 1 97 97 GLU H H 97 8.060 8.060 8.265 -0.205 26060 10726 1 15 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.190 0.810 26060 10727 1 15 . 1 1 98 98 PRO C C 98 175.900 175.900 176.635 -0.735 26060 10728 1 15 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.012 -1.852 26060 10729 1 15 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.804 2.196 26060 10730 1 15 . 1 1 99 99 ARG N N 99 122.800 122.800 120.046 2.754 26060 10731 1 15 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.345 0.285 26060 10732 1 15 . 1 1 99 99 ARG C C 99 175.800 175.800 175.390 0.410 26060 10733 1 15 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.269 0.221 26060 10734 1 15 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.577 -0.167 26060 10735 1 15 . 1 1 99 99 ARG H H 99 8.602 8.602 8.524 0.078 26060 10736 1 15 . 1 1 100 100 LYS N N 100 113.220 113.220 116.740 -3.520 26060 10737 1 15 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.337 0.603 26060 10738 1 15 . 1 1 100 100 LYS C C 100 174.100 174.100 174.397 -0.297 26060 10739 1 15 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.065 -0.155 26060 10740 1 15 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.728 -1.008 26060 10741 1 15 . 1 1 100 100 LYS H H 100 7.650 7.650 7.322 0.328 26060 10742 1 15 . 1 1 101 101 VAL N N 101 116.230 116.230 121.268 -5.038 26060 10743 1 15 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.129 0.141 26060 10744 1 15 . 1 1 101 101 VAL C C 101 171.600 171.600 173.698 -2.098 26060 10745 1 15 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.223 1.037 26060 10746 1 15 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.068 0.112 26060 10747 1 15 . 1 1 101 101 VAL H H 101 8.120 8.120 7.816 0.303 26060 10748 1 15 . 1 1 102 102 ARG N N 102 124.980 124.980 127.912 -2.932 26060 10749 1 15 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.858 0.302 26060 10750 1 15 . 1 1 102 102 ARG C C 102 174.340 174.340 175.225 -0.885 26060 10751 1 15 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.767 -1.016 26060 10752 1 15 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.447 1.903 26060 10753 1 15 . 1 1 102 102 ARG H H 102 7.930 7.930 8.266 -0.336 26060 10754 1 15 . 1 1 103 103 PHE N N 103 124.590 124.590 127.210 -2.620 26060 10755 1 15 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.795 -0.003 26060 10756 1 15 . 1 1 103 103 PHE C C 103 174.280 174.280 174.635 -0.355 26060 10757 1 15 . 1 1 103 103 PHE CA C 103 55.980 55.980 55.025 0.955 26060 10758 1 15 . 1 1 103 103 PHE CB C 103 42.250 42.250 40.230 2.020 26060 10759 1 15 . 1 1 103 103 PHE H H 103 9.390 9.390 9.189 0.201 26060 10760 1 15 . 1 1 104 104 ASP N N 104 124.700 124.700 126.846 -2.146 26060 10761 1 15 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.705 0.094 26060 10762 1 15 . 1 1 104 104 ASP C C 104 174.500 174.500 174.906 -0.406 26060 10763 1 15 . 1 1 104 104 ASP CA C 104 54.390 54.390 55.053 -0.663 26060 10764 1 15 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.948 0.282 26060 10765 1 15 . 1 1 104 104 ASP H H 104 9.010 9.010 8.978 0.032 26060 10766 1 15 . 1 1 105 105 TYR N N 105 129.840 129.840 125.846 3.994 26060 10767 1 15 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.510 -0.410 26060 10768 1 15 . 1 1 105 105 TYR C C 105 173.100 173.100 174.406 -1.306 26060 10769 1 15 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.760 0.920 26060 10770 1 15 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.457 1.393 26060 10771 1 15 . 1 1 105 105 TYR H H 105 8.140 8.140 8.431 -0.291 26060 10772 1 15 . 1 1 106 106 ASP N N 106 126.800 126.800 128.374 -1.574 26060 10773 1 15 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.303 -0.083 26060 10774 1 15 . 1 1 106 106 ASP C C 106 172.900 172.900 174.531 -1.631 26060 10775 1 15 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.818 -0.308 26060 10776 1 15 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.060 -1.560 26060 10777 1 15 . 1 1 106 106 ASP H H 106 7.730 7.730 8.429 -0.699 26060 10778 1 15 . 1 1 107 107 LEU N N 107 132.150 132.150 128.676 3.474 26060 10779 1 15 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.375 -0.535 26060 10780 1 15 . 1 1 107 107 LEU C C 107 172.100 172.100 174.956 -2.856 26060 10781 1 15 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.829 -0.129 26060 10782 1 15 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.110 -1.870 26060 10783 1 15 . 1 1 107 107 LEU H H 107 7.770 7.770 7.701 0.069 26060 10784 1 15 . 1 1 108 108 PHE N N 108 118.960 118.960 121.806 -2.846 26060 10785 1 15 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.869 -0.179 26060 10786 1 15 . 1 1 108 108 PHE C C 108 174.300 174.300 173.716 0.584 26060 10787 1 15 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.212 -0.521 26060 10788 1 15 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.407 -0.117 26060 10789 1 15 . 1 1 108 108 PHE H H 108 6.060 6.060 7.017 -0.957 26060 10790 1 15 . 1 1 109 109 LEU N N 109 118.900 118.900 123.542 -4.642 26060 10791 1 15 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.606 -0.206 26060 10792 1 15 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.351 -1.191 26060 10793 1 15 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.290 -1.210 26060 10794 1 15 . 1 1 109 109 LEU H H 109 8.388 8.388 8.391 -0.003 26060 10795 1 15 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.416 0.024 26060 10796 1 15 . 1 1 111 111 LEU C C 111 177.300 177.300 177.275 0.025 26060 10797 1 15 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.324 -1.104 26060 10798 1 15 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.542 1.327 26060 10799 1 15 . 1 1 112 112 GLU N N 112 120.660 120.660 122.747 -2.087 26060 10800 1 15 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.094 0.076 26060 10801 1 15 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.300 0.160 26060 10802 1 15 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.014 -0.324 26060 10803 1 15 . 1 1 112 112 GLU H H 112 8.780 8.780 8.853 -0.073 26060 10804 1 15 . 1 1 113 113 GLY C C 113 173.900 173.900 173.871 0.029 26060 10805 1 15 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.943 0.007 26060 10806 1 15 . 1 1 114 114 HIS N N 114 120.890 120.890 121.440 -0.550 26060 10807 1 15 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.112 -0.206 26060 10808 1 15 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.325 0.445 26060 10809 1 15 . 1 1 114 114 HIS CB C 114 30.590 30.590 32.350 -1.760 26060 10810 1 15 . 1 1 114 114 HIS H H 114 7.934 7.934 8.000 -0.066 26060 10811 1 15 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.102 -0.302 26060 10812 1 15 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.178 0.912 26060 10813 1 15 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.789 -1.109 26060 10814 1 15 . 1 1 116 116 PRO C C 116 176.600 176.600 175.798 0.802 26060 10815 1 15 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.216 0.084 26060 10816 1 15 . 1 1 117 117 VAL N N 117 127.480 127.480 126.825 0.655 26060 10817 1 15 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.321 -0.531 26060 10818 1 15 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.756 0.944 26060 10819 1 15 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.266 -0.066 26060 10820 1 15 . 1 1 117 117 VAL H H 117 8.890 8.890 8.000 0.890 26060 10821 1 15 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.924 0.066 26060 10822 1 15 . 1 1 118 118 ASN C C 118 172.700 172.700 173.685 -0.985 26060 10823 1 15 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.391 -0.030 26060 10824 1 15 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.368 -1.169 26060 10825 1 15 . 1 1 119 119 HIS N N 119 124.930 124.930 126.111 -1.181 26060 10826 1 15 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.061 -0.241 26060 10827 1 15 . 1 1 119 119 HIS C C 119 173.500 173.500 172.725 0.775 26060 10828 1 15 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.586 1.385 26060 10829 1 15 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.267 0.403 26060 10830 1 15 . 1 1 119 119 HIS H H 119 8.790 8.790 8.636 0.154 26060 10831 1 15 . 1 1 120 120 LEU N N 120 128.280 128.280 123.639 4.641 26060 10832 1 15 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.251 -0.301 26060 10833 1 15 . 1 1 120 120 LEU C C 120 174.030 174.030 174.814 -0.784 26060 10834 1 15 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.662 0.778 26060 10835 1 15 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.480 0.120 26060 10836 1 15 . 1 1 120 120 LEU H H 120 7.460 7.460 8.112 -0.652 26060 10837 1 15 . 1 1 121 121 ARG N N 121 128.060 128.060 122.988 5.072 26060 10838 1 15 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.625 0.015 26060 10839 1 15 . 1 1 121 121 ARG C C 121 173.400 173.400 173.623 -0.223 26060 10840 1 15 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.490 -0.130 26060 10841 1 15 . 1 1 121 121 ARG CB C 121 34.260 34.260 33.668 0.592 26060 10842 1 15 . 1 1 121 121 ARG H H 121 9.860 9.860 9.179 0.681 26060 10843 1 15 . 1 1 122 122 CYS N N 122 125.290 125.290 122.525 2.765 26060 10844 1 15 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.158 -0.138 26060 10845 1 15 . 1 1 122 122 CYS C C 122 174.600 174.600 174.654 -0.054 26060 10846 1 15 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.717 1.573 26060 10847 1 15 . 1 1 122 122 CYS CB C 122 28.030 28.030 28.890 -0.860 26060 10848 1 15 . 1 1 122 122 CYS H H 122 8.835 8.835 8.699 0.136 26060 10849 1 15 . 1 1 123 123 GLU N N 123 125.920 125.920 124.522 1.398 26060 10850 1 15 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.491 0.189 26060 10851 1 15 . 1 1 123 123 GLU C C 123 174.500 174.500 174.603 -0.103 26060 10852 1 15 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.731 -0.311 26060 10853 1 15 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.944 0.639 26060 10854 1 15 . 1 1 123 123 GLU H H 123 8.970 8.970 9.220 -0.250 26060 10855 1 15 . 1 1 124 124 LYS N N 124 121.837 121.837 123.101 -1.264 26060 10856 1 15 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.625 0.335 26060 10857 1 15 . 1 1 124 124 LYS C C 124 175.700 175.700 175.795 -0.095 26060 10858 1 15 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.258 0.099 26060 10859 1 15 . 1 1 124 124 LYS CB C 124 34.189 34.189 33.816 0.374 26060 10860 1 15 . 1 1 124 124 LYS H H 124 8.652 8.652 8.458 0.194 26060 10861 1 15 . 1 1 125 125 LEU N N 125 127.000 127.000 130.577 -3.577 26060 10862 1 15 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.587 0.063 26060 10863 1 15 . 1 1 125 125 LEU C C 125 175.110 175.110 175.528 -0.418 26060 10864 1 15 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.766 0.088 26060 10865 1 15 . 1 1 125 125 LEU CB C 125 44.267 44.267 42.792 1.475 26060 10866 1 15 . 1 1 125 125 LEU H H 125 9.175 9.175 9.113 0.062 26060 10867 1 15 . 1 1 126 126 THR N N 126 117.779 117.779 120.029 -2.250 26060 10868 1 15 . 1 1 126 126 THR HA H 126 4.650 4.650 4.629 0.021 26060 10869 1 15 . 1 1 126 126 THR C C 126 173.200 173.200 173.662 -0.462 26060 10870 1 15 . 1 1 126 126 THR CA C 126 62.036 62.036 61.568 0.468 26060 10871 1 15 . 1 1 126 126 THR CB C 126 70.284 70.284 69.302 0.982 26060 10872 1 15 . 1 1 126 126 THR H H 126 8.331 8.331 8.373 -0.042 26060 10873 1 15 . 1 1 127 127 PHE N N 127 126.576 126.576 126.708 -0.132 26060 10874 1 15 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.737 -0.147 26060 10875 1 15 . 1 1 127 127 PHE C C 127 174.860 174.860 174.768 0.092 26060 10876 1 15 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.619 0.245 26060 10877 1 15 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.216 -1.216 26060 10878 1 15 . 1 1 127 127 PHE H H 127 9.051 9.051 8.880 0.171 26060 10879 1 15 . 1 1 128 128 ASN N N 128 123.040 123.040 122.495 0.545 26060 10880 1 15 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.553 0.067 26060 10881 1 15 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.556 0.924 26060 10882 1 15 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.550 0.910 26060 10883 1 15 . 1 1 128 128 ASN H H 128 8.880 8.880 8.690 0.190 26060 10884 1 15 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.544 0.216 26060 10885 1 15 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.316 -0.416 26060 10886 1 15 . 1 1 129 129 ASN CB C 129 38.730 38.730 38.306 0.424 26060 10887 1 15 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.647 0.143 26060 10888 1 15 . 1 1 130 130 PRO C C 130 177.470 177.470 175.628 1.842 26060 10889 1 15 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.478 0.096 26060 10890 1 15 . 1 1 130 130 PRO CB C 130 32.310 32.310 34.098 -1.788 26060 10891 1 15 . 1 1 131 131 THR N N 131 113.400 113.400 114.377 -0.977 26060 10892 1 15 . 1 1 131 131 THR HA H 131 4.300 4.300 4.227 0.073 26060 10893 1 15 . 1 1 131 131 THR C C 131 175.200 175.200 176.170 -0.970 26060 10894 1 15 . 1 1 131 131 THR CA C 131 62.200 62.200 61.741 0.459 26060 10895 1 15 . 1 1 131 131 THR CB C 131 70.600 70.600 70.993 -0.393 26060 10896 1 15 . 1 1 131 131 THR H H 131 8.950 8.950 9.195 -0.245 26060 10897 1 15 . 1 1 132 132 GLU N N 132 122.199 122.199 125.953 -3.754 26060 10898 1 15 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.022 -0.012 26060 10899 1 15 . 1 1 132 132 GLU C C 132 178.700 178.700 178.276 0.424 26060 10900 1 15 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.112 0.182 26060 10901 1 15 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.597 -0.436 26060 10902 1 15 . 1 1 132 132 GLU H H 132 8.932 8.932 9.045 -0.113 26060 10903 1 15 . 1 1 133 133 ASP N N 133 116.324 116.324 119.628 -3.304 26060 10904 1 15 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.381 -0.051 26060 10905 1 15 . 1 1 133 133 ASP C C 133 177.800 177.800 179.185 -1.385 26060 10906 1 15 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.656 -0.110 26060 10907 1 15 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.669 1.154 26060 10908 1 15 . 1 1 133 133 ASP H H 133 8.490 8.490 7.917 0.573 26060 10909 1 15 . 1 1 134 134 PHE N N 134 119.914 119.914 121.951 -2.037 26060 10910 1 15 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.306 0.304 26060 10911 1 15 . 1 1 134 134 PHE C C 134 177.300 177.300 176.790 0.510 26060 10912 1 15 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.423 0.114 26060 10913 1 15 . 1 1 134 134 PHE CB C 134 39.200 39.200 39.031 0.169 26060 10914 1 15 . 1 1 134 134 PHE H H 134 7.787 7.787 7.627 0.160 26060 10915 1 15 . 1 1 135 135 ARG N N 135 119.794 119.794 120.007 -0.213 26060 10916 1 15 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.639 -0.289 26060 10917 1 15 . 1 1 135 135 ARG C C 135 177.370 177.370 178.229 -0.859 26060 10918 1 15 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.871 0.505 26060 10919 1 15 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.870 0.526 26060 10920 1 15 . 1 1 135 135 ARG H H 135 9.087 9.087 8.601 0.486 26060 10921 1 15 . 1 1 136 136 ARG N N 136 114.554 114.554 118.808 -4.254 26060 10922 1 15 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.896 -0.076 26060 10923 1 15 . 1 1 136 136 ARG C C 136 178.950 178.950 178.640 0.310 26060 10924 1 15 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.884 -0.084 26060 10925 1 15 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.172 0.045 26060 10926 1 15 . 1 1 136 136 ARG H H 136 7.747 7.747 8.449 -0.702 26060 10927 1 15 . 1 1 137 137 LYS N N 137 118.298 118.298 119.006 -0.708 26060 10928 1 15 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.972 -0.072 26060 10929 1 15 . 1 1 137 137 LYS C C 137 177.980 177.980 179.039 -1.059 26060 10930 1 15 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.525 0.870 26060 10931 1 15 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.429 0.018 26060 10932 1 15 . 1 1 137 137 LYS H H 137 7.154 7.154 7.438 -0.284 26060 10933 1 15 . 1 1 138 138 LEU N N 138 117.159 117.159 118.732 -1.573 26060 10934 1 15 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.700 -0.280 26060 10935 1 15 . 1 1 138 138 LEU C C 138 179.100 179.100 178.853 0.247 26060 10936 1 15 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.272 -0.041 26060 10937 1 15 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.322 1.006 26060 10938 1 15 . 1 1 138 138 LEU H H 138 7.709 7.709 7.719 -0.010 26060 10939 1 15 . 1 1 139 139 LEU N N 139 115.158 115.158 116.597 -1.439 26060 10940 1 15 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.045 0.105 26060 10941 1 15 . 1 1 139 139 LEU C C 139 177.600 177.600 178.793 -1.193 26060 10942 1 15 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.709 -1.180 26060 10943 1 15 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.875 -0.131 26060 10944 1 15 . 1 1 139 139 LEU H H 139 7.507 7.507 7.921 -0.414 26060 10945 1 15 . 1 1 140 140 LYS N N 140 120.256 120.256 118.241 2.015 26060 10946 1 15 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.022 0.088 26060 10947 1 15 . 1 1 140 140 LYS C C 140 175.800 175.800 177.157 -1.357 26060 10948 1 15 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.388 -0.336 26060 10949 1 15 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.394 0.252 26060 10950 1 15 . 1 1 140 140 LYS H H 140 7.304 7.304 7.497 -0.193 26060 10951 1 16 . 1 1 4 4 MET C C 4 175.800 175.800 174.722 1.078 26060 10952 1 16 . 1 1 4 4 MET CA C 4 55.350 55.350 56.884 -1.534 26060 10953 1 16 . 1 1 4 4 MET CB C 4 32.880 32.880 32.397 0.483 26060 10954 1 16 . 1 1 5 5 ALA N N 5 125.230 125.230 122.349 2.881 26060 10955 1 16 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.518 -0.168 26060 10956 1 16 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.607 0.823 26060 10957 1 16 . 1 1 5 5 ALA CB C 5 19.370 19.370 20.503 -1.133 26060 10958 1 16 . 1 1 5 5 ALA H H 5 8.320 8.320 8.072 0.248 26060 10959 1 16 . 1 1 6 6 SER HA H 6 4.490 4.490 4.571 -0.081 26060 10960 1 16 . 1 1 6 6 SER CA C 6 58.200 58.200 57.317 0.883 26060 10961 1 16 . 1 1 6 6 SER CB C 6 63.700 63.700 62.397 1.303 26060 10962 1 16 . 1 1 7 7 SER HA H 7 4.530 4.530 4.740 -0.210 26060 10963 1 16 . 1 1 7 7 SER CA C 7 58.200 58.200 58.561 -0.361 26060 10964 1 16 . 1 1 7 7 SER CB C 7 63.700 63.700 63.378 0.322 26060 10965 1 16 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.807 -0.197 26060 10966 1 16 . 1 1 8 8 CYS C C 8 173.500 173.500 173.606 -0.106 26060 10967 1 16 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.595 1.745 26060 10968 1 16 . 1 1 8 8 CYS CB C 8 28.490 28.490 28.266 0.224 26060 10969 1 16 . 1 1 9 9 ALA N N 9 124.700 124.700 129.402 -4.702 26060 10970 1 16 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.123 -0.333 26060 10971 1 16 . 1 1 9 9 ALA C C 9 177.400 177.400 176.887 0.513 26060 10972 1 16 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.456 1.614 26060 10973 1 16 . 1 1 9 9 ALA CB C 9 20.629 20.629 20.458 0.171 26060 10974 1 16 . 1 1 9 9 ALA H H 9 7.960 7.960 8.637 -0.677 26060 10975 1 16 . 1 1 10 10 VAL N N 10 120.124 120.124 124.715 -4.591 26060 10976 1 16 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.121 0.169 26060 10977 1 16 . 1 1 10 10 VAL C C 10 173.900 173.900 175.091 -1.191 26060 10978 1 16 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.564 -0.014 26060 10979 1 16 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.307 2.592 26060 10980 1 16 . 1 1 10 10 VAL H H 10 8.424 8.424 8.508 -0.084 26060 10981 1 16 . 1 1 11 11 GLN N N 11 125.818 125.818 127.148 -1.330 26060 10982 1 16 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.319 0.241 26060 10983 1 16 . 1 1 11 11 GLN C C 11 175.400 175.400 175.236 0.164 26060 10984 1 16 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.749 -0.626 26060 10985 1 16 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.362 1.667 26060 10986 1 16 . 1 1 11 11 GLN H H 11 8.636 8.636 8.591 0.045 26060 10987 1 16 . 1 1 12 12 VAL N N 12 119.106 119.106 119.123 -0.017 26060 10988 1 16 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.401 0.229 26060 10989 1 16 . 1 1 12 12 VAL C C 12 173.800 173.800 174.619 -0.819 26060 10990 1 16 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.187 0.613 26060 10991 1 16 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.755 1.956 26060 10992 1 16 . 1 1 12 12 VAL H H 12 8.827 8.827 8.902 -0.075 26060 10993 1 16 . 1 1 13 13 LYS N N 13 121.700 121.700 125.668 -3.968 26060 10994 1 16 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.262 -0.062 26060 10995 1 16 . 1 1 13 13 LYS C C 13 175.030 175.030 176.151 -1.121 26060 10996 1 16 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.057 0.373 26060 10997 1 16 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.222 1.698 26060 10998 1 16 . 1 1 13 13 LYS H H 13 8.234 8.234 8.518 -0.284 26060 10999 1 16 . 1 1 14 14 LEU N N 14 119.100 119.100 123.712 -4.612 26060 11000 1 16 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.200 -0.250 26060 11001 1 16 . 1 1 14 14 LEU C C 14 175.110 175.110 175.876 -0.766 26060 11002 1 16 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.259 0.098 26060 11003 1 16 . 1 1 14 14 LEU CB C 14 46.921 46.921 46.001 0.920 26060 11004 1 16 . 1 1 14 14 LEU H H 14 8.840 8.840 8.245 0.595 26060 11005 1 16 . 1 1 15 15 GLU N N 15 120.978 120.978 119.937 1.041 26060 11006 1 16 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.028 -0.038 26060 11007 1 16 . 1 1 15 15 GLU C C 15 173.800 173.800 174.475 -0.675 26060 11008 1 16 . 1 1 15 15 GLU CA C 15 55.428 55.428 55.131 0.297 26060 11009 1 16 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.462 -1.635 26060 11010 1 16 . 1 1 15 15 GLU H H 15 9.181 9.181 8.990 0.191 26060 11011 1 16 . 1 1 16 16 LEU N N 16 124.438 124.438 126.021 -1.583 26060 11012 1 16 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.344 -0.234 26060 11013 1 16 . 1 1 16 16 LEU C C 16 174.700 174.700 176.199 -1.499 26060 11014 1 16 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.566 0.510 26060 11015 1 16 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.958 1.934 26060 11016 1 16 . 1 1 16 16 LEU H H 16 8.891 8.891 8.657 0.234 26060 11017 1 16 . 1 1 17 17 GLY N N 17 108.067 108.067 108.094 -0.027 26060 11018 1 16 . 1 1 17 17 GLY C C 17 170.350 170.350 172.274 -1.924 26060 11019 1 16 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.392 1.592 26060 11020 1 16 . 1 1 17 17 GLY H H 17 7.227 7.227 8.427 -1.200 26060 11021 1 16 . 1 1 18 18 HIS N N 18 111.200 111.200 118.267 -7.067 26060 11022 1 16 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.806 -0.186 26060 11023 1 16 . 1 1 18 18 HIS C C 18 172.400 172.400 172.668 -0.268 26060 11024 1 16 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.776 -0.836 26060 11025 1 16 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.506 1.654 26060 11026 1 16 . 1 1 18 18 HIS H H 18 8.150 8.150 9.163 -1.013 26060 11027 1 16 . 1 1 19 19 ARG N N 19 117.800 117.800 122.055 -4.255 26060 11028 1 16 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.676 0.424 26060 11029 1 16 . 1 1 19 19 ARG C C 19 175.800 175.800 174.139 1.661 26060 11030 1 16 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.086 -0.586 26060 11031 1 16 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.066 -0.416 26060 11032 1 16 . 1 1 19 19 ARG H H 19 9.010 9.010 8.994 0.016 26060 11033 1 16 . 1 1 20 20 ALA N N 20 120.390 120.390 121.984 -1.594 26060 11034 1 16 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.569 -0.039 26060 11035 1 16 . 1 1 20 20 ALA C C 20 175.800 175.800 175.177 0.623 26060 11036 1 16 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.868 1.322 26060 11037 1 16 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.210 0.539 26060 11038 1 16 . 1 1 20 20 ALA H H 20 8.070 8.070 8.359 -0.289 26060 11039 1 16 . 1 1 21 21 GLN N N 21 121.790 121.790 121.751 0.039 26060 11040 1 16 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.049 0.181 26060 11041 1 16 . 1 1 21 21 GLN CA C 21 54.330 54.330 53.934 0.396 26060 11042 1 16 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.379 -0.479 26060 11043 1 16 . 1 1 21 21 GLN H H 21 9.240 9.240 9.085 0.155 26060 11044 1 16 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.341 -0.711 26060 11045 1 16 . 1 1 22 22 VAL C C 22 176.500 176.500 175.183 1.317 26060 11046 1 16 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.006 3.024 26060 11047 1 16 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.528 -1.928 26060 11048 1 16 . 1 1 23 23 ARG N N 23 127.840 127.840 127.712 0.128 26060 11049 1 16 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.562 -0.432 26060 11050 1 16 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.386 1.214 26060 11051 1 16 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.857 1.293 26060 11052 1 16 . 1 1 23 23 ARG H H 23 8.720 8.720 8.396 0.324 26060 11053 1 16 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.171 -0.131 26060 11054 1 16 . 1 1 24 24 LYS C C 24 176.960 176.960 176.446 0.514 26060 11055 1 16 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.769 1.032 26060 11056 1 16 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.083 -0.023 26060 11057 1 16 . 1 1 25 25 LYS N N 25 115.870 115.870 120.127 -4.257 26060 11058 1 16 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.654 0.176 26060 11059 1 16 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.742 -0.782 26060 11060 1 16 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.286 1.794 26060 11061 1 16 . 1 1 25 25 LYS H H 25 7.720 7.720 7.620 0.100 26060 11062 1 16 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.691 0.139 26060 11063 1 16 . 1 1 26 26 PRO C C 26 177.400 177.400 176.789 0.611 26060 11064 1 16 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.760 -0.110 26060 11065 1 16 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.371 0.019 26060 11066 1 16 . 1 1 27 27 THR N N 27 111.270 111.270 114.818 -3.548 26060 11067 1 16 . 1 1 27 27 THR HA H 27 4.530 4.530 4.178 0.352 26060 11068 1 16 . 1 1 27 27 THR C C 27 177.300 177.300 176.906 0.394 26060 11069 1 16 . 1 1 27 27 THR CA C 27 61.300 61.300 61.312 -0.012 26060 11070 1 16 . 1 1 27 27 THR CB C 27 71.460 71.460 69.961 1.499 26060 11071 1 16 . 1 1 27 27 THR H H 27 8.380 8.380 8.021 0.359 26060 11072 1 16 . 1 1 28 28 VAL N N 28 121.170 121.170 122.806 -1.636 26060 11073 1 16 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.809 0.074 26060 11074 1 16 . 1 1 28 28 VAL C C 28 177.030 177.030 176.039 0.991 26060 11075 1 16 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.095 0.105 26060 11076 1 16 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.658 -0.258 26060 11077 1 16 . 1 1 28 28 VAL H H 28 8.910 8.910 8.545 0.365 26060 11078 1 16 . 1 1 29 29 GLU N N 29 116.800 116.800 116.670 0.130 26060 11079 1 16 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.184 -0.264 26060 11080 1 16 . 1 1 29 29 GLU C C 29 176.200 176.200 175.910 0.290 26060 11081 1 16 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.403 1.847 26060 11082 1 16 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.542 -1.372 26060 11083 1 16 . 1 1 29 29 GLU H H 29 7.990 7.990 7.765 0.225 26060 11084 1 16 . 1 1 30 30 GLY N N 30 105.500 105.500 107.828 -2.328 26060 11085 1 16 . 1 1 30 30 GLY C C 30 174.900 174.900 173.941 0.959 26060 11086 1 16 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.201 -0.741 26060 11087 1 16 . 1 1 30 30 GLY H H 30 7.950 7.950 7.829 0.121 26060 11088 1 16 . 1 1 31 31 PHE N N 31 119.300 119.300 118.943 0.357 26060 11089 1 16 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.995 -0.235 26060 11090 1 16 . 1 1 31 31 PHE C C 31 176.400 176.400 175.883 0.517 26060 11091 1 16 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.487 1.413 26060 11092 1 16 . 1 1 31 31 PHE CB C 31 35.500 35.500 38.964 -3.464 26060 11093 1 16 . 1 1 31 31 PHE H H 31 7.520 7.520 7.359 0.161 26060 11094 1 16 . 1 1 32 32 THR N N 32 112.300 112.300 117.713 -5.413 26060 11095 1 16 . 1 1 32 32 THR HA H 32 4.330 4.330 4.406 -0.076 26060 11096 1 16 . 1 1 32 32 THR C C 32 175.200 175.200 174.091 1.109 26060 11097 1 16 . 1 1 32 32 THR CA C 32 62.780 62.780 62.928 -0.148 26060 11098 1 16 . 1 1 32 32 THR CB C 32 70.350 70.350 70.239 0.111 26060 11099 1 16 . 1 1 32 32 THR H H 32 7.770 7.770 9.048 -1.278 26060 11100 1 16 . 1 1 33 33 HIS N N 33 121.900 121.900 122.809 -0.909 26060 11101 1 16 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.232 0.268 26060 11102 1 16 . 1 1 33 33 HIS C C 33 173.880 173.880 173.548 0.332 26060 11103 1 16 . 1 1 33 33 HIS CA C 33 56.780 56.780 57.105 -0.325 26060 11104 1 16 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.027 3.613 26060 11105 1 16 . 1 1 33 33 HIS H H 33 9.110 9.110 8.868 0.242 26060 11106 1 16 . 1 1 34 34 ASP N N 34 120.300 120.300 125.063 -4.763 26060 11107 1 16 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.502 -0.102 26060 11108 1 16 . 1 1 34 34 ASP C C 34 175.100 175.100 174.989 0.111 26060 11109 1 16 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.798 -0.488 26060 11110 1 16 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.595 -0.495 26060 11111 1 16 . 1 1 34 34 ASP H H 34 8.810 8.810 8.834 -0.024 26060 11112 1 16 . 1 1 35 35 TRP N N 35 119.800 119.800 120.799 -0.999 26060 11113 1 16 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.575 0.155 26060 11114 1 16 . 1 1 35 35 TRP C C 35 174.900 174.900 173.350 1.550 26060 11115 1 16 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.900 0.000 26060 11116 1 16 . 1 1 35 35 TRP CB C 35 35.070 35.070 32.990 2.080 26060 11117 1 16 . 1 1 35 35 TRP H H 35 9.250 9.250 8.929 0.321 26060 11118 1 16 . 1 1 36 36 MET N N 36 120.980 120.980 122.862 -1.882 26060 11119 1 16 . 1 1 36 36 MET HA H 36 5.750 5.750 5.924 -0.174 26060 11120 1 16 . 1 1 36 36 MET C C 36 173.700 173.700 174.481 -0.781 26060 11121 1 16 . 1 1 36 36 MET CA C 36 54.830 54.830 53.918 0.912 26060 11122 1 16 . 1 1 36 36 MET CB C 36 35.220 35.220 36.436 -1.216 26060 11123 1 16 . 1 1 36 36 MET H H 36 9.080 9.080 8.912 0.168 26060 11124 1 16 . 1 1 37 37 VAL N N 37 126.220 126.220 121.951 4.269 26060 11125 1 16 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.054 0.256 26060 11126 1 16 . 1 1 37 37 VAL C C 37 172.300 172.300 174.462 -2.162 26060 11127 1 16 . 1 1 37 37 VAL CA C 37 58.540 58.540 60.022 -1.482 26060 11128 1 16 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.492 1.578 26060 11129 1 16 . 1 1 37 37 VAL H H 37 9.080 9.080 8.879 0.201 26060 11130 1 16 . 1 1 38 38 PHE N N 38 120.640 120.640 122.196 -1.556 26060 11131 1 16 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.330 0.640 26060 11132 1 16 . 1 1 38 38 PHE C C 38 172.960 172.960 175.049 -2.089 26060 11133 1 16 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.792 -0.662 26060 11134 1 16 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.480 -0.480 26060 11135 1 16 . 1 1 38 38 PHE H H 38 8.320 8.320 9.024 -0.704 26060 11136 1 16 . 1 1 39 39 VAL N N 39 116.500 116.500 120.907 -4.407 26060 11137 1 16 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.700 -0.690 26060 11138 1 16 . 1 1 39 39 VAL C C 39 174.700 174.700 174.424 0.276 26060 11139 1 16 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.897 1.743 26060 11140 1 16 . 1 1 39 39 VAL CB C 39 35.400 35.400 34.063 1.337 26060 11141 1 16 . 1 1 39 39 VAL H H 39 8.580 8.580 9.268 -0.688 26060 11142 1 16 . 1 1 40 40 ARG N N 40 124.100 124.100 124.289 -0.189 26060 11143 1 16 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.945 0.135 26060 11144 1 16 . 1 1 40 40 ARG C C 40 173.800 173.800 174.092 -0.292 26060 11145 1 16 . 1 1 40 40 ARG CA C 40 54.930 54.930 56.051 -1.121 26060 11146 1 16 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.557 1.023 26060 11147 1 16 . 1 1 40 40 ARG H H 40 9.880 9.880 8.737 1.143 26060 11148 1 16 . 1 1 41 41 GLY N N 41 107.640 107.640 106.340 1.300 26060 11149 1 16 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.588 1.382 26060 11150 1 16 . 1 1 41 41 GLY H H 41 8.910 8.910 8.595 0.315 26060 11151 1 16 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.383 0.107 26060 11152 1 16 . 1 1 42 42 PRO C C 42 177.300 177.300 176.957 0.343 26060 11153 1 16 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.385 0.055 26060 11154 1 16 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.565 -0.455 26060 11155 1 16 . 1 1 43 43 GLU N N 43 121.050 121.050 120.652 0.398 26060 11156 1 16 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.119 -0.329 26060 11157 1 16 . 1 1 43 43 GLU C C 43 176.110 176.110 176.837 -0.727 26060 11158 1 16 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.739 -0.889 26060 11159 1 16 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.796 -0.946 26060 11160 1 16 . 1 1 43 43 GLU H H 43 9.060 9.060 8.793 0.267 26060 11161 1 16 . 1 1 44 44 HIS N N 44 114.100 114.100 117.088 -2.988 26060 11162 1 16 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.295 0.056 26060 11163 1 16 . 1 1 44 44 HIS C C 44 175.170 175.170 174.501 0.669 26060 11164 1 16 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.976 0.674 26060 11165 1 16 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.576 -0.206 26060 11166 1 16 . 1 1 44 44 HIS H H 44 8.420 8.420 8.682 -0.262 26060 11167 1 16 . 1 1 45 45 SER N N 45 115.540 115.540 118.001 -2.461 26060 11168 1 16 . 1 1 45 45 SER HA H 45 4.560 4.560 4.321 0.239 26060 11169 1 16 . 1 1 45 45 SER C C 45 173.700 173.700 174.005 -0.305 26060 11170 1 16 . 1 1 45 45 SER CA C 45 58.710 58.710 57.225 1.484 26060 11171 1 16 . 1 1 45 45 SER CB C 45 65.040 65.040 63.403 1.637 26060 11172 1 16 . 1 1 45 45 SER H H 45 7.870 7.870 7.644 0.226 26060 11173 1 16 . 1 1 46 46 ASN N N 46 123.900 123.900 124.370 -0.470 26060 11174 1 16 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.937 0.183 26060 11175 1 16 . 1 1 46 46 ASN C C 46 176.300 176.300 175.685 0.615 26060 11176 1 16 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.558 0.132 26060 11177 1 16 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.027 -1.297 26060 11178 1 16 . 1 1 46 46 ASN H H 46 9.480 9.480 8.472 1.008 26060 11179 1 16 . 1 1 47 47 ILE N N 47 115.240 115.240 121.111 -5.871 26060 11180 1 16 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.437 0.503 26060 11181 1 16 . 1 1 47 47 ILE C C 47 176.000 176.000 176.607 -0.607 26060 11182 1 16 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.904 0.296 26060 11183 1 16 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.288 -1.587 26060 11184 1 16 . 1 1 47 47 ILE H H 47 8.170 8.170 8.394 -0.224 26060 11185 1 16 . 1 1 48 48 GLN N N 48 123.200 123.200 119.970 3.230 26060 11186 1 16 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.159 0.121 26060 11187 1 16 . 1 1 48 48 GLN C C 48 175.670 175.670 176.657 -0.987 26060 11188 1 16 . 1 1 48 48 GLN CA C 48 57.900 57.900 57.965 -0.065 26060 11189 1 16 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.256 -0.266 26060 11190 1 16 . 1 1 48 48 GLN H H 48 8.850 8.850 8.562 0.288 26060 11191 1 16 . 1 1 49 49 HIS N N 49 115.400 115.400 116.427 -1.027 26060 11192 1 16 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.392 0.178 26060 11193 1 16 . 1 1 49 49 HIS C C 49 176.380 176.380 176.939 -0.559 26060 11194 1 16 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.727 0.023 26060 11195 1 16 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.511 1.109 26060 11196 1 16 . 1 1 49 49 HIS H H 49 7.400 7.400 7.606 -0.206 26060 11197 1 16 . 1 1 50 50 PHE N N 50 109.800 109.800 112.826 -3.026 26060 11198 1 16 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.918 0.312 26060 11199 1 16 . 1 1 50 50 PHE C C 50 173.800 173.800 174.295 -0.495 26060 11200 1 16 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.801 -0.141 26060 11201 1 16 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.653 1.347 26060 11202 1 16 . 1 1 50 50 PHE H H 50 7.570 7.570 7.485 0.085 26060 11203 1 16 . 1 1 51 51 VAL N N 51 127.810 127.810 120.259 7.551 26060 11204 1 16 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.940 -0.570 26060 11205 1 16 . 1 1 51 51 VAL C C 51 174.500 174.500 174.562 -0.062 26060 11206 1 16 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.424 1.576 26060 11207 1 16 . 1 1 51 51 VAL CB C 51 33.280 33.280 35.016 -1.736 26060 11208 1 16 . 1 1 51 51 VAL H H 51 7.810 7.810 8.018 -0.208 26060 11209 1 16 . 1 1 52 52 GLU N N 52 130.700 130.700 127.189 3.511 26060 11210 1 16 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.558 -0.578 26060 11211 1 16 . 1 1 52 52 GLU C C 52 175.400 175.400 175.548 -0.148 26060 11212 1 16 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.041 1.059 26060 11213 1 16 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.460 -0.880 26060 11214 1 16 . 1 1 52 52 GLU H H 52 9.380 9.380 8.893 0.487 26060 11215 1 16 . 1 1 53 53 LYS N N 53 109.200 109.200 114.742 -5.542 26060 11216 1 16 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.066 -0.266 26060 11217 1 16 . 1 1 53 53 LYS C C 53 172.300 172.300 174.663 -2.363 26060 11218 1 16 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.420 0.420 26060 11219 1 16 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.193 -1.943 26060 11220 1 16 . 1 1 53 53 LYS H H 53 7.190 7.190 7.453 -0.263 26060 11221 1 16 . 1 1 54 54 VAL N N 54 120.380 120.380 117.739 2.641 26060 11222 1 16 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.697 0.073 26060 11223 1 16 . 1 1 54 54 VAL C C 54 173.600 173.600 173.859 -0.259 26060 11224 1 16 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.425 -0.385 26060 11225 1 16 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.671 -1.971 26060 11226 1 16 . 1 1 54 54 VAL H H 54 8.450 8.450 8.284 0.166 26060 11227 1 16 . 1 1 55 55 VAL N N 55 126.920 126.920 122.984 3.936 26060 11228 1 16 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.196 -0.496 26060 11229 1 16 . 1 1 55 55 VAL C C 55 173.800 173.800 173.867 -0.067 26060 11230 1 16 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.807 0.063 26060 11231 1 16 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.941 -2.841 26060 11232 1 16 . 1 1 55 55 VAL H H 55 9.260 9.260 8.914 0.346 26060 11233 1 16 . 1 1 56 56 PHE N N 56 126.130 126.130 124.253 1.877 26060 11234 1 16 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.069 -0.379 26060 11235 1 16 . 1 1 56 56 PHE C C 56 174.000 174.000 174.432 -0.432 26060 11236 1 16 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.615 -0.035 26060 11237 1 16 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.701 -1.811 26060 11238 1 16 . 1 1 56 56 PHE H H 56 9.290 9.290 9.264 0.026 26060 11239 1 16 . 1 1 57 57 HIS N N 57 124.180 124.180 123.670 0.510 26060 11240 1 16 . 1 1 57 57 HIS HA H 57 4.800 4.800 5.012 -0.212 26060 11241 1 16 . 1 1 57 57 HIS C C 57 174.700 174.700 174.700 0.000 26060 11242 1 16 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.085 0.235 26060 11243 1 16 . 1 1 57 57 HIS CB C 57 30.100 30.100 29.157 0.943 26060 11244 1 16 . 1 1 57 57 HIS H H 57 8.690 8.690 8.666 0.024 26060 11245 1 16 . 1 1 58 58 LEU N N 58 122.050 122.050 123.036 -0.986 26060 11246 1 16 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.437 -0.197 26060 11247 1 16 . 1 1 58 58 LEU C C 58 174.400 174.400 176.875 -2.475 26060 11248 1 16 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.535 0.875 26060 11249 1 16 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.387 -1.227 26060 11250 1 16 . 1 1 58 58 LEU H H 58 9.050 9.050 8.268 0.782 26060 11251 1 16 . 1 1 59 59 HIS N N 59 118.510 118.510 118.164 0.346 26060 11252 1 16 . 1 1 59 59 HIS C C 59 175.300 175.300 176.459 -1.159 26060 11253 1 16 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.117 2.993 26060 11254 1 16 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.819 0.111 26060 11255 1 16 . 1 1 59 59 HIS H H 59 5.160 5.160 7.879 -2.719 26060 11256 1 16 . 1 1 60 60 GLU N N 60 122.190 122.190 126.366 -4.176 26060 11257 1 16 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.953 0.007 26060 11258 1 16 . 1 1 60 60 GLU C C 60 175.130 175.130 176.830 -1.700 26060 11259 1 16 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.020 -0.010 26060 11260 1 16 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.837 -0.017 26060 11261 1 16 . 1 1 60 60 GLU H H 60 7.960 7.960 8.387 -0.427 26060 11262 1 16 . 1 1 61 61 SER N N 61 116.940 116.940 113.319 3.621 26060 11263 1 16 . 1 1 61 61 SER HA H 61 4.200 4.200 4.346 -0.146 26060 11264 1 16 . 1 1 61 61 SER CA C 61 60.010 60.010 59.574 0.436 26060 11265 1 16 . 1 1 61 61 SER CB C 61 63.140 63.140 63.679 -0.539 26060 11266 1 16 . 1 1 61 61 SER H H 61 8.540 8.540 7.953 0.587 26060 11267 1 16 . 1 1 62 62 PHE N N 62 123.700 123.700 122.668 1.032 26060 11268 1 16 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.591 -0.041 26060 11269 1 16 . 1 1 62 62 PHE CA C 62 57.940 57.940 56.012 1.928 26060 11270 1 16 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.797 -0.397 26060 11271 1 16 . 1 1 62 62 PHE H H 62 8.640 8.640 8.161 0.479 26060 11272 1 16 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.451 -0.041 26060 11273 1 16 . 1 1 63 63 PRO C C 63 176.400 176.400 176.111 0.289 26060 11274 1 16 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.344 -0.744 26060 11275 1 16 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.047 -0.187 26060 11276 1 16 . 1 1 64 64 ARG N N 64 116.840 116.840 120.392 -3.552 26060 11277 1 16 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.110 -0.010 26060 11278 1 16 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.105 -0.495 26060 11279 1 16 . 1 1 64 64 ARG CB C 64 28.830 28.830 29.027 -0.197 26060 11280 1 16 . 1 1 64 64 ARG H H 64 8.890 8.890 8.582 0.308 26060 11281 1 16 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.391 -0.401 26060 11282 1 16 . 1 1 65 65 PRO C C 65 175.800 175.800 177.035 -1.235 26060 11283 1 16 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.949 1.861 26060 11284 1 16 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.989 -0.109 26060 11285 1 16 . 1 1 66 66 LYS N N 66 119.035 119.035 120.185 -1.150 26060 11286 1 16 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.052 -0.442 26060 11287 1 16 . 1 1 66 66 LYS C C 66 175.400 175.400 175.820 -0.420 26060 11288 1 16 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.334 0.119 26060 11289 1 16 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.059 -0.329 26060 11290 1 16 . 1 1 66 66 LYS H H 66 7.630 7.630 7.868 -0.238 26060 11291 1 16 . 1 1 67 67 ARG N N 67 127.394 127.394 127.501 -0.107 26060 11292 1 16 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.618 0.122 26060 11293 1 16 . 1 1 67 67 ARG C C 67 174.500 174.500 174.745 -0.245 26060 11294 1 16 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.684 0.116 26060 11295 1 16 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.424 -1.710 26060 11296 1 16 . 1 1 67 67 ARG H H 67 8.855 8.855 8.750 0.105 26060 11297 1 16 . 1 1 68 68 VAL N N 68 124.388 124.388 119.419 4.969 26060 11298 1 16 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.132 -0.552 26060 11299 1 16 . 1 1 68 68 VAL C C 68 176.850 176.850 175.331 1.519 26060 11300 1 16 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.746 2.327 26060 11301 1 16 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.992 -0.388 26060 11302 1 16 . 1 1 68 68 VAL H H 68 8.681 8.681 8.369 0.312 26060 11303 1 16 . 1 1 69 69 CYS N N 69 127.080 127.080 125.749 1.331 26060 11304 1 16 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.749 0.321 26060 11305 1 16 . 1 1 69 69 CYS CA C 69 58.346 58.346 58.014 0.332 26060 11306 1 16 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.395 0.374 26060 11307 1 16 . 1 1 69 69 CYS H H 69 9.455 9.455 9.048 0.407 26060 11308 1 16 . 1 1 70 70 LYS N N 70 125.480 125.480 123.540 1.940 26060 11309 1 16 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.502 -0.012 26060 11310 1 16 . 1 1 70 70 LYS C C 70 174.300 174.300 175.332 -1.032 26060 11311 1 16 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.231 1.529 26060 11312 1 16 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.200 -0.030 26060 11313 1 16 . 1 1 70 70 LYS H H 70 9.050 9.050 8.572 0.478 26060 11314 1 16 . 1 1 71 71 ASP N N 71 116.940 116.940 119.575 -2.635 26060 11315 1 16 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.762 0.338 26060 11316 1 16 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.940 -0.860 26060 11317 1 16 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.712 1.667 26060 11318 1 16 . 1 1 71 71 ASP H H 71 7.620 7.620 7.484 0.136 26060 11319 1 16 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.103 -0.843 26060 11320 1 16 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.904 -2.254 26060 11321 1 16 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.186 -1.145 26060 11322 1 16 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.169 -0.069 26060 11323 1 16 . 1 1 73 73 PRO C C 73 174.700 174.700 175.940 -1.240 26060 11324 1 16 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.324 -2.634 26060 11325 1 16 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.102 2.938 26060 11326 1 16 . 1 1 74 74 TYR N N 74 125.400 125.400 124.098 1.302 26060 11327 1 16 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.529 0.321 26060 11328 1 16 . 1 1 74 74 TYR C C 74 172.900 172.900 175.538 -2.638 26060 11329 1 16 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.995 -2.325 26060 11330 1 16 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.622 -4.222 26060 11331 1 16 . 1 1 74 74 TYR H H 74 8.960 8.960 8.443 0.517 26060 11332 1 16 . 1 1 75 75 LYS N N 75 121.400 121.400 118.900 2.500 26060 11333 1 16 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.149 0.441 26060 11334 1 16 . 1 1 75 75 LYS C C 75 173.800 173.800 174.281 -0.481 26060 11335 1 16 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.666 -0.016 26060 11336 1 16 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.745 -0.855 26060 11337 1 16 . 1 1 75 75 LYS H H 75 7.670 7.670 7.995 -0.325 26060 11338 1 16 . 1 1 76 76 VAL N N 76 119.800 119.800 119.477 0.323 26060 11339 1 16 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.144 -0.254 26060 11340 1 16 . 1 1 76 76 VAL C C 76 173.900 173.900 173.883 0.017 26060 11341 1 16 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.463 1.267 26060 11342 1 16 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.678 -0.138 26060 11343 1 16 . 1 1 76 76 VAL H H 76 8.180 8.180 7.827 0.353 26060 11344 1 16 . 1 1 77 77 GLU N N 77 126.190 126.190 127.141 -0.951 26060 11345 1 16 . 1 1 77 77 GLU HA H 77 4.950 4.950 5.001 -0.051 26060 11346 1 16 . 1 1 77 77 GLU C C 77 174.700 174.700 175.246 -0.546 26060 11347 1 16 . 1 1 77 77 GLU CA C 77 54.940 54.940 54.711 0.229 26060 11348 1 16 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.047 0.503 26060 11349 1 16 . 1 1 77 77 GLU H H 77 8.270 8.270 8.581 -0.311 26060 11350 1 16 . 1 1 78 78 GLU N N 78 126.180 126.180 124.115 2.065 26060 11351 1 16 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.600 -0.150 26060 11352 1 16 . 1 1 78 78 GLU C C 78 175.400 175.400 173.972 1.428 26060 11353 1 16 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.918 0.124 26060 11354 1 16 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.892 3.208 26060 11355 1 16 . 1 1 78 78 GLU H H 78 7.870 7.870 8.586 -0.716 26060 11356 1 16 . 1 1 79 79 SER N N 79 112.109 112.109 113.370 -1.261 26060 11357 1 16 . 1 1 79 79 SER HA H 79 5.560 5.560 5.332 0.228 26060 11358 1 16 . 1 1 79 79 SER C C 79 172.490 172.490 173.272 -0.782 26060 11359 1 16 . 1 1 79 79 SER CA C 79 57.754 57.754 56.469 1.285 26060 11360 1 16 . 1 1 79 79 SER CB C 79 65.861 65.861 65.337 0.524 26060 11361 1 16 . 1 1 79 79 SER H H 79 7.714 7.714 8.355 -0.641 26060 11362 1 16 . 1 1 80 80 GLY N N 80 106.048 106.048 110.763 -4.715 26060 11363 1 16 . 1 1 80 80 GLY C C 80 172.630 172.630 171.903 0.727 26060 11364 1 16 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.608 0.963 26060 11365 1 16 . 1 1 80 80 GLY H H 80 8.828 8.828 8.998 -0.170 26060 11366 1 16 . 1 1 81 81 TYR N N 81 115.280 115.280 114.306 0.974 26060 11367 1 16 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.330 0.350 26060 11368 1 16 . 1 1 81 81 TYR C C 81 174.100 174.100 174.285 -0.185 26060 11369 1 16 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.714 -1.214 26060 11370 1 16 . 1 1 81 81 TYR CB C 81 41.340 41.340 38.920 2.420 26060 11371 1 16 . 1 1 81 81 TYR H H 81 8.770 8.770 8.063 0.707 26060 11372 1 16 . 1 1 82 82 ALA N N 82 122.350 122.350 122.547 -0.197 26060 11373 1 16 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.450 -0.050 26060 11374 1 16 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.659 0.381 26060 11375 1 16 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.014 1.386 26060 11376 1 16 . 1 1 82 82 ALA H H 82 7.160 7.160 7.449 -0.289 26060 11377 1 16 . 1 1 83 83 GLY N N 83 107.100 107.100 106.567 0.533 26060 11378 1 16 . 1 1 83 83 GLY C C 83 172.500 172.500 173.626 -1.126 26060 11379 1 16 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.048 0.562 26060 11380 1 16 . 1 1 83 83 GLY H H 83 8.220 8.220 8.240 -0.020 26060 11381 1 16 . 1 1 84 84 PHE N N 84 111.660 111.660 114.531 -2.871 26060 11382 1 16 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.566 0.124 26060 11383 1 16 . 1 1 84 84 PHE C C 84 172.460 172.460 173.077 -0.617 26060 11384 1 16 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.432 0.068 26060 11385 1 16 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.539 -0.959 26060 11386 1 16 . 1 1 84 84 PHE H H 84 7.700 7.700 7.952 -0.252 26060 11387 1 16 . 1 1 85 85 ILE N N 85 117.810 117.810 121.197 -3.387 26060 11388 1 16 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.101 0.209 26060 11389 1 16 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.987 -1.647 26060 11390 1 16 . 1 1 85 85 ILE CB C 85 35.260 35.260 36.877 -1.617 26060 11391 1 16 . 1 1 85 85 ILE H H 85 8.340 8.340 8.340 0.000 26060 11392 1 16 . 1 1 86 86 LEU N N 86 108.130 108.130 129.456 -21.326 26060 11393 1 16 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.090 -0.110 26060 11394 1 16 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.120 2.080 26060 11395 1 16 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.359 -0.059 26060 11396 1 16 . 1 1 86 86 LEU H H 86 9.900 9.900 8.767 1.133 26060 11397 1 16 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.493 0.607 26060 11398 1 16 . 1 1 87 87 PRO C C 87 175.340 175.340 175.728 -0.388 26060 11399 1 16 . 1 1 87 87 PRO CA C 87 63.110 63.110 63.075 0.035 26060 11400 1 16 . 1 1 87 87 PRO CB C 87 31.560 31.560 31.355 0.205 26060 11401 1 16 . 1 1 88 88 ILE N N 88 126.000 126.000 123.847 2.153 26060 11402 1 16 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.432 0.358 26060 11403 1 16 . 1 1 88 88 ILE C C 88 176.100 176.100 174.850 1.250 26060 11404 1 16 . 1 1 88 88 ILE CA C 88 60.560 60.560 59.714 0.846 26060 11405 1 16 . 1 1 88 88 ILE CB C 88 42.000 42.000 41.032 0.967 26060 11406 1 16 . 1 1 88 88 ILE H H 88 9.380 9.380 8.535 0.845 26060 11407 1 16 . 1 1 89 89 GLU N N 89 123.900 123.900 124.715 -0.815 26060 11408 1 16 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.228 -0.028 26060 11409 1 16 . 1 1 89 89 GLU C C 89 173.800 173.800 175.456 -1.656 26060 11410 1 16 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.394 -0.424 26060 11411 1 16 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.322 1.058 26060 11412 1 16 . 1 1 89 89 GLU H H 89 9.320 9.320 8.959 0.361 26060 11413 1 16 . 1 1 90 90 VAL N N 90 123.980 123.980 123.881 0.099 26060 11414 1 16 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.150 0.010 26060 11415 1 16 . 1 1 90 90 VAL C C 90 174.800 174.800 174.718 0.082 26060 11416 1 16 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.258 0.733 26060 11417 1 16 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.868 0.622 26060 11418 1 16 . 1 1 90 90 VAL H H 90 8.630 8.630 8.313 0.317 26060 11419 1 16 . 1 1 91 91 TYR N N 91 124.230 124.230 127.582 -3.352 26060 11420 1 16 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.436 0.224 26060 11421 1 16 . 1 1 91 91 TYR C C 91 176.800 176.800 175.558 1.242 26060 11422 1 16 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.035 -1.335 26060 11423 1 16 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.700 1.540 26060 11424 1 16 . 1 1 91 91 TYR H H 91 8.640 8.640 8.963 -0.323 26060 11425 1 16 . 1 1 92 92 PHE N N 92 121.200 121.200 122.545 -1.345 26060 11426 1 16 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.238 0.422 26060 11427 1 16 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.864 1.647 26060 11428 1 16 . 1 1 92 92 PHE CB C 92 42.700 42.700 42.199 0.501 26060 11429 1 16 . 1 1 92 92 PHE H H 92 8.750 8.750 8.981 -0.231 26060 11430 1 16 . 1 1 93 93 LYS N N 93 123.450 123.450 121.908 1.542 26060 11431 1 16 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.566 0.034 26060 11432 1 16 . 1 1 93 93 LYS C C 93 174.200 174.200 174.834 -0.634 26060 11433 1 16 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.987 -0.807 26060 11434 1 16 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.112 -0.432 26060 11435 1 16 . 1 1 93 93 LYS H H 93 8.560 8.560 8.917 -0.357 26060 11436 1 16 . 1 1 94 94 ASN N N 94 118.800 118.800 120.427 -1.627 26060 11437 1 16 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.786 -0.346 26060 11438 1 16 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.212 -1.002 26060 11439 1 16 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.218 -0.417 26060 11440 1 16 . 1 1 94 94 ASN H H 94 7.820 7.820 8.003 -0.183 26060 11441 1 16 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.397 -0.067 26060 11442 1 16 . 1 1 95 95 LYS C C 95 175.800 175.800 175.784 0.016 26060 11443 1 16 . 1 1 95 95 LYS CA C 95 56.210 56.210 55.975 0.235 26060 11444 1 16 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.257 -0.247 26060 11445 1 16 . 1 1 96 96 GLU N N 96 118.330 118.330 119.893 -1.563 26060 11446 1 16 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.285 0.225 26060 11447 1 16 . 1 1 96 96 GLU C C 96 173.200 173.200 175.485 -2.285 26060 11448 1 16 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.486 -1.386 26060 11449 1 16 . 1 1 96 96 GLU CB C 96 31.470 31.470 28.865 2.605 26060 11450 1 16 . 1 1 96 96 GLU H H 96 7.120 7.120 7.686 -0.566 26060 11451 1 16 . 1 1 97 97 GLU N N 97 115.630 115.630 119.752 -4.122 26060 11452 1 16 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.154 0.276 26060 11453 1 16 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.751 -0.891 26060 11454 1 16 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.515 0.755 26060 11455 1 16 . 1 1 97 97 GLU H H 97 8.060 8.060 8.249 -0.189 26060 11456 1 16 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.185 0.815 26060 11457 1 16 . 1 1 98 98 PRO C C 98 175.900 175.900 176.736 -0.836 26060 11458 1 16 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.019 -1.859 26060 11459 1 16 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.837 2.163 26060 11460 1 16 . 1 1 99 99 ARG N N 99 122.800 122.800 119.933 2.867 26060 11461 1 16 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.302 0.328 26060 11462 1 16 . 1 1 99 99 ARG C C 99 175.800 175.800 175.366 0.434 26060 11463 1 16 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.447 0.043 26060 11464 1 16 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.608 -0.198 26060 11465 1 16 . 1 1 99 99 ARG H H 99 8.602 8.602 8.546 0.056 26060 11466 1 16 . 1 1 100 100 LYS N N 100 113.220 113.220 116.129 -2.909 26060 11467 1 16 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.336 0.604 26060 11468 1 16 . 1 1 100 100 LYS C C 100 174.100 174.100 174.225 -0.125 26060 11469 1 16 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.375 -0.465 26060 11470 1 16 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.421 -0.701 26060 11471 1 16 . 1 1 100 100 LYS H H 100 7.650 7.650 7.361 0.289 26060 11472 1 16 . 1 1 101 101 VAL N N 101 116.230 116.230 120.800 -4.570 26060 11473 1 16 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.182 0.088 26060 11474 1 16 . 1 1 101 101 VAL C C 101 171.600 171.600 173.600 -2.000 26060 11475 1 16 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.566 0.694 26060 11476 1 16 . 1 1 101 101 VAL CB C 101 35.180 35.180 34.756 0.424 26060 11477 1 16 . 1 1 101 101 VAL H H 101 8.120 8.120 7.965 0.155 26060 11478 1 16 . 1 1 102 102 ARG N N 102 124.980 124.980 128.403 -3.423 26060 11479 1 16 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.917 0.243 26060 11480 1 16 . 1 1 102 102 ARG C C 102 174.340 174.340 175.137 -0.797 26060 11481 1 16 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.363 -0.613 26060 11482 1 16 . 1 1 102 102 ARG CB C 102 33.350 33.350 30.985 2.365 26060 11483 1 16 . 1 1 102 102 ARG H H 102 7.930 7.930 8.379 -0.449 26060 11484 1 16 . 1 1 103 103 PHE N N 103 124.590 124.590 126.702 -2.112 26060 11485 1 16 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.645 0.147 26060 11486 1 16 . 1 1 103 103 PHE C C 103 174.280 174.280 175.051 -0.771 26060 11487 1 16 . 1 1 103 103 PHE CA C 103 55.980 55.980 55.052 0.928 26060 11488 1 16 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.996 2.254 26060 11489 1 16 . 1 1 103 103 PHE H H 103 9.390 9.390 8.937 0.453 26060 11490 1 16 . 1 1 104 104 ASP N N 104 124.700 124.700 126.699 -1.999 26060 11491 1 16 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.616 0.183 26060 11492 1 16 . 1 1 104 104 ASP C C 104 174.500 174.500 174.933 -0.433 26060 11493 1 16 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.243 0.147 26060 11494 1 16 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.749 0.481 26060 11495 1 16 . 1 1 104 104 ASP H H 104 9.010 9.010 8.910 0.100 26060 11496 1 16 . 1 1 105 105 TYR N N 105 129.840 129.840 124.639 5.201 26060 11497 1 16 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.436 -0.336 26060 11498 1 16 . 1 1 105 105 TYR C C 105 173.100 173.100 173.844 -0.744 26060 11499 1 16 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.850 0.830 26060 11500 1 16 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.454 1.396 26060 11501 1 16 . 1 1 105 105 TYR H H 105 8.140 8.140 8.342 -0.202 26060 11502 1 16 . 1 1 106 106 ASP N N 106 126.800 126.800 128.009 -1.209 26060 11503 1 16 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.379 -0.159 26060 11504 1 16 . 1 1 106 106 ASP C C 106 172.900 172.900 174.586 -1.686 26060 11505 1 16 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.655 -0.145 26060 11506 1 16 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.203 -1.703 26060 11507 1 16 . 1 1 106 106 ASP H H 106 7.730 7.730 8.345 -0.615 26060 11508 1 16 . 1 1 107 107 LEU N N 107 132.150 132.150 128.326 3.824 26060 11509 1 16 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.459 -0.620 26060 11510 1 16 . 1 1 107 107 LEU C C 107 172.100 172.100 174.792 -2.692 26060 11511 1 16 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.784 -0.084 26060 11512 1 16 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.743 -1.503 26060 11513 1 16 . 1 1 107 107 LEU H H 107 7.770 7.770 7.625 0.144 26060 11514 1 16 . 1 1 108 108 PHE N N 108 118.960 118.960 121.796 -2.836 26060 11515 1 16 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.881 -0.191 26060 11516 1 16 . 1 1 108 108 PHE C C 108 174.300 174.300 173.603 0.697 26060 11517 1 16 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.238 -0.548 26060 11518 1 16 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.752 -0.462 26060 11519 1 16 . 1 1 108 108 PHE H H 108 6.060 6.060 7.120 -1.060 26060 11520 1 16 . 1 1 109 109 LEU N N 109 118.900 118.900 122.794 -3.894 26060 11521 1 16 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.673 -0.273 26060 11522 1 16 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.269 -1.109 26060 11523 1 16 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.796 -1.716 26060 11524 1 16 . 1 1 109 109 LEU H H 109 8.388 8.388 8.343 0.045 26060 11525 1 16 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.417 0.023 26060 11526 1 16 . 1 1 111 111 LEU C C 111 177.300 177.300 177.133 0.167 26060 11527 1 16 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.193 -0.973 26060 11528 1 16 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.639 1.231 26060 11529 1 16 . 1 1 112 112 GLU N N 112 120.660 120.660 124.076 -3.416 26060 11530 1 16 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.102 0.068 26060 11531 1 16 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.520 -0.060 26060 11532 1 16 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.050 -0.360 26060 11533 1 16 . 1 1 112 112 GLU H H 112 8.780 8.780 8.882 -0.102 26060 11534 1 16 . 1 1 113 113 GLY C C 113 173.900 173.900 173.568 0.332 26060 11535 1 16 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.907 0.043 26060 11536 1 16 . 1 1 114 114 HIS N N 114 120.890 120.890 120.269 0.621 26060 11537 1 16 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.033 -0.127 26060 11538 1 16 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.152 0.618 26060 11539 1 16 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.477 -0.887 26060 11540 1 16 . 1 1 114 114 HIS H H 114 7.934 7.934 7.888 0.046 26060 11541 1 16 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.069 -0.269 26060 11542 1 16 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.024 1.066 26060 11543 1 16 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.941 -1.261 26060 11544 1 16 . 1 1 116 116 PRO C C 116 176.600 176.600 175.699 0.901 26060 11545 1 16 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.425 -0.124 26060 11546 1 16 . 1 1 117 117 VAL N N 117 127.480 127.480 127.289 0.191 26060 11547 1 16 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.389 -0.599 26060 11548 1 16 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.978 0.722 26060 11549 1 16 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.688 -0.488 26060 11550 1 16 . 1 1 117 117 VAL H H 117 8.890 8.890 8.050 0.840 26060 11551 1 16 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.977 0.013 26060 11552 1 16 . 1 1 118 118 ASN C C 118 172.700 172.700 173.602 -0.902 26060 11553 1 16 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.545 -0.185 26060 11554 1 16 . 1 1 118 118 ASN CB C 118 39.200 39.200 39.980 -0.780 26060 11555 1 16 . 1 1 119 119 HIS N N 119 124.930 124.930 126.158 -1.228 26060 11556 1 16 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.081 -0.261 26060 11557 1 16 . 1 1 119 119 HIS C C 119 173.500 173.500 172.849 0.651 26060 11558 1 16 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.936 2.034 26060 11559 1 16 . 1 1 119 119 HIS CB C 119 34.670 34.670 33.767 0.903 26060 11560 1 16 . 1 1 119 119 HIS H H 119 8.790 8.790 9.042 -0.252 26060 11561 1 16 . 1 1 120 120 LEU N N 120 128.280 128.280 125.025 3.255 26060 11562 1 16 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.190 -0.240 26060 11563 1 16 . 1 1 120 120 LEU C C 120 174.030 174.030 174.836 -0.806 26060 11564 1 16 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.584 0.856 26060 11565 1 16 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.487 0.113 26060 11566 1 16 . 1 1 120 120 LEU H H 120 7.460 7.460 8.538 -1.078 26060 11567 1 16 . 1 1 121 121 ARG N N 121 128.060 128.060 121.794 6.266 26060 11568 1 16 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.572 0.068 26060 11569 1 16 . 1 1 121 121 ARG C C 121 173.400 173.400 172.740 0.660 26060 11570 1 16 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.790 -0.430 26060 11571 1 16 . 1 1 121 121 ARG CB C 121 34.260 34.260 33.505 0.755 26060 11572 1 16 . 1 1 121 121 ARG H H 121 9.860 9.860 9.114 0.746 26060 11573 1 16 . 1 1 122 122 CYS N N 122 125.290 125.290 122.990 2.300 26060 11574 1 16 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.340 -0.320 26060 11575 1 16 . 1 1 122 122 CYS C C 122 174.600 174.600 175.266 -0.666 26060 11576 1 16 . 1 1 122 122 CYS CA C 122 58.290 58.290 57.127 1.163 26060 11577 1 16 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.035 -1.005 26060 11578 1 16 . 1 1 122 122 CYS H H 122 8.835 8.835 8.660 0.175 26060 11579 1 16 . 1 1 123 123 GLU N N 123 125.920 125.920 124.985 0.935 26060 11580 1 16 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.524 0.156 26060 11581 1 16 . 1 1 123 123 GLU C C 123 174.500 174.500 174.567 -0.067 26060 11582 1 16 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.984 -0.564 26060 11583 1 16 . 1 1 123 123 GLU CB C 123 32.583 32.583 30.994 1.589 26060 11584 1 16 . 1 1 123 123 GLU H H 123 8.970 8.970 8.807 0.163 26060 11585 1 16 . 1 1 124 124 LYS N N 124 121.837 121.837 121.575 0.262 26060 11586 1 16 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.880 0.080 26060 11587 1 16 . 1 1 124 124 LYS C C 124 175.700 175.700 175.637 0.063 26060 11588 1 16 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.170 0.187 26060 11589 1 16 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.425 -0.236 26060 11590 1 16 . 1 1 124 124 LYS H H 124 8.652 8.652 8.268 0.384 26060 11591 1 16 . 1 1 125 125 LEU N N 125 127.000 127.000 129.632 -2.632 26060 11592 1 16 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.617 0.033 26060 11593 1 16 . 1 1 125 125 LEU C C 125 175.110 175.110 175.469 -0.359 26060 11594 1 16 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.850 0.004 26060 11595 1 16 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.572 0.695 26060 11596 1 16 . 1 1 125 125 LEU H H 125 9.175 9.175 9.188 -0.013 26060 11597 1 16 . 1 1 126 126 THR N N 126 117.779 117.779 119.775 -1.996 26060 11598 1 16 . 1 1 126 126 THR HA H 126 4.650 4.650 4.580 0.070 26060 11599 1 16 . 1 1 126 126 THR C C 126 173.200 173.200 173.513 -0.313 26060 11600 1 16 . 1 1 126 126 THR CA C 126 62.036 62.036 61.459 0.577 26060 11601 1 16 . 1 1 126 126 THR CB C 126 70.284 70.284 69.239 1.045 26060 11602 1 16 . 1 1 126 126 THR H H 126 8.331 8.331 8.410 -0.079 26060 11603 1 16 . 1 1 127 127 PHE N N 127 126.576 126.576 126.473 0.103 26060 11604 1 16 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.652 -0.062 26060 11605 1 16 . 1 1 127 127 PHE C C 127 174.860 174.860 174.529 0.331 26060 11606 1 16 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.744 0.120 26060 11607 1 16 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.920 -0.920 26060 11608 1 16 . 1 1 127 127 PHE H H 127 9.051 9.051 8.627 0.424 26060 11609 1 16 . 1 1 128 128 ASN N N 128 123.040 123.040 124.052 -1.012 26060 11610 1 16 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.660 -0.040 26060 11611 1 16 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.899 0.581 26060 11612 1 16 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.908 0.552 26060 11613 1 16 . 1 1 128 128 ASN H H 128 8.880 8.880 8.860 0.020 26060 11614 1 16 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.491 0.269 26060 11615 1 16 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.550 -0.649 26060 11616 1 16 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.391 1.339 26060 11617 1 16 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.680 0.110 26060 11618 1 16 . 1 1 130 130 PRO C C 130 177.470 177.470 177.015 0.455 26060 11619 1 16 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.439 0.135 26060 11620 1 16 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.749 -0.439 26060 11621 1 16 . 1 1 131 131 THR N N 131 113.400 113.400 116.842 -3.442 26060 11622 1 16 . 1 1 131 131 THR HA H 131 4.300 4.300 4.138 0.162 26060 11623 1 16 . 1 1 131 131 THR C C 131 175.200 175.200 176.089 -0.889 26060 11624 1 16 . 1 1 131 131 THR CA C 131 62.200 62.200 62.140 0.060 26060 11625 1 16 . 1 1 131 131 THR CB C 131 70.600 70.600 70.482 0.118 26060 11626 1 16 . 1 1 131 131 THR H H 131 8.950 8.950 8.437 0.513 26060 11627 1 16 . 1 1 132 132 GLU N N 132 122.199 122.199 125.349 -3.150 26060 11628 1 16 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.990 0.020 26060 11629 1 16 . 1 1 132 132 GLU C C 132 178.700 178.700 178.388 0.312 26060 11630 1 16 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.340 -0.046 26060 11631 1 16 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.677 -0.516 26060 11632 1 16 . 1 1 132 132 GLU H H 132 8.932 8.932 9.007 -0.075 26060 11633 1 16 . 1 1 133 133 ASP N N 133 116.324 116.324 119.401 -3.077 26060 11634 1 16 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.383 -0.053 26060 11635 1 16 . 1 1 133 133 ASP C C 133 177.800 177.800 178.974 -1.174 26060 11636 1 16 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.478 0.068 26060 11637 1 16 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.416 1.407 26060 11638 1 16 . 1 1 133 133 ASP H H 133 8.490 8.490 8.233 0.257 26060 11639 1 16 . 1 1 134 134 PHE N N 134 119.914 119.914 122.060 -2.146 26060 11640 1 16 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.278 0.332 26060 11641 1 16 . 1 1 134 134 PHE C C 134 177.300 177.300 177.219 0.081 26060 11642 1 16 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.476 0.062 26060 11643 1 16 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.763 0.437 26060 11644 1 16 . 1 1 134 134 PHE H H 134 7.787 7.787 7.498 0.289 26060 11645 1 16 . 1 1 135 135 ARG N N 135 119.794 119.794 120.299 -0.505 26060 11646 1 16 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.560 -0.210 26060 11647 1 16 . 1 1 135 135 ARG C C 135 177.370 177.370 178.300 -0.930 26060 11648 1 16 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.033 0.343 26060 11649 1 16 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.988 0.408 26060 11650 1 16 . 1 1 135 135 ARG H H 135 9.087 9.087 8.835 0.252 26060 11651 1 16 . 1 1 136 136 ARG N N 136 114.554 114.554 118.762 -4.208 26060 11652 1 16 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.888 -0.068 26060 11653 1 16 . 1 1 136 136 ARG C C 136 178.950 178.950 178.766 0.184 26060 11654 1 16 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.986 -0.186 26060 11655 1 16 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.149 0.068 26060 11656 1 16 . 1 1 136 136 ARG H H 136 7.747 7.747 8.485 -0.738 26060 11657 1 16 . 1 1 137 137 LYS N N 137 118.298 118.298 119.208 -0.910 26060 11658 1 16 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.983 -0.083 26060 11659 1 16 . 1 1 137 137 LYS C C 137 177.980 177.980 179.081 -1.101 26060 11660 1 16 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.624 0.771 26060 11661 1 16 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.449 -0.002 26060 11662 1 16 . 1 1 137 137 LYS H H 137 7.154 7.154 7.480 -0.326 26060 11663 1 16 . 1 1 138 138 LEU N N 138 117.159 117.159 119.472 -2.313 26060 11664 1 16 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.757 -0.337 26060 11665 1 16 . 1 1 138 138 LEU C C 138 179.100 179.100 178.854 0.246 26060 11666 1 16 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.478 -0.247 26060 11667 1 16 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.351 0.977 26060 11668 1 16 . 1 1 138 138 LEU H H 138 7.709 7.709 7.938 -0.229 26060 11669 1 16 . 1 1 139 139 LEU N N 139 115.158 115.158 117.453 -2.295 26060 11670 1 16 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.054 0.096 26060 11671 1 16 . 1 1 139 139 LEU C C 139 177.600 177.600 178.662 -1.062 26060 11672 1 16 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.871 -1.342 26060 11673 1 16 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.760 -0.016 26060 11674 1 16 . 1 1 139 139 LEU H H 139 7.507 7.507 8.280 -0.773 26060 11675 1 16 . 1 1 140 140 LYS N N 140 120.256 120.256 118.204 2.052 26060 11676 1 16 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.015 0.095 26060 11677 1 16 . 1 1 140 140 LYS C C 140 175.800 175.800 177.031 -1.231 26060 11678 1 16 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.523 -0.471 26060 11679 1 16 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.441 0.205 26060 11680 1 16 . 1 1 140 140 LYS H H 140 7.304 7.304 7.663 -0.359 26060 11681 1 17 . 1 1 4 4 MET C C 4 175.800 175.800 176.319 -0.519 26060 11682 1 17 . 1 1 4 4 MET CA C 4 55.350 55.350 53.740 1.610 26060 11683 1 17 . 1 1 4 4 MET CB C 4 32.880 32.880 31.273 1.607 26060 11684 1 17 . 1 1 5 5 ALA N N 5 125.230 125.230 129.660 -4.430 26060 11685 1 17 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.033 0.317 26060 11686 1 17 . 1 1 5 5 ALA CA C 5 52.430 52.430 54.139 -1.709 26060 11687 1 17 . 1 1 5 5 ALA CB C 5 19.370 19.370 17.310 2.060 26060 11688 1 17 . 1 1 5 5 ALA H H 5 8.320 8.320 8.950 -0.630 26060 11689 1 17 . 1 1 6 6 SER HA H 6 4.490 4.490 4.640 -0.150 26060 11690 1 17 . 1 1 6 6 SER CA C 6 58.200 58.200 57.114 1.086 26060 11691 1 17 . 1 1 6 6 SER CB C 6 63.700 63.700 64.199 -0.499 26060 11692 1 17 . 1 1 7 7 SER HA H 7 4.530 4.530 4.725 -0.195 26060 11693 1 17 . 1 1 7 7 SER CA C 7 58.200 58.200 58.752 -0.552 26060 11694 1 17 . 1 1 7 7 SER CB C 7 63.700 63.700 63.123 0.577 26060 11695 1 17 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.633 -0.023 26060 11696 1 17 . 1 1 8 8 CYS C C 8 173.500 173.500 173.194 0.306 26060 11697 1 17 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.804 0.536 26060 11698 1 17 . 1 1 8 8 CYS CB C 8 28.490 28.490 29.029 -0.539 26060 11699 1 17 . 1 1 9 9 ALA N N 9 124.700 124.700 129.315 -4.615 26060 11700 1 17 . 1 1 9 9 ALA HA H 9 4.790 4.790 5.034 -0.244 26060 11701 1 17 . 1 1 9 9 ALA C C 9 177.400 177.400 176.643 0.757 26060 11702 1 17 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.767 1.303 26060 11703 1 17 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.914 0.715 26060 11704 1 17 . 1 1 9 9 ALA H H 9 7.960 7.960 8.651 -0.691 26060 11705 1 17 . 1 1 10 10 VAL N N 10 120.124 120.124 125.414 -5.290 26060 11706 1 17 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.159 0.131 26060 11707 1 17 . 1 1 10 10 VAL C C 10 173.900 173.900 174.978 -1.078 26060 11708 1 17 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.589 -0.039 26060 11709 1 17 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.126 2.774 26060 11710 1 17 . 1 1 10 10 VAL H H 10 8.424 8.424 8.464 -0.040 26060 11711 1 17 . 1 1 11 11 GLN N N 11 125.818 125.818 127.286 -1.468 26060 11712 1 17 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.294 0.266 26060 11713 1 17 . 1 1 11 11 GLN C C 11 175.400 175.400 175.208 0.192 26060 11714 1 17 . 1 1 11 11 GLN CA C 11 54.123 54.123 53.854 0.269 26060 11715 1 17 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.160 1.869 26060 11716 1 17 . 1 1 11 11 GLN H H 11 8.636 8.636 8.547 0.089 26060 11717 1 17 . 1 1 12 12 VAL N N 12 119.106 119.106 119.000 0.106 26060 11718 1 17 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.373 0.257 26060 11719 1 17 . 1 1 12 12 VAL C C 12 173.800 173.800 174.851 -1.051 26060 11720 1 17 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.512 0.288 26060 11721 1 17 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.493 2.218 26060 11722 1 17 . 1 1 12 12 VAL H H 12 8.827 8.827 8.809 0.018 26060 11723 1 17 . 1 1 13 13 LYS N N 13 121.700 121.700 125.419 -3.719 26060 11724 1 17 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.447 -0.247 26060 11725 1 17 . 1 1 13 13 LYS C C 13 175.030 175.030 175.962 -0.932 26060 11726 1 17 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.065 0.365 26060 11727 1 17 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.407 1.513 26060 11728 1 17 . 1 1 13 13 LYS H H 13 8.234 8.234 8.518 -0.284 26060 11729 1 17 . 1 1 14 14 LEU N N 14 119.100 119.100 124.581 -5.481 26060 11730 1 17 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.095 -0.145 26060 11731 1 17 . 1 1 14 14 LEU C C 14 175.110 175.110 175.215 -0.105 26060 11732 1 17 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.579 -0.222 26060 11733 1 17 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.833 1.088 26060 11734 1 17 . 1 1 14 14 LEU H H 14 8.840 8.840 8.884 -0.044 26060 11735 1 17 . 1 1 15 15 GLU N N 15 120.978 120.978 122.405 -1.427 26060 11736 1 17 . 1 1 15 15 GLU HA H 15 4.990 4.990 4.972 0.018 26060 11737 1 17 . 1 1 15 15 GLU C C 15 173.800 173.800 174.760 -0.960 26060 11738 1 17 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.553 0.875 26060 11739 1 17 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.121 -1.295 26060 11740 1 17 . 1 1 15 15 GLU H H 15 9.181 9.181 9.220 -0.039 26060 11741 1 17 . 1 1 16 16 LEU N N 16 124.438 124.438 126.297 -1.859 26060 11742 1 17 . 1 1 16 16 LEU HA H 16 5.110 5.110 4.428 0.682 26060 11743 1 17 . 1 1 16 16 LEU C C 16 174.700 174.700 175.469 -0.769 26060 11744 1 17 . 1 1 16 16 LEU CA C 16 53.076 53.076 53.153 -0.077 26060 11745 1 17 . 1 1 16 16 LEU CB C 16 44.892 44.892 41.648 3.244 26060 11746 1 17 . 1 1 16 16 LEU H H 16 8.891 8.891 8.774 0.117 26060 11747 1 17 . 1 1 17 17 GLY N N 17 108.067 108.067 109.733 -1.666 26060 11748 1 17 . 1 1 17 17 GLY C C 17 170.350 170.350 171.512 -1.162 26060 11749 1 17 . 1 1 17 17 GLY CA C 17 46.984 46.984 44.604 2.380 26060 11750 1 17 . 1 1 17 17 GLY H H 17 7.227 7.227 7.868 -0.641 26060 11751 1 17 . 1 1 18 18 HIS N N 18 111.200 111.200 121.383 -10.183 26060 11752 1 17 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.824 -0.204 26060 11753 1 17 . 1 1 18 18 HIS C C 18 172.400 172.400 172.800 -0.400 26060 11754 1 17 . 1 1 18 18 HIS CA C 18 54.940 54.940 54.860 0.080 26060 11755 1 17 . 1 1 18 18 HIS CB C 18 34.160 34.160 33.411 0.749 26060 11756 1 17 . 1 1 18 18 HIS H H 18 8.150 8.150 9.047 -0.897 26060 11757 1 17 . 1 1 19 19 ARG N N 19 117.800 117.800 121.541 -3.741 26060 11758 1 17 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.954 0.146 26060 11759 1 17 . 1 1 19 19 ARG C C 19 175.800 175.800 174.138 1.662 26060 11760 1 17 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.052 -0.552 26060 11761 1 17 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.242 -0.592 26060 11762 1 17 . 1 1 19 19 ARG H H 19 9.010 9.010 9.047 -0.037 26060 11763 1 17 . 1 1 20 20 ALA N N 20 120.390 120.390 122.994 -2.604 26060 11764 1 17 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.563 -0.033 26060 11765 1 17 . 1 1 20 20 ALA C C 20 175.800 175.800 175.315 0.485 26060 11766 1 17 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.643 1.547 26060 11767 1 17 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.044 0.706 26060 11768 1 17 . 1 1 20 20 ALA H H 20 8.070 8.070 8.516 -0.446 26060 11769 1 17 . 1 1 21 21 GLN N N 21 121.790 121.790 121.610 0.180 26060 11770 1 17 . 1 1 21 21 GLN HA H 21 5.230 5.230 5.155 0.075 26060 11771 1 17 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.141 0.190 26060 11772 1 17 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.034 -0.134 26060 11773 1 17 . 1 1 21 21 GLN H H 21 9.240 9.240 9.231 0.009 26060 11774 1 17 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.479 -0.849 26060 11775 1 17 . 1 1 22 22 VAL C C 22 176.500 176.500 175.084 1.416 26060 11776 1 17 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.767 3.263 26060 11777 1 17 . 1 1 22 22 VAL CB C 22 31.600 31.600 34.118 -2.518 26060 11778 1 17 . 1 1 23 23 ARG N N 23 127.840 127.840 126.979 0.861 26060 11779 1 17 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.649 -0.519 26060 11780 1 17 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.048 1.552 26060 11781 1 17 . 1 1 23 23 ARG CB C 23 32.150 32.150 31.060 1.090 26060 11782 1 17 . 1 1 23 23 ARG H H 23 8.720 8.720 8.579 0.141 26060 11783 1 17 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.152 -0.112 26060 11784 1 17 . 1 1 24 24 LYS C C 24 176.960 176.960 176.214 0.746 26060 11785 1 17 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.706 1.094 26060 11786 1 17 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.592 -0.532 26060 11787 1 17 . 1 1 25 25 LYS N N 25 115.870 115.870 119.577 -3.707 26060 11788 1 17 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.617 0.213 26060 11789 1 17 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.542 -0.582 26060 11790 1 17 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.000 2.080 26060 11791 1 17 . 1 1 25 25 LYS H H 25 7.720 7.720 7.731 -0.011 26060 11792 1 17 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.649 0.181 26060 11793 1 17 . 1 1 26 26 PRO C C 26 177.400 177.400 176.823 0.577 26060 11794 1 17 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.770 -0.120 26060 11795 1 17 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.359 0.031 26060 11796 1 17 . 1 1 27 27 THR N N 27 111.270 111.270 114.687 -3.417 26060 11797 1 17 . 1 1 27 27 THR HA H 27 4.530 4.530 4.217 0.313 26060 11798 1 17 . 1 1 27 27 THR C C 27 177.300 177.300 176.921 0.379 26060 11799 1 17 . 1 1 27 27 THR CA C 27 61.300 61.300 61.163 0.136 26060 11800 1 17 . 1 1 27 27 THR CB C 27 71.460 71.460 69.995 1.465 26060 11801 1 17 . 1 1 27 27 THR H H 27 8.380 8.380 8.033 0.347 26060 11802 1 17 . 1 1 28 28 VAL N N 28 121.170 121.170 122.685 -1.515 26060 11803 1 17 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.812 0.071 26060 11804 1 17 . 1 1 28 28 VAL C C 28 177.030 177.030 176.025 1.005 26060 11805 1 17 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.097 0.103 26060 11806 1 17 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.654 -0.254 26060 11807 1 17 . 1 1 28 28 VAL H H 28 8.910 8.910 8.549 0.361 26060 11808 1 17 . 1 1 29 29 GLU N N 29 116.800 116.800 116.771 0.029 26060 11809 1 17 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.177 -0.257 26060 11810 1 17 . 1 1 29 29 GLU C C 29 176.200 176.200 175.882 0.318 26060 11811 1 17 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.357 1.893 26060 11812 1 17 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.436 -1.266 26060 11813 1 17 . 1 1 29 29 GLU H H 29 7.990 7.990 7.905 0.085 26060 11814 1 17 . 1 1 30 30 GLY N N 30 105.500 105.500 107.888 -2.388 26060 11815 1 17 . 1 1 30 30 GLY C C 30 174.900 174.900 173.923 0.977 26060 11816 1 17 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.206 -0.746 26060 11817 1 17 . 1 1 30 30 GLY H H 30 7.950 7.950 7.838 0.112 26060 11818 1 17 . 1 1 31 31 PHE N N 31 119.300 119.300 119.058 0.242 26060 11819 1 17 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.925 -0.165 26060 11820 1 17 . 1 1 31 31 PHE C C 31 176.400 176.400 175.911 0.489 26060 11821 1 17 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.527 1.373 26060 11822 1 17 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.190 -3.690 26060 11823 1 17 . 1 1 31 31 PHE H H 31 7.520 7.520 7.391 0.129 26060 11824 1 17 . 1 1 32 32 THR N N 32 112.300 112.300 116.241 -3.941 26060 11825 1 17 . 1 1 32 32 THR HA H 32 4.330 4.330 4.445 -0.115 26060 11826 1 17 . 1 1 32 32 THR C C 32 175.200 175.200 174.302 0.898 26060 11827 1 17 . 1 1 32 32 THR CA C 32 62.780 62.780 62.725 0.055 26060 11828 1 17 . 1 1 32 32 THR CB C 32 70.350 70.350 70.071 0.279 26060 11829 1 17 . 1 1 32 32 THR H H 32 7.770 7.770 9.091 -1.321 26060 11830 1 17 . 1 1 33 33 HIS N N 33 121.900 121.900 121.697 0.203 26060 11831 1 17 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.259 0.241 26060 11832 1 17 . 1 1 33 33 HIS C C 33 173.880 173.880 173.650 0.230 26060 11833 1 17 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.370 0.410 26060 11834 1 17 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.177 3.463 26060 11835 1 17 . 1 1 33 33 HIS H H 33 9.110 9.110 8.773 0.337 26060 11836 1 17 . 1 1 34 34 ASP N N 34 120.300 120.300 123.591 -3.291 26060 11837 1 17 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.585 -0.185 26060 11838 1 17 . 1 1 34 34 ASP C C 34 175.100 175.100 175.352 -0.252 26060 11839 1 17 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.728 -0.418 26060 11840 1 17 . 1 1 34 34 ASP CB C 34 43.100 43.100 44.000 -0.900 26060 11841 1 17 . 1 1 34 34 ASP H H 34 8.810 8.810 9.229 -0.419 26060 11842 1 17 . 1 1 35 35 TRP N N 35 119.800 119.800 118.645 1.155 26060 11843 1 17 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.560 0.170 26060 11844 1 17 . 1 1 35 35 TRP C C 35 174.900 174.900 173.331 1.569 26060 11845 1 17 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.312 -0.412 26060 11846 1 17 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.129 1.941 26060 11847 1 17 . 1 1 35 35 TRP H H 35 9.250 9.250 8.951 0.299 26060 11848 1 17 . 1 1 36 36 MET N N 36 120.980 120.980 121.698 -0.718 26060 11849 1 17 . 1 1 36 36 MET HA H 36 5.750 5.750 5.940 -0.190 26060 11850 1 17 . 1 1 36 36 MET C C 36 173.700 173.700 174.234 -0.534 26060 11851 1 17 . 1 1 36 36 MET CA C 36 54.830 54.830 54.240 0.590 26060 11852 1 17 . 1 1 36 36 MET CB C 36 35.220 35.220 37.029 -1.809 26060 11853 1 17 . 1 1 36 36 MET H H 36 9.080 9.080 9.330 -0.250 26060 11854 1 17 . 1 1 37 37 VAL N N 37 126.220 126.220 121.218 5.002 26060 11855 1 17 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.414 -0.104 26060 11856 1 17 . 1 1 37 37 VAL C C 37 172.300 172.300 174.573 -2.273 26060 11857 1 17 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.929 -1.389 26060 11858 1 17 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.900 1.170 26060 11859 1 17 . 1 1 37 37 VAL H H 37 9.080 9.080 8.862 0.218 26060 11860 1 17 . 1 1 38 38 PHE N N 38 120.640 120.640 120.985 -0.345 26060 11861 1 17 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.944 0.026 26060 11862 1 17 . 1 1 38 38 PHE C C 38 172.960 172.960 173.870 -0.910 26060 11863 1 17 . 1 1 38 38 PHE CA C 38 56.130 56.130 55.493 0.637 26060 11864 1 17 . 1 1 38 38 PHE CB C 38 43.000 43.000 42.819 0.181 26060 11865 1 17 . 1 1 38 38 PHE H H 38 8.320 8.320 8.936 -0.616 26060 11866 1 17 . 1 1 39 39 VAL N N 39 116.500 116.500 119.550 -3.050 26060 11867 1 17 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.379 -0.369 26060 11868 1 17 . 1 1 39 39 VAL C C 39 174.700 174.700 175.149 -0.449 26060 11869 1 17 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.435 1.205 26060 11870 1 17 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.280 2.120 26060 11871 1 17 . 1 1 39 39 VAL H H 39 8.580 8.580 8.724 -0.144 26060 11872 1 17 . 1 1 40 40 ARG N N 40 124.100 124.100 124.807 -0.707 26060 11873 1 17 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.893 0.187 26060 11874 1 17 . 1 1 40 40 ARG C C 40 173.800 173.800 174.729 -0.929 26060 11875 1 17 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.162 -0.232 26060 11876 1 17 . 1 1 40 40 ARG CB C 40 33.580 33.580 34.855 -1.276 26060 11877 1 17 . 1 1 40 40 ARG H H 40 9.880 9.880 8.531 1.349 26060 11878 1 17 . 1 1 41 41 GLY N N 41 107.640 107.640 108.049 -0.409 26060 11879 1 17 . 1 1 41 41 GLY CA C 41 43.970 43.970 43.000 0.970 26060 11880 1 17 . 1 1 41 41 GLY H H 41 8.910 8.910 8.659 0.251 26060 11881 1 17 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.399 0.091 26060 11882 1 17 . 1 1 42 42 PRO C C 42 177.300 177.300 176.563 0.737 26060 11883 1 17 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.179 0.260 26060 11884 1 17 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.433 -0.323 26060 11885 1 17 . 1 1 43 43 GLU N N 43 121.050 121.050 121.194 -0.144 26060 11886 1 17 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.151 -0.361 26060 11887 1 17 . 1 1 43 43 GLU C C 43 176.110 176.110 176.670 -0.560 26060 11888 1 17 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.719 -0.869 26060 11889 1 17 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.637 -0.787 26060 11890 1 17 . 1 1 43 43 GLU H H 43 9.060 9.060 8.792 0.268 26060 11891 1 17 . 1 1 44 44 HIS N N 44 114.100 114.100 116.479 -2.379 26060 11892 1 17 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.278 0.073 26060 11893 1 17 . 1 1 44 44 HIS C C 44 175.170 175.170 174.562 0.608 26060 11894 1 17 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.846 0.804 26060 11895 1 17 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.419 -0.049 26060 11896 1 17 . 1 1 44 44 HIS H H 44 8.420 8.420 8.629 -0.209 26060 11897 1 17 . 1 1 45 45 SER N N 45 115.540 115.540 117.336 -1.796 26060 11898 1 17 . 1 1 45 45 SER HA H 45 4.560 4.560 4.453 0.107 26060 11899 1 17 . 1 1 45 45 SER C C 45 173.700 173.700 174.196 -0.496 26060 11900 1 17 . 1 1 45 45 SER CA C 45 58.710 58.710 57.395 1.315 26060 11901 1 17 . 1 1 45 45 SER CB C 45 65.040 65.040 63.356 1.683 26060 11902 1 17 . 1 1 45 45 SER H H 45 7.870 7.870 7.655 0.215 26060 11903 1 17 . 1 1 46 46 ASN N N 46 123.900 123.900 124.357 -0.457 26060 11904 1 17 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.931 0.189 26060 11905 1 17 . 1 1 46 46 ASN C C 46 176.300 176.300 175.655 0.645 26060 11906 1 17 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.884 -0.194 26060 11907 1 17 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.584 -1.854 26060 11908 1 17 . 1 1 46 46 ASN H H 46 9.480 9.480 8.324 1.156 26060 11909 1 17 . 1 1 47 47 ILE N N 47 115.240 115.240 120.131 -4.891 26060 11910 1 17 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.208 0.733 26060 11911 1 17 . 1 1 47 47 ILE C C 47 176.000 176.000 176.543 -0.543 26060 11912 1 17 . 1 1 47 47 ILE CA C 47 63.200 63.200 63.125 0.075 26060 11913 1 17 . 1 1 47 47 ILE CB C 47 36.700 36.700 37.931 -1.231 26060 11914 1 17 . 1 1 47 47 ILE H H 47 8.170 8.170 8.646 -0.476 26060 11915 1 17 . 1 1 48 48 GLN N N 48 123.200 123.200 119.797 3.403 26060 11916 1 17 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.130 0.150 26060 11917 1 17 . 1 1 48 48 GLN C C 48 175.670 175.670 177.374 -1.704 26060 11918 1 17 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.476 -0.576 26060 11919 1 17 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.903 -0.913 26060 11920 1 17 . 1 1 48 48 GLN H H 48 8.850 8.850 8.550 0.300 26060 11921 1 17 . 1 1 49 49 HIS N N 49 115.400 115.400 117.138 -1.738 26060 11922 1 17 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.380 0.190 26060 11923 1 17 . 1 1 49 49 HIS C C 49 176.380 176.380 176.718 -0.338 26060 11924 1 17 . 1 1 49 49 HIS CA C 49 58.750 58.750 59.012 -0.262 26060 11925 1 17 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.511 1.109 26060 11926 1 17 . 1 1 49 49 HIS H H 49 7.400 7.400 7.482 -0.082 26060 11927 1 17 . 1 1 50 50 PHE N N 50 109.800 109.800 112.017 -2.217 26060 11928 1 17 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.882 0.348 26060 11929 1 17 . 1 1 50 50 PHE C C 50 173.800 173.800 174.420 -0.620 26060 11930 1 17 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.900 -0.240 26060 11931 1 17 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.800 1.200 26060 11932 1 17 . 1 1 50 50 PHE H H 50 7.570 7.570 7.432 0.138 26060 11933 1 17 . 1 1 51 51 VAL N N 51 127.810 127.810 121.200 6.610 26060 11934 1 17 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.933 -0.563 26060 11935 1 17 . 1 1 51 51 VAL C C 51 174.500 174.500 174.665 -0.165 26060 11936 1 17 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.278 1.722 26060 11937 1 17 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.177 -0.897 26060 11938 1 17 . 1 1 51 51 VAL H H 51 7.810 7.810 8.205 -0.395 26060 11939 1 17 . 1 1 52 52 GLU N N 52 130.700 130.700 129.099 1.601 26060 11940 1 17 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.316 -0.336 26060 11941 1 17 . 1 1 52 52 GLU C C 52 175.400 175.400 175.965 -0.565 26060 11942 1 17 . 1 1 52 52 GLU CA C 52 58.100 58.100 58.126 -0.026 26060 11943 1 17 . 1 1 52 52 GLU CB C 52 31.580 31.580 31.015 0.565 26060 11944 1 17 . 1 1 52 52 GLU H H 52 9.380 9.380 8.679 0.701 26060 11945 1 17 . 1 1 53 53 LYS N N 53 109.200 109.200 114.864 -5.664 26060 11946 1 17 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.966 -0.166 26060 11947 1 17 . 1 1 53 53 LYS C C 53 172.300 172.300 174.403 -2.103 26060 11948 1 17 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.617 0.223 26060 11949 1 17 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.976 -1.726 26060 11950 1 17 . 1 1 53 53 LYS H H 53 7.190 7.190 7.445 -0.255 26060 11951 1 17 . 1 1 54 54 VAL N N 54 120.380 120.380 118.000 2.380 26060 11952 1 17 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.757 0.013 26060 11953 1 17 . 1 1 54 54 VAL C C 54 173.600 173.600 173.987 -0.387 26060 11954 1 17 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.348 -0.308 26060 11955 1 17 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.616 -1.916 26060 11956 1 17 . 1 1 54 54 VAL H H 54 8.450 8.450 8.498 -0.048 26060 11957 1 17 . 1 1 55 55 VAL N N 55 126.920 126.920 122.958 3.962 26060 11958 1 17 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.006 -0.306 26060 11959 1 17 . 1 1 55 55 VAL C C 55 173.800 173.800 173.874 -0.074 26060 11960 1 17 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.781 0.089 26060 11961 1 17 . 1 1 55 55 VAL CB C 55 34.100 34.100 37.004 -2.904 26060 11962 1 17 . 1 1 55 55 VAL H H 55 9.260 9.260 9.016 0.244 26060 11963 1 17 . 1 1 56 56 PHE N N 56 126.130 126.130 123.733 2.397 26060 11964 1 17 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.014 -0.324 26060 11965 1 17 . 1 1 56 56 PHE C C 56 174.000 174.000 174.306 -0.306 26060 11966 1 17 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.739 -0.159 26060 11967 1 17 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.676 -1.786 26060 11968 1 17 . 1 1 56 56 PHE H H 56 9.290 9.290 8.756 0.534 26060 11969 1 17 . 1 1 57 57 HIS N N 57 124.180 124.180 124.139 0.041 26060 11970 1 17 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.990 -0.190 26060 11971 1 17 . 1 1 57 57 HIS C C 57 174.700 174.700 175.077 -0.377 26060 11972 1 17 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.100 0.220 26060 11973 1 17 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.795 1.305 26060 11974 1 17 . 1 1 57 57 HIS H H 57 8.690 8.690 8.580 0.110 26060 11975 1 17 . 1 1 58 58 LEU N N 58 122.050 122.050 123.580 -1.530 26060 11976 1 17 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.398 -0.158 26060 11977 1 17 . 1 1 58 58 LEU C C 58 174.400 174.400 176.982 -2.582 26060 11978 1 17 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.992 0.418 26060 11979 1 17 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.423 -1.263 26060 11980 1 17 . 1 1 58 58 LEU H H 58 9.050 9.050 8.046 1.004 26060 11981 1 17 . 1 1 59 59 HIS N N 59 118.510 118.510 117.873 0.637 26060 11982 1 17 . 1 1 59 59 HIS C C 59 175.300 175.300 176.732 -1.432 26060 11983 1 17 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.947 3.163 26060 11984 1 17 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.563 0.367 26060 11985 1 17 . 1 1 59 59 HIS H H 59 5.160 5.160 7.895 -2.735 26060 11986 1 17 . 1 1 60 60 GLU N N 60 122.190 122.190 125.723 -3.533 26060 11987 1 17 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.993 -0.033 26060 11988 1 17 . 1 1 60 60 GLU C C 60 175.130 175.130 177.015 -1.885 26060 11989 1 17 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.210 -0.200 26060 11990 1 17 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.036 -0.216 26060 11991 1 17 . 1 1 60 60 GLU H H 60 7.960 7.960 8.378 -0.418 26060 11992 1 17 . 1 1 61 61 SER N N 61 116.940 116.940 113.665 3.275 26060 11993 1 17 . 1 1 61 61 SER HA H 61 4.200 4.200 4.251 -0.051 26060 11994 1 17 . 1 1 61 61 SER CA C 61 60.010 60.010 60.394 -0.384 26060 11995 1 17 . 1 1 61 61 SER CB C 61 63.140 63.140 63.528 -0.388 26060 11996 1 17 . 1 1 61 61 SER H H 61 8.540 8.540 8.052 0.488 26060 11997 1 17 . 1 1 62 62 PHE N N 62 123.700 123.700 122.557 1.143 26060 11998 1 17 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.593 -0.043 26060 11999 1 17 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.754 2.186 26060 12000 1 17 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.880 -0.480 26060 12001 1 17 . 1 1 62 62 PHE H H 62 8.640 8.640 8.167 0.473 26060 12002 1 17 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.506 -0.096 26060 12003 1 17 . 1 1 63 63 PRO C C 63 176.400 176.400 176.552 -0.152 26060 12004 1 17 . 1 1 63 63 PRO CA C 63 62.600 62.600 62.995 -0.395 26060 12005 1 17 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.116 -0.256 26060 12006 1 17 . 1 1 64 64 ARG N N 64 116.840 116.840 120.513 -3.673 26060 12007 1 17 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.080 0.020 26060 12008 1 17 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.230 -0.620 26060 12009 1 17 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.706 0.124 26060 12010 1 17 . 1 1 64 64 ARG H H 64 8.890 8.890 8.801 0.089 26060 12011 1 17 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.376 -0.386 26060 12012 1 17 . 1 1 65 65 PRO C C 65 175.800 175.800 177.257 -1.457 26060 12013 1 17 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.013 1.797 26060 12014 1 17 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.942 -0.062 26060 12015 1 17 . 1 1 66 66 LYS N N 66 119.035 119.035 120.208 -1.173 26060 12016 1 17 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.056 -0.446 26060 12017 1 17 . 1 1 66 66 LYS C C 66 175.400 175.400 175.831 -0.431 26060 12018 1 17 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.408 0.045 26060 12019 1 17 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.010 -0.280 26060 12020 1 17 . 1 1 66 66 LYS H H 66 7.630 7.630 7.866 -0.236 26060 12021 1 17 . 1 1 67 67 ARG N N 67 127.394 127.394 127.784 -0.390 26060 12022 1 17 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.628 0.112 26060 12023 1 17 . 1 1 67 67 ARG C C 67 174.500 174.500 174.998 -0.498 26060 12024 1 17 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.564 0.236 26060 12025 1 17 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.679 -0.965 26060 12026 1 17 . 1 1 67 67 ARG H H 67 8.855 8.855 8.709 0.146 26060 12027 1 17 . 1 1 68 68 VAL N N 68 124.388 124.388 120.457 3.931 26060 12028 1 17 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.034 -0.454 26060 12029 1 17 . 1 1 68 68 VAL C C 68 176.850 176.850 175.580 1.270 26060 12030 1 17 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.967 2.106 26060 12031 1 17 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.305 0.299 26060 12032 1 17 . 1 1 68 68 VAL H H 68 8.681 8.681 8.423 0.258 26060 12033 1 17 . 1 1 69 69 CYS N N 69 127.080 127.080 126.026 1.054 26060 12034 1 17 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.764 0.306 26060 12035 1 17 . 1 1 69 69 CYS CA C 69 58.346 58.346 58.078 0.268 26060 12036 1 17 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.162 0.609 26060 12037 1 17 . 1 1 69 69 CYS H H 69 9.455 9.455 9.174 0.281 26060 12038 1 17 . 1 1 70 70 LYS N N 70 125.480 125.480 123.486 1.994 26060 12039 1 17 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.514 -0.024 26060 12040 1 17 . 1 1 70 70 LYS C C 70 174.300 174.300 175.446 -1.146 26060 12041 1 17 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.310 1.450 26060 12042 1 17 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.247 -0.077 26060 12043 1 17 . 1 1 70 70 LYS H H 70 9.050 9.050 8.594 0.456 26060 12044 1 17 . 1 1 71 71 ASP N N 71 116.940 116.940 119.188 -2.248 26060 12045 1 17 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.816 0.284 26060 12046 1 17 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.248 -1.168 26060 12047 1 17 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.459 1.921 26060 12048 1 17 . 1 1 71 71 ASP H H 71 7.620 7.620 7.539 0.081 26060 12049 1 17 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.145 -0.885 26060 12050 1 17 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.944 -2.294 26060 12051 1 17 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.927 -0.887 26060 12052 1 17 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.098 0.002 26060 12053 1 17 . 1 1 73 73 PRO C C 73 174.700 174.700 175.922 -1.222 26060 12054 1 17 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.307 -2.617 26060 12055 1 17 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.281 2.759 26060 12056 1 17 . 1 1 74 74 TYR N N 74 125.400 125.400 124.795 0.605 26060 12057 1 17 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.551 0.299 26060 12058 1 17 . 1 1 74 74 TYR C C 74 172.900 172.900 175.477 -2.577 26060 12059 1 17 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.205 -2.535 26060 12060 1 17 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.078 -3.678 26060 12061 1 17 . 1 1 74 74 TYR H H 74 8.960 8.960 8.583 0.377 26060 12062 1 17 . 1 1 75 75 LYS N N 75 121.400 121.400 120.189 1.211 26060 12063 1 17 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.323 0.267 26060 12064 1 17 . 1 1 75 75 LYS C C 75 173.800 173.800 174.609 -0.809 26060 12065 1 17 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.900 -0.250 26060 12066 1 17 . 1 1 75 75 LYS CB C 75 35.890 35.890 37.025 -1.135 26060 12067 1 17 . 1 1 75 75 LYS H H 75 7.670 7.670 8.054 -0.384 26060 12068 1 17 . 1 1 76 76 VAL N N 76 119.800 119.800 121.179 -1.379 26060 12069 1 17 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.235 -0.345 26060 12070 1 17 . 1 1 76 76 VAL C C 76 173.900 173.900 174.319 -0.419 26060 12071 1 17 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.555 1.175 26060 12072 1 17 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.422 0.118 26060 12073 1 17 . 1 1 76 76 VAL H H 76 8.180 8.180 8.109 0.071 26060 12074 1 17 . 1 1 77 77 GLU N N 77 126.190 126.190 127.517 -1.327 26060 12075 1 17 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.991 -0.041 26060 12076 1 17 . 1 1 77 77 GLU C C 77 174.700 174.700 175.446 -0.746 26060 12077 1 17 . 1 1 77 77 GLU CA C 77 54.940 54.940 54.993 -0.053 26060 12078 1 17 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.068 0.482 26060 12079 1 17 . 1 1 77 77 GLU H H 77 8.270 8.270 8.633 -0.363 26060 12080 1 17 . 1 1 78 78 GLU N N 78 126.180 126.180 123.790 2.390 26060 12081 1 17 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.615 -0.165 26060 12082 1 17 . 1 1 78 78 GLU C C 78 175.400 175.400 174.097 1.303 26060 12083 1 17 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.791 0.251 26060 12084 1 17 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.809 3.291 26060 12085 1 17 . 1 1 78 78 GLU H H 78 7.870 7.870 8.286 -0.416 26060 12086 1 17 . 1 1 79 79 SER N N 79 112.109 112.109 113.382 -1.273 26060 12087 1 17 . 1 1 79 79 SER HA H 79 5.560 5.560 5.409 0.151 26060 12088 1 17 . 1 1 79 79 SER C C 79 172.490 172.490 173.121 -0.631 26060 12089 1 17 . 1 1 79 79 SER CA C 79 57.754 57.754 56.672 1.082 26060 12090 1 17 . 1 1 79 79 SER CB C 79 65.861 65.861 65.299 0.562 26060 12091 1 17 . 1 1 79 79 SER H H 79 7.714 7.714 8.365 -0.651 26060 12092 1 17 . 1 1 80 80 GLY N N 80 106.048 106.048 111.154 -5.106 26060 12093 1 17 . 1 1 80 80 GLY C C 80 172.630 172.630 171.744 0.886 26060 12094 1 17 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.751 0.819 26060 12095 1 17 . 1 1 80 80 GLY H H 80 8.828 8.828 8.975 -0.147 26060 12096 1 17 . 1 1 81 81 TYR N N 81 115.280 115.280 114.195 1.085 26060 12097 1 17 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.252 0.428 26060 12098 1 17 . 1 1 81 81 TYR C C 81 174.100 174.100 173.999 0.101 26060 12099 1 17 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.996 -1.496 26060 12100 1 17 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.334 2.006 26060 12101 1 17 . 1 1 81 81 TYR H H 81 8.770 8.770 8.119 0.651 26060 12102 1 17 . 1 1 82 82 ALA N N 82 122.350 122.350 122.701 -0.351 26060 12103 1 17 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.533 -0.133 26060 12104 1 17 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.698 0.342 26060 12105 1 17 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.095 1.305 26060 12106 1 17 . 1 1 82 82 ALA H H 82 7.160 7.160 7.369 -0.209 26060 12107 1 17 . 1 1 83 83 GLY N N 83 107.100 107.100 106.696 0.404 26060 12108 1 17 . 1 1 83 83 GLY C C 83 172.500 172.500 173.622 -1.122 26060 12109 1 17 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.074 0.536 26060 12110 1 17 . 1 1 83 83 GLY H H 83 8.220 8.220 8.217 0.003 26060 12111 1 17 . 1 1 84 84 PHE N N 84 111.660 111.660 114.778 -3.118 26060 12112 1 17 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.585 0.105 26060 12113 1 17 . 1 1 84 84 PHE C C 84 172.460 172.460 173.506 -1.046 26060 12114 1 17 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.654 -0.154 26060 12115 1 17 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.668 -1.088 26060 12116 1 17 . 1 1 84 84 PHE H H 84 7.700 7.700 8.276 -0.576 26060 12117 1 17 . 1 1 85 85 ILE N N 85 117.810 117.810 121.839 -4.029 26060 12118 1 17 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.039 0.271 26060 12119 1 17 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.740 -1.400 26060 12120 1 17 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.035 -1.775 26060 12121 1 17 . 1 1 85 85 ILE H H 85 8.340 8.340 8.513 -0.173 26060 12122 1 17 . 1 1 86 86 LEU N N 86 108.130 108.130 129.416 -21.286 26060 12123 1 17 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.043 -0.063 26060 12124 1 17 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.049 2.151 26060 12125 1 17 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.359 -0.059 26060 12126 1 17 . 1 1 86 86 LEU H H 86 9.900 9.900 8.633 1.267 26060 12127 1 17 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.644 0.456 26060 12128 1 17 . 1 1 87 87 PRO C C 87 175.340 175.340 176.121 -0.781 26060 12129 1 17 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.771 0.339 26060 12130 1 17 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.424 1.136 26060 12131 1 17 . 1 1 88 88 ILE N N 88 126.000 126.000 126.412 -0.412 26060 12132 1 17 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.212 0.578 26060 12133 1 17 . 1 1 88 88 ILE C C 88 176.100 176.100 175.080 1.020 26060 12134 1 17 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.688 -0.128 26060 12135 1 17 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.478 2.522 26060 12136 1 17 . 1 1 88 88 ILE H H 88 9.380 9.380 8.572 0.808 26060 12137 1 17 . 1 1 89 89 GLU N N 89 123.900 123.900 126.252 -2.352 26060 12138 1 17 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.220 -0.020 26060 12139 1 17 . 1 1 89 89 GLU C C 89 173.800 173.800 175.638 -1.838 26060 12140 1 17 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.420 -0.450 26060 12141 1 17 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.011 1.369 26060 12142 1 17 . 1 1 89 89 GLU H H 89 9.320 9.320 8.968 0.352 26060 12143 1 17 . 1 1 90 90 VAL N N 90 123.980 123.980 123.837 0.143 26060 12144 1 17 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.180 -0.020 26060 12145 1 17 . 1 1 90 90 VAL C C 90 174.800 174.800 174.703 0.097 26060 12146 1 17 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.259 0.731 26060 12147 1 17 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.772 0.718 26060 12148 1 17 . 1 1 90 90 VAL H H 90 8.630 8.630 8.467 0.163 26060 12149 1 17 . 1 1 91 91 TYR N N 91 124.230 124.230 127.737 -3.507 26060 12150 1 17 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.220 0.440 26060 12151 1 17 . 1 1 91 91 TYR C C 91 176.800 176.800 175.457 1.343 26060 12152 1 17 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.613 -1.913 26060 12153 1 17 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.788 1.452 26060 12154 1 17 . 1 1 91 91 TYR H H 91 8.640 8.640 8.934 -0.294 26060 12155 1 17 . 1 1 92 92 PHE N N 92 121.200 121.200 122.375 -1.175 26060 12156 1 17 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.278 0.382 26060 12157 1 17 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.824 1.686 26060 12158 1 17 . 1 1 92 92 PHE CB C 92 42.700 42.700 42.083 0.618 26060 12159 1 17 . 1 1 92 92 PHE H H 92 8.750 8.750 8.853 -0.103 26060 12160 1 17 . 1 1 93 93 LYS N N 93 123.450 123.450 122.729 0.721 26060 12161 1 17 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.509 0.091 26060 12162 1 17 . 1 1 93 93 LYS C C 93 174.200 174.200 175.340 -1.140 26060 12163 1 17 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.053 -0.873 26060 12164 1 17 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.266 -0.586 26060 12165 1 17 . 1 1 93 93 LYS H H 93 8.560 8.560 9.056 -0.496 26060 12166 1 17 . 1 1 94 94 ASN N N 94 118.800 118.800 123.168 -4.368 26060 12167 1 17 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.626 -0.186 26060 12168 1 17 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.393 -1.183 26060 12169 1 17 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.361 -1.561 26060 12170 1 17 . 1 1 94 94 ASN H H 94 7.820 7.820 8.171 -0.351 26060 12171 1 17 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.339 -0.009 26060 12172 1 17 . 1 1 95 95 LYS C C 95 175.800 175.800 175.377 0.423 26060 12173 1 17 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.323 -0.113 26060 12174 1 17 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.067 -0.057 26060 12175 1 17 . 1 1 96 96 GLU N N 96 118.330 118.330 118.022 0.308 26060 12176 1 17 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.368 0.142 26060 12177 1 17 . 1 1 96 96 GLU C C 96 173.200 173.200 175.032 -1.832 26060 12178 1 17 . 1 1 96 96 GLU CA C 96 54.100 54.100 54.529 -0.429 26060 12179 1 17 . 1 1 96 96 GLU CB C 96 31.470 31.470 30.289 1.181 26060 12180 1 17 . 1 1 96 96 GLU H H 96 7.120 7.120 7.554 -0.434 26060 12181 1 17 . 1 1 97 97 GLU N N 97 115.630 115.630 119.485 -3.855 26060 12182 1 17 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.159 0.271 26060 12183 1 17 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.830 -0.970 26060 12184 1 17 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.559 0.711 26060 12185 1 17 . 1 1 97 97 GLU H H 97 8.060 8.060 8.297 -0.237 26060 12186 1 17 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.228 0.772 26060 12187 1 17 . 1 1 98 98 PRO C C 98 175.900 175.900 176.237 -0.337 26060 12188 1 17 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.011 -1.851 26060 12189 1 17 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.134 1.866 26060 12190 1 17 . 1 1 99 99 ARG N N 99 122.800 122.800 119.843 2.957 26060 12191 1 17 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.296 0.334 26060 12192 1 17 . 1 1 99 99 ARG C C 99 175.800 175.800 175.670 0.130 26060 12193 1 17 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.652 -0.162 26060 12194 1 17 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.588 -0.178 26060 12195 1 17 . 1 1 99 99 ARG H H 99 8.602 8.602 8.668 -0.066 26060 12196 1 17 . 1 1 100 100 LYS N N 100 113.220 113.220 116.069 -2.849 26060 12197 1 17 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.320 0.620 26060 12198 1 17 . 1 1 100 100 LYS C C 100 174.100 174.100 174.200 -0.100 26060 12199 1 17 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.241 -0.331 26060 12200 1 17 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.573 -0.853 26060 12201 1 17 . 1 1 100 100 LYS H H 100 7.650 7.650 7.355 0.295 26060 12202 1 17 . 1 1 101 101 VAL N N 101 116.230 116.230 119.683 -3.453 26060 12203 1 17 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.196 0.074 26060 12204 1 17 . 1 1 101 101 VAL C C 101 171.600 171.600 173.480 -1.880 26060 12205 1 17 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.542 0.718 26060 12206 1 17 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.076 0.104 26060 12207 1 17 . 1 1 101 101 VAL H H 101 8.120 8.120 7.897 0.223 26060 12208 1 17 . 1 1 102 102 ARG N N 102 124.980 124.980 127.860 -2.880 26060 12209 1 17 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.879 0.281 26060 12210 1 17 . 1 1 102 102 ARG C C 102 174.340 174.340 175.172 -0.832 26060 12211 1 17 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.423 -0.673 26060 12212 1 17 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.226 2.124 26060 12213 1 17 . 1 1 102 102 ARG H H 102 7.930 7.930 8.412 -0.482 26060 12214 1 17 . 1 1 103 103 PHE N N 103 124.590 124.590 126.979 -2.389 26060 12215 1 17 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.668 0.124 26060 12216 1 17 . 1 1 103 103 PHE C C 103 174.280 174.280 175.290 -1.010 26060 12217 1 17 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.736 1.244 26060 12218 1 17 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.122 3.128 26060 12219 1 17 . 1 1 103 103 PHE H H 103 9.390 9.390 9.100 0.290 26060 12220 1 17 . 1 1 104 104 ASP N N 104 124.700 124.700 126.685 -1.985 26060 12221 1 17 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.658 0.141 26060 12222 1 17 . 1 1 104 104 ASP C C 104 174.500 174.500 175.060 -0.560 26060 12223 1 17 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.721 -0.331 26060 12224 1 17 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.541 0.689 26060 12225 1 17 . 1 1 104 104 ASP H H 104 9.010 9.010 8.757 0.253 26060 12226 1 17 . 1 1 105 105 TYR N N 105 129.840 129.840 125.102 4.738 26060 12227 1 17 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.431 -0.331 26060 12228 1 17 . 1 1 105 105 TYR C C 105 173.100 173.100 173.944 -0.844 26060 12229 1 17 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.417 1.263 26060 12230 1 17 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.206 1.644 26060 12231 1 17 . 1 1 105 105 TYR H H 105 8.140 8.140 8.421 -0.281 26060 12232 1 17 . 1 1 106 106 ASP N N 106 126.800 126.800 128.479 -1.679 26060 12233 1 17 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.254 -0.034 26060 12234 1 17 . 1 1 106 106 ASP C C 106 172.900 172.900 174.114 -1.214 26060 12235 1 17 . 1 1 106 106 ASP CA C 106 53.510 53.510 54.123 -0.613 26060 12236 1 17 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.369 -1.869 26060 12237 1 17 . 1 1 106 106 ASP H H 106 7.730 7.730 8.386 -0.656 26060 12238 1 17 . 1 1 107 107 LEU N N 107 132.150 132.150 128.086 4.064 26060 12239 1 17 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.513 -0.673 26060 12240 1 17 . 1 1 107 107 LEU C C 107 172.100 172.100 174.540 -2.440 26060 12241 1 17 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.673 0.027 26060 12242 1 17 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.378 -2.138 26060 12243 1 17 . 1 1 107 107 LEU H H 107 7.770 7.770 7.813 -0.043 26060 12244 1 17 . 1 1 108 108 PHE N N 108 118.960 118.960 122.039 -3.079 26060 12245 1 17 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.875 -0.185 26060 12246 1 17 . 1 1 108 108 PHE C C 108 174.300 174.300 173.362 0.938 26060 12247 1 17 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.349 -0.659 26060 12248 1 17 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.507 -1.217 26060 12249 1 17 . 1 1 108 108 PHE H H 108 6.060 6.060 7.398 -1.338 26060 12250 1 17 . 1 1 109 109 LEU N N 109 118.900 118.900 121.505 -2.605 26060 12251 1 17 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.663 -0.263 26060 12252 1 17 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.007 -0.847 26060 12253 1 17 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.725 -1.645 26060 12254 1 17 . 1 1 109 109 LEU H H 109 8.388 8.388 8.273 0.115 26060 12255 1 17 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.239 0.201 26060 12256 1 17 . 1 1 111 111 LEU C C 111 177.300 177.300 177.917 -0.617 26060 12257 1 17 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.517 -1.297 26060 12258 1 17 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.707 1.163 26060 12259 1 17 . 1 1 112 112 GLU N N 112 120.660 120.660 122.138 -1.478 26060 12260 1 17 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.160 0.010 26060 12261 1 17 . 1 1 112 112 GLU CA C 112 58.460 58.460 57.792 0.668 26060 12262 1 17 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.473 0.217 26060 12263 1 17 . 1 1 112 112 GLU H H 112 8.780 8.780 8.835 -0.055 26060 12264 1 17 . 1 1 113 113 GLY C C 113 173.900 173.900 173.588 0.312 26060 12265 1 17 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.015 -0.065 26060 12266 1 17 . 1 1 114 114 HIS N N 114 120.890 120.890 119.559 1.331 26060 12267 1 17 . 1 1 114 114 HIS HA H 114 4.906 4.906 4.848 0.058 26060 12268 1 17 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.614 1.156 26060 12269 1 17 . 1 1 114 114 HIS CB C 114 30.590 30.590 32.259 -1.669 26060 12270 1 17 . 1 1 114 114 HIS H H 114 7.934 7.934 7.915 0.019 26060 12271 1 17 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.057 0.743 26060 12272 1 17 . 1 1 115 115 PRO CA C 115 62.090 62.090 62.723 -0.633 26060 12273 1 17 . 1 1 115 115 PRO CB C 115 30.680 30.680 30.935 -0.255 26060 12274 1 17 . 1 1 116 116 PRO C C 116 176.600 176.600 176.710 -0.110 26060 12275 1 17 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.315 -0.015 26060 12276 1 17 . 1 1 117 117 VAL N N 117 127.480 127.480 122.073 5.407 26060 12277 1 17 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.275 -0.485 26060 12278 1 17 . 1 1 117 117 VAL CA C 117 62.700 62.700 62.261 0.439 26060 12279 1 17 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.240 -0.040 26060 12280 1 17 . 1 1 117 117 VAL H H 117 8.890 8.890 8.132 0.758 26060 12281 1 17 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.095 -0.105 26060 12282 1 17 . 1 1 118 118 ASN C C 118 172.700 172.700 173.614 -0.914 26060 12283 1 17 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.194 0.166 26060 12284 1 17 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.109 -0.909 26060 12285 1 17 . 1 1 119 119 HIS N N 119 124.930 124.930 126.155 -1.225 26060 12286 1 17 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.118 -0.298 26060 12287 1 17 . 1 1 119 119 HIS C C 119 173.500 173.500 172.905 0.595 26060 12288 1 17 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.148 1.822 26060 12289 1 17 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.026 0.644 26060 12290 1 17 . 1 1 119 119 HIS H H 119 8.790 8.790 9.066 -0.276 26060 12291 1 17 . 1 1 120 120 LEU N N 120 128.280 128.280 123.265 5.015 26060 12292 1 17 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.152 -0.202 26060 12293 1 17 . 1 1 120 120 LEU C C 120 174.030 174.030 175.004 -0.974 26060 12294 1 17 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.498 0.942 26060 12295 1 17 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.726 -0.126 26060 12296 1 17 . 1 1 120 120 LEU H H 120 7.460 7.460 8.088 -0.628 26060 12297 1 17 . 1 1 121 121 ARG N N 121 128.060 128.060 119.565 8.495 26060 12298 1 17 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.628 0.012 26060 12299 1 17 . 1 1 121 121 ARG C C 121 173.400 173.400 174.086 -0.686 26060 12300 1 17 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.673 -0.313 26060 12301 1 17 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.295 1.965 26060 12302 1 17 . 1 1 121 121 ARG H H 121 9.860 9.860 9.007 0.853 26060 12303 1 17 . 1 1 122 122 CYS N N 122 125.290 125.290 122.527 2.763 26060 12304 1 17 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.170 -0.150 26060 12305 1 17 . 1 1 122 122 CYS C C 122 174.600 174.600 174.558 0.042 26060 12306 1 17 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.184 2.106 26060 12307 1 17 . 1 1 122 122 CYS CB C 122 28.030 28.030 28.765 -0.735 26060 12308 1 17 . 1 1 122 122 CYS H H 122 8.835 8.835 8.469 0.366 26060 12309 1 17 . 1 1 123 123 GLU N N 123 125.920 125.920 124.119 1.801 26060 12310 1 17 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.464 0.216 26060 12311 1 17 . 1 1 123 123 GLU C C 123 174.500 174.500 175.088 -0.588 26060 12312 1 17 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.865 -0.445 26060 12313 1 17 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.660 -0.077 26060 12314 1 17 . 1 1 123 123 GLU H H 123 8.970 8.970 9.040 -0.070 26060 12315 1 17 . 1 1 124 124 LYS N N 124 121.837 121.837 124.010 -2.173 26060 12316 1 17 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.924 0.036 26060 12317 1 17 . 1 1 124 124 LYS C C 124 175.700 175.700 175.853 -0.153 26060 12318 1 17 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.102 0.255 26060 12319 1 17 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.286 -0.097 26060 12320 1 17 . 1 1 124 124 LYS H H 124 8.652 8.652 8.538 0.114 26060 12321 1 17 . 1 1 125 125 LEU N N 125 127.000 127.000 129.888 -2.888 26060 12322 1 17 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.578 0.072 26060 12323 1 17 . 1 1 125 125 LEU C C 125 175.110 175.110 175.389 -0.279 26060 12324 1 17 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.695 0.159 26060 12325 1 17 . 1 1 125 125 LEU CB C 125 44.267 44.267 42.842 1.425 26060 12326 1 17 . 1 1 125 125 LEU H H 125 9.175 9.175 9.169 0.006 26060 12327 1 17 . 1 1 126 126 THR N N 126 117.779 117.779 119.824 -2.045 26060 12328 1 17 . 1 1 126 126 THR HA H 126 4.650 4.650 4.459 0.191 26060 12329 1 17 . 1 1 126 126 THR C C 126 173.200 173.200 173.594 -0.394 26060 12330 1 17 . 1 1 126 126 THR CA C 126 62.036 62.036 61.741 0.295 26060 12331 1 17 . 1 1 126 126 THR CB C 126 70.284 70.284 69.053 1.230 26060 12332 1 17 . 1 1 126 126 THR H H 126 8.331 8.331 8.400 -0.069 26060 12333 1 17 . 1 1 127 127 PHE N N 127 126.576 126.576 126.998 -0.422 26060 12334 1 17 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.718 -0.128 26060 12335 1 17 . 1 1 127 127 PHE C C 127 174.860 174.860 174.757 0.103 26060 12336 1 17 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.639 0.225 26060 12337 1 17 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.735 -0.735 26060 12338 1 17 . 1 1 127 127 PHE H H 127 9.051 9.051 8.634 0.417 26060 12339 1 17 . 1 1 128 128 ASN N N 128 123.040 123.040 122.487 0.553 26060 12340 1 17 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.644 -0.024 26060 12341 1 17 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.357 1.123 26060 12342 1 17 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.440 1.020 26060 12343 1 17 . 1 1 128 128 ASN H H 128 8.880 8.880 8.683 0.197 26060 12344 1 17 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.522 0.238 26060 12345 1 17 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.674 -0.774 26060 12346 1 17 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.182 1.548 26060 12347 1 17 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.672 0.118 26060 12348 1 17 . 1 1 130 130 PRO C C 130 177.470 177.470 176.206 1.264 26060 12349 1 17 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.373 0.202 26060 12350 1 17 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.065 -0.755 26060 12351 1 17 . 1 1 131 131 THR N N 131 113.400 113.400 115.342 -1.942 26060 12352 1 17 . 1 1 131 131 THR HA H 131 4.300 4.300 4.226 0.074 26060 12353 1 17 . 1 1 131 131 THR C C 131 175.200 175.200 176.195 -0.995 26060 12354 1 17 . 1 1 131 131 THR CA C 131 62.200 62.200 61.873 0.327 26060 12355 1 17 . 1 1 131 131 THR CB C 131 70.600 70.600 71.115 -0.515 26060 12356 1 17 . 1 1 131 131 THR H H 131 8.950 8.950 9.356 -0.406 26060 12357 1 17 . 1 1 132 132 GLU N N 132 122.199 122.199 126.596 -4.397 26060 12358 1 17 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.005 0.005 26060 12359 1 17 . 1 1 132 132 GLU C C 132 178.700 178.700 178.261 0.439 26060 12360 1 17 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.629 -0.335 26060 12361 1 17 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.607 -0.446 26060 12362 1 17 . 1 1 132 132 GLU H H 132 8.932 8.932 9.000 -0.068 26060 12363 1 17 . 1 1 133 133 ASP N N 133 116.324 116.324 119.006 -2.682 26060 12364 1 17 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.365 -0.035 26060 12365 1 17 . 1 1 133 133 ASP C C 133 177.800 177.800 178.423 -0.623 26060 12366 1 17 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.341 0.205 26060 12367 1 17 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.779 1.044 26060 12368 1 17 . 1 1 133 133 ASP H H 133 8.490 8.490 8.165 0.325 26060 12369 1 17 . 1 1 134 134 PHE N N 134 119.914 119.914 120.546 -0.632 26060 12370 1 17 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.269 0.341 26060 12371 1 17 . 1 1 134 134 PHE C C 134 177.300 177.300 177.332 -0.032 26060 12372 1 17 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.563 -0.025 26060 12373 1 17 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.813 0.387 26060 12374 1 17 . 1 1 134 134 PHE H H 134 7.787 7.787 7.458 0.329 26060 12375 1 17 . 1 1 135 135 ARG N N 135 119.794 119.794 120.486 -0.692 26060 12376 1 17 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.582 -0.232 26060 12377 1 17 . 1 1 135 135 ARG C C 135 177.370 177.370 178.335 -0.965 26060 12378 1 17 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.748 0.627 26060 12379 1 17 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.966 0.430 26060 12380 1 17 . 1 1 135 135 ARG H H 135 9.087 9.087 8.759 0.328 26060 12381 1 17 . 1 1 136 136 ARG N N 136 114.554 114.554 118.475 -3.921 26060 12382 1 17 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.870 -0.050 26060 12383 1 17 . 1 1 136 136 ARG C C 136 178.950 178.950 178.721 0.229 26060 12384 1 17 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.911 -0.111 26060 12385 1 17 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.174 0.043 26060 12386 1 17 . 1 1 136 136 ARG H H 136 7.747 7.747 8.450 -0.703 26060 12387 1 17 . 1 1 137 137 LYS N N 137 118.298 118.298 119.051 -0.753 26060 12388 1 17 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.998 -0.098 26060 12389 1 17 . 1 1 137 137 LYS C C 137 177.980 177.980 179.001 -1.021 26060 12390 1 17 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.590 0.805 26060 12391 1 17 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.399 0.048 26060 12392 1 17 . 1 1 137 137 LYS H H 137 7.154 7.154 7.470 -0.316 26060 12393 1 17 . 1 1 138 138 LEU N N 138 117.159 117.159 118.331 -1.172 26060 12394 1 17 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.726 -0.306 26060 12395 1 17 . 1 1 138 138 LEU C C 138 179.100 179.100 178.369 0.731 26060 12396 1 17 . 1 1 138 138 LEU CA C 138 57.231 57.231 56.997 0.234 26060 12397 1 17 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.358 0.970 26060 12398 1 17 . 1 1 138 138 LEU H H 138 7.709 7.709 7.599 0.110 26060 12399 1 17 . 1 1 139 139 LEU N N 139 115.158 115.158 117.085 -1.927 26060 12400 1 17 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.090 0.060 26060 12401 1 17 . 1 1 139 139 LEU C C 139 177.600 177.600 178.614 -1.014 26060 12402 1 17 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.689 -1.160 26060 12403 1 17 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.834 -0.090 26060 12404 1 17 . 1 1 139 139 LEU H H 139 7.507 7.507 7.601 -0.094 26060 12405 1 17 . 1 1 140 140 LYS N N 140 120.256 120.256 118.207 2.049 26060 12406 1 17 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.976 0.134 26060 12407 1 17 . 1 1 140 140 LYS C C 140 175.800 175.800 177.089 -1.289 26060 12408 1 17 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.453 -0.401 26060 12409 1 17 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.278 0.368 26060 12410 1 17 . 1 1 140 140 LYS H H 140 7.304 7.304 7.515 -0.211 26060 12411 1 18 . 1 1 4 4 MET C C 4 175.800 175.800 177.284 -1.484 26060 12412 1 18 . 1 1 4 4 MET CA C 4 55.350 55.350 56.267 -0.917 26060 12413 1 18 . 1 1 4 4 MET CB C 4 32.880 32.880 33.230 -0.350 26060 12414 1 18 . 1 1 5 5 ALA N N 5 125.230 125.230 120.355 4.875 26060 12415 1 18 . 1 1 5 5 ALA HA H 5 4.350 4.350 3.918 0.432 26060 12416 1 18 . 1 1 5 5 ALA CA C 5 52.430 52.430 53.723 -1.293 26060 12417 1 18 . 1 1 5 5 ALA CB C 5 19.370 19.370 17.025 2.345 26060 12418 1 18 . 1 1 5 5 ALA H H 5 8.320 8.320 8.475 -0.155 26060 12419 1 18 . 1 1 6 6 SER HA H 6 4.490 4.490 4.566 -0.076 26060 12420 1 18 . 1 1 6 6 SER CA C 6 58.200 58.200 58.002 0.198 26060 12421 1 18 . 1 1 6 6 SER CB C 6 63.700 63.700 63.632 0.068 26060 12422 1 18 . 1 1 7 7 SER HA H 7 4.530 4.530 4.507 0.023 26060 12423 1 18 . 1 1 7 7 SER CA C 7 58.200 58.200 58.561 -0.361 26060 12424 1 18 . 1 1 7 7 SER CB C 7 63.700 63.700 63.711 -0.011 26060 12425 1 18 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.872 -0.262 26060 12426 1 18 . 1 1 8 8 CYS C C 8 173.500 173.500 173.871 -0.371 26060 12427 1 18 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.329 1.011 26060 12428 1 18 . 1 1 8 8 CYS CB C 8 28.490 28.490 30.808 -2.318 26060 12429 1 18 . 1 1 9 9 ALA N N 9 124.700 124.700 123.960 0.740 26060 12430 1 18 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.650 0.140 26060 12431 1 18 . 1 1 9 9 ALA C C 9 177.400 177.400 176.870 0.530 26060 12432 1 18 . 1 1 9 9 ALA CA C 9 52.070 52.070 52.002 0.068 26060 12433 1 18 . 1 1 9 9 ALA CB C 9 20.629 20.629 18.721 1.909 26060 12434 1 18 . 1 1 9 9 ALA H H 9 7.960 7.960 8.261 -0.301 26060 12435 1 18 . 1 1 10 10 VAL N N 10 120.124 120.124 125.638 -5.514 26060 12436 1 18 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.153 0.137 26060 12437 1 18 . 1 1 10 10 VAL C C 10 173.900 173.900 174.890 -0.990 26060 12438 1 18 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.608 -0.058 26060 12439 1 18 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.483 2.417 26060 12440 1 18 . 1 1 10 10 VAL H H 10 8.424 8.424 8.561 -0.137 26060 12441 1 18 . 1 1 11 11 GLN N N 11 125.818 125.818 126.411 -0.593 26060 12442 1 18 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.474 0.086 26060 12443 1 18 . 1 1 11 11 GLN C C 11 175.400 175.400 175.033 0.367 26060 12444 1 18 . 1 1 11 11 GLN CA C 11 54.123 54.123 53.503 0.620 26060 12445 1 18 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.615 1.414 26060 12446 1 18 . 1 1 11 11 GLN H H 11 8.636 8.636 8.557 0.079 26060 12447 1 18 . 1 1 12 12 VAL N N 12 119.106 119.106 119.256 -0.150 26060 12448 1 18 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.401 0.229 26060 12449 1 18 . 1 1 12 12 VAL C C 12 173.800 173.800 174.331 -0.531 26060 12450 1 18 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.212 0.588 26060 12451 1 18 . 1 1 12 12 VAL CB C 12 35.711 35.711 34.606 1.105 26060 12452 1 18 . 1 1 12 12 VAL H H 12 8.827 8.827 8.629 0.198 26060 12453 1 18 . 1 1 13 13 LYS N N 13 121.700 121.700 125.082 -3.382 26060 12454 1 18 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.267 -0.067 26060 12455 1 18 . 1 1 13 13 LYS C C 13 175.030 175.030 175.362 -0.332 26060 12456 1 18 . 1 1 13 13 LYS CA C 13 55.430 55.430 54.809 0.621 26060 12457 1 18 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.586 1.334 26060 12458 1 18 . 1 1 13 13 LYS H H 13 8.234 8.234 8.530 -0.296 26060 12459 1 18 . 1 1 14 14 LEU N N 14 119.100 119.100 126.395 -7.295 26060 12460 1 18 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.313 -0.363 26060 12461 1 18 . 1 1 14 14 LEU C C 14 175.110 175.110 174.921 0.189 26060 12462 1 18 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.464 -0.107 26060 12463 1 18 . 1 1 14 14 LEU CB C 14 46.921 46.921 46.093 0.828 26060 12464 1 18 . 1 1 14 14 LEU H H 14 8.840 8.840 8.980 -0.140 26060 12465 1 18 . 1 1 15 15 GLU N N 15 120.978 120.978 122.238 -1.260 26060 12466 1 18 . 1 1 15 15 GLU HA H 15 4.990 4.990 4.909 0.081 26060 12467 1 18 . 1 1 15 15 GLU C C 15 173.800 173.800 174.589 -0.789 26060 12468 1 18 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.623 0.805 26060 12469 1 18 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.201 -1.375 26060 12470 1 18 . 1 1 15 15 GLU H H 15 9.181 9.181 9.303 -0.122 26060 12471 1 18 . 1 1 16 16 LEU N N 16 124.438 124.438 125.970 -1.532 26060 12472 1 18 . 1 1 16 16 LEU HA H 16 5.110 5.110 4.399 0.711 26060 12473 1 18 . 1 1 16 16 LEU C C 16 174.700 174.700 175.348 -0.648 26060 12474 1 18 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.938 0.138 26060 12475 1 18 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.104 2.788 26060 12476 1 18 . 1 1 16 16 LEU H H 16 8.891 8.891 8.886 0.005 26060 12477 1 18 . 1 1 17 17 GLY N N 17 108.067 108.067 109.574 -1.507 26060 12478 1 18 . 1 1 17 17 GLY C C 17 170.350 170.350 171.513 -1.163 26060 12479 1 18 . 1 1 17 17 GLY CA C 17 46.984 46.984 44.557 2.427 26060 12480 1 18 . 1 1 17 17 GLY H H 17 7.227 7.227 7.831 -0.604 26060 12481 1 18 . 1 1 18 18 HIS N N 18 111.200 111.200 121.203 -10.003 26060 12482 1 18 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.826 -0.206 26060 12483 1 18 . 1 1 18 18 HIS C C 18 172.400 172.400 172.761 -0.361 26060 12484 1 18 . 1 1 18 18 HIS CA C 18 54.940 54.940 54.924 0.016 26060 12485 1 18 . 1 1 18 18 HIS CB C 18 34.160 34.160 33.353 0.807 26060 12486 1 18 . 1 1 18 18 HIS H H 18 8.150 8.150 9.022 -0.872 26060 12487 1 18 . 1 1 19 19 ARG N N 19 117.800 117.800 121.162 -3.362 26060 12488 1 18 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.892 0.208 26060 12489 1 18 . 1 1 19 19 ARG C C 19 175.800 175.800 174.180 1.620 26060 12490 1 18 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.976 -0.476 26060 12491 1 18 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.265 -0.615 26060 12492 1 18 . 1 1 19 19 ARG H H 19 9.010 9.010 9.019 -0.009 26060 12493 1 18 . 1 1 20 20 ALA N N 20 120.390 120.390 122.179 -1.789 26060 12494 1 18 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.526 0.004 26060 12495 1 18 . 1 1 20 20 ALA C C 20 175.800 175.800 175.041 0.759 26060 12496 1 18 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.947 1.243 26060 12497 1 18 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.038 0.712 26060 12498 1 18 . 1 1 20 20 ALA H H 20 8.070 8.070 8.523 -0.453 26060 12499 1 18 . 1 1 21 21 GLN N N 21 121.790 121.790 121.197 0.593 26060 12500 1 18 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.954 0.276 26060 12501 1 18 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.184 0.146 26060 12502 1 18 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.210 -0.310 26060 12503 1 18 . 1 1 21 21 GLN H H 21 9.240 9.240 9.141 0.099 26060 12504 1 18 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.469 -0.839 26060 12505 1 18 . 1 1 22 22 VAL C C 22 176.500 176.500 175.320 1.180 26060 12506 1 18 . 1 1 22 22 VAL CA C 22 63.030 63.030 59.929 3.101 26060 12507 1 18 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.870 -2.270 26060 12508 1 18 . 1 1 23 23 ARG N N 23 127.840 127.840 126.839 1.001 26060 12509 1 18 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.580 -0.450 26060 12510 1 18 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.259 1.341 26060 12511 1 18 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.792 1.358 26060 12512 1 18 . 1 1 23 23 ARG H H 23 8.720 8.720 8.375 0.345 26060 12513 1 18 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.082 -0.042 26060 12514 1 18 . 1 1 24 24 LYS C C 24 176.960 176.960 176.305 0.655 26060 12515 1 18 . 1 1 24 24 LYS CA C 24 58.800 58.800 58.264 0.536 26060 12516 1 18 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.581 -0.521 26060 12517 1 18 . 1 1 25 25 LYS N N 25 115.870 115.870 118.501 -2.631 26060 12518 1 18 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.696 0.134 26060 12519 1 18 . 1 1 25 25 LYS CA C 25 52.960 52.960 52.814 0.146 26060 12520 1 18 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.646 1.434 26060 12521 1 18 . 1 1 25 25 LYS H H 25 7.720 7.720 7.549 0.171 26060 12522 1 18 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.629 0.201 26060 12523 1 18 . 1 1 26 26 PRO C C 26 177.400 177.400 176.869 0.531 26060 12524 1 18 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.687 -0.037 26060 12525 1 18 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.566 -0.176 26060 12526 1 18 . 1 1 27 27 THR N N 27 111.270 111.270 114.462 -3.192 26060 12527 1 18 . 1 1 27 27 THR HA H 27 4.530 4.530 4.212 0.318 26060 12528 1 18 . 1 1 27 27 THR C C 27 177.300 177.300 176.928 0.372 26060 12529 1 18 . 1 1 27 27 THR CA C 27 61.300 61.300 61.137 0.163 26060 12530 1 18 . 1 1 27 27 THR CB C 27 71.460 71.460 69.952 1.508 26060 12531 1 18 . 1 1 27 27 THR H H 27 8.380 8.380 8.145 0.235 26060 12532 1 18 . 1 1 28 28 VAL N N 28 121.170 121.170 122.566 -1.396 26060 12533 1 18 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.802 0.081 26060 12534 1 18 . 1 1 28 28 VAL C C 28 177.030 177.030 176.150 0.880 26060 12535 1 18 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.136 0.064 26060 12536 1 18 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.638 -0.238 26060 12537 1 18 . 1 1 28 28 VAL H H 28 8.910 8.910 8.525 0.385 26060 12538 1 18 . 1 1 29 29 GLU N N 29 116.800 116.800 118.739 -1.939 26060 12539 1 18 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.111 -0.191 26060 12540 1 18 . 1 1 29 29 GLU C C 29 176.200 176.200 175.891 0.309 26060 12541 1 18 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.372 1.878 26060 12542 1 18 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.262 -1.092 26060 12543 1 18 . 1 1 29 29 GLU H H 29 7.990 7.990 8.041 -0.051 26060 12544 1 18 . 1 1 30 30 GLY N N 30 105.500 105.500 107.088 -1.588 26060 12545 1 18 . 1 1 30 30 GLY C C 30 174.900 174.900 173.728 1.172 26060 12546 1 18 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.121 -0.661 26060 12547 1 18 . 1 1 30 30 GLY H H 30 7.950 7.950 7.596 0.354 26060 12548 1 18 . 1 1 31 31 PHE N N 31 119.300 119.300 118.812 0.488 26060 12549 1 18 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.953 -0.193 26060 12550 1 18 . 1 1 31 31 PHE C C 31 176.400 176.400 175.989 0.411 26060 12551 1 18 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.457 1.443 26060 12552 1 18 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.358 -3.858 26060 12553 1 18 . 1 1 31 31 PHE H H 31 7.520 7.520 7.348 0.172 26060 12554 1 18 . 1 1 32 32 THR N N 32 112.300 112.300 116.169 -3.869 26060 12555 1 18 . 1 1 32 32 THR HA H 32 4.330 4.330 4.428 -0.098 26060 12556 1 18 . 1 1 32 32 THR C C 32 175.200 175.200 174.358 0.842 26060 12557 1 18 . 1 1 32 32 THR CA C 32 62.780 62.780 62.919 -0.139 26060 12558 1 18 . 1 1 32 32 THR CB C 32 70.350 70.350 69.988 0.362 26060 12559 1 18 . 1 1 32 32 THR H H 32 7.770 7.770 9.145 -1.375 26060 12560 1 18 . 1 1 33 33 HIS N N 33 121.900 121.900 121.954 -0.054 26060 12561 1 18 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.230 0.270 26060 12562 1 18 . 1 1 33 33 HIS C C 33 173.880 173.880 173.597 0.283 26060 12563 1 18 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.621 0.159 26060 12564 1 18 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.172 3.468 26060 12565 1 18 . 1 1 33 33 HIS H H 33 9.110 9.110 8.790 0.320 26060 12566 1 18 . 1 1 34 34 ASP N N 34 120.300 120.300 125.176 -4.876 26060 12567 1 18 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.500 -0.100 26060 12568 1 18 . 1 1 34 34 ASP C C 34 175.100 175.100 175.090 0.010 26060 12569 1 18 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.099 -0.789 26060 12570 1 18 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.410 -0.310 26060 12571 1 18 . 1 1 34 34 ASP H H 34 8.810 8.810 8.971 -0.161 26060 12572 1 18 . 1 1 35 35 TRP N N 35 119.800 119.800 121.577 -1.777 26060 12573 1 18 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.553 0.177 26060 12574 1 18 . 1 1 35 35 TRP C C 35 174.900 174.900 173.408 1.492 26060 12575 1 18 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.772 0.128 26060 12576 1 18 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.148 1.922 26060 12577 1 18 . 1 1 35 35 TRP H H 35 9.250 9.250 8.880 0.370 26060 12578 1 18 . 1 1 36 36 MET N N 36 120.980 120.980 122.008 -1.028 26060 12579 1 18 . 1 1 36 36 MET HA H 36 5.750 5.750 5.948 -0.198 26060 12580 1 18 . 1 1 36 36 MET C C 36 173.700 173.700 174.293 -0.593 26060 12581 1 18 . 1 1 36 36 MET CA C 36 54.830 54.830 54.299 0.531 26060 12582 1 18 . 1 1 36 36 MET CB C 36 35.220 35.220 36.839 -1.619 26060 12583 1 18 . 1 1 36 36 MET H H 36 9.080 9.080 9.059 0.021 26060 12584 1 18 . 1 1 37 37 VAL N N 37 126.220 126.220 121.379 4.841 26060 12585 1 18 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.375 -0.065 26060 12586 1 18 . 1 1 37 37 VAL C C 37 172.300 172.300 174.580 -2.280 26060 12587 1 18 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.916 -1.376 26060 12588 1 18 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.776 1.294 26060 12589 1 18 . 1 1 37 37 VAL H H 37 9.080 9.080 8.643 0.437 26060 12590 1 18 . 1 1 38 38 PHE N N 38 120.640 120.640 120.910 -0.270 26060 12591 1 18 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.971 -0.001 26060 12592 1 18 . 1 1 38 38 PHE C C 38 172.960 172.960 173.852 -0.892 26060 12593 1 18 . 1 1 38 38 PHE CA C 38 56.130 56.130 55.620 0.510 26060 12594 1 18 . 1 1 38 38 PHE CB C 38 43.000 43.000 42.542 0.458 26060 12595 1 18 . 1 1 38 38 PHE H H 38 8.320 8.320 8.891 -0.571 26060 12596 1 18 . 1 1 39 39 VAL N N 39 116.500 116.500 119.083 -2.583 26060 12597 1 18 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.493 -0.483 26060 12598 1 18 . 1 1 39 39 VAL C C 39 174.700 174.700 175.051 -0.351 26060 12599 1 18 . 1 1 39 39 VAL CA C 39 61.640 61.640 59.821 1.819 26060 12600 1 18 . 1 1 39 39 VAL CB C 39 35.400 35.400 34.268 1.132 26060 12601 1 18 . 1 1 39 39 VAL H H 39 8.580 8.580 9.285 -0.705 26060 12602 1 18 . 1 1 40 40 ARG N N 40 124.100 124.100 122.476 1.624 26060 12603 1 18 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.851 0.229 26060 12604 1 18 . 1 1 40 40 ARG C C 40 173.800 173.800 174.426 -0.626 26060 12605 1 18 . 1 1 40 40 ARG CA C 40 54.930 54.930 56.189 -1.259 26060 12606 1 18 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.082 1.498 26060 12607 1 18 . 1 1 40 40 ARG H H 40 9.880 9.880 8.489 1.391 26060 12608 1 18 . 1 1 41 41 GLY N N 41 107.640 107.640 106.794 0.846 26060 12609 1 18 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.827 1.143 26060 12610 1 18 . 1 1 41 41 GLY H H 41 8.910 8.910 8.689 0.221 26060 12611 1 18 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.568 -0.078 26060 12612 1 18 . 1 1 42 42 PRO C C 42 177.300 177.300 176.822 0.478 26060 12613 1 18 . 1 1 42 42 PRO CA C 42 62.440 62.440 61.763 0.677 26060 12614 1 18 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.864 -0.753 26060 12615 1 18 . 1 1 43 43 GLU N N 43 121.050 121.050 122.306 -1.256 26060 12616 1 18 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.945 -0.155 26060 12617 1 18 . 1 1 43 43 GLU C C 43 176.110 176.110 176.292 -0.182 26060 12618 1 18 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.450 -0.601 26060 12619 1 18 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.298 -0.448 26060 12620 1 18 . 1 1 43 43 GLU H H 43 9.060 9.060 8.734 0.326 26060 12621 1 18 . 1 1 44 44 HIS N N 44 114.100 114.100 115.821 -1.721 26060 12622 1 18 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.309 0.042 26060 12623 1 18 . 1 1 44 44 HIS C C 44 175.170 175.170 175.312 -0.142 26060 12624 1 18 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.487 0.163 26060 12625 1 18 . 1 1 44 44 HIS CB C 44 28.370 28.370 29.065 -0.695 26060 12626 1 18 . 1 1 44 44 HIS H H 44 8.420 8.420 8.583 -0.163 26060 12627 1 18 . 1 1 45 45 SER N N 45 115.540 115.540 116.832 -1.292 26060 12628 1 18 . 1 1 45 45 SER HA H 45 4.560 4.560 4.760 -0.200 26060 12629 1 18 . 1 1 45 45 SER C C 45 173.700 173.700 174.585 -0.885 26060 12630 1 18 . 1 1 45 45 SER CA C 45 58.710 58.710 57.471 1.239 26060 12631 1 18 . 1 1 45 45 SER CB C 45 65.040 65.040 63.502 1.538 26060 12632 1 18 . 1 1 45 45 SER H H 45 7.870 7.870 7.874 -0.004 26060 12633 1 18 . 1 1 46 46 ASN N N 46 123.900 123.900 123.245 0.655 26060 12634 1 18 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.683 0.437 26060 12635 1 18 . 1 1 46 46 ASN C C 46 176.300 176.300 175.180 1.120 26060 12636 1 18 . 1 1 46 46 ASN CA C 46 52.690 52.690 53.748 -1.058 26060 12637 1 18 . 1 1 46 46 ASN CB C 46 38.730 38.730 39.355 -0.625 26060 12638 1 18 . 1 1 46 46 ASN H H 46 9.480 9.480 8.374 1.106 26060 12639 1 18 . 1 1 47 47 ILE N N 47 115.240 115.240 115.908 -0.668 26060 12640 1 18 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.250 0.690 26060 12641 1 18 . 1 1 47 47 ILE C C 47 176.000 176.000 177.221 -1.221 26060 12642 1 18 . 1 1 47 47 ILE CA C 47 63.200 63.200 61.987 1.213 26060 12643 1 18 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.475 -1.775 26060 12644 1 18 . 1 1 47 47 ILE H H 47 8.170 8.170 8.239 -0.069 26060 12645 1 18 . 1 1 48 48 GLN N N 48 123.200 123.200 121.216 1.984 26060 12646 1 18 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.190 0.090 26060 12647 1 18 . 1 1 48 48 GLN C C 48 175.670 175.670 177.633 -1.963 26060 12648 1 18 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.521 -0.621 26060 12649 1 18 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.087 -0.097 26060 12650 1 18 . 1 1 48 48 GLN H H 48 8.850 8.850 8.793 0.057 26060 12651 1 18 . 1 1 49 49 HIS N N 49 115.400 115.400 115.640 -0.240 26060 12652 1 18 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.456 0.114 26060 12653 1 18 . 1 1 49 49 HIS C C 49 176.380 176.380 176.821 -0.441 26060 12654 1 18 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.798 -0.048 26060 12655 1 18 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.148 1.472 26060 12656 1 18 . 1 1 49 49 HIS H H 49 7.400 7.400 8.264 -0.864 26060 12657 1 18 . 1 1 50 50 PHE N N 50 109.800 109.800 113.279 -3.479 26060 12658 1 18 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.913 0.317 26060 12659 1 18 . 1 1 50 50 PHE C C 50 173.800 173.800 174.352 -0.552 26060 12660 1 18 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.893 -0.233 26060 12661 1 18 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.634 1.366 26060 12662 1 18 . 1 1 50 50 PHE H H 50 7.570 7.570 7.779 -0.209 26060 12663 1 18 . 1 1 51 51 VAL N N 51 127.810 127.810 120.423 7.387 26060 12664 1 18 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.830 -0.460 26060 12665 1 18 . 1 1 51 51 VAL C C 51 174.500 174.500 174.379 0.121 26060 12666 1 18 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.386 1.614 26060 12667 1 18 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.976 -1.696 26060 12668 1 18 . 1 1 51 51 VAL H H 51 7.810 7.810 7.986 -0.176 26060 12669 1 18 . 1 1 52 52 GLU N N 52 130.700 130.700 127.585 3.115 26060 12670 1 18 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.490 -0.510 26060 12671 1 18 . 1 1 52 52 GLU C C 52 175.400 175.400 175.749 -0.349 26060 12672 1 18 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.268 0.832 26060 12673 1 18 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.153 -0.573 26060 12674 1 18 . 1 1 52 52 GLU H H 52 9.380 9.380 8.872 0.508 26060 12675 1 18 . 1 1 53 53 LYS N N 53 109.200 109.200 115.243 -6.043 26060 12676 1 18 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.159 -0.359 26060 12677 1 18 . 1 1 53 53 LYS C C 53 172.300 172.300 174.569 -2.269 26060 12678 1 18 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.529 0.311 26060 12679 1 18 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.104 -1.854 26060 12680 1 18 . 1 1 53 53 LYS H H 53 7.190 7.190 7.440 -0.250 26060 12681 1 18 . 1 1 54 54 VAL N N 54 120.380 120.380 117.831 2.549 26060 12682 1 18 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.683 0.087 26060 12683 1 18 . 1 1 54 54 VAL C C 54 173.600 173.600 173.890 -0.290 26060 12684 1 18 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.522 -0.482 26060 12685 1 18 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.735 -2.035 26060 12686 1 18 . 1 1 54 54 VAL H H 54 8.450 8.450 8.365 0.085 26060 12687 1 18 . 1 1 55 55 VAL N N 55 126.920 126.920 122.794 4.126 26060 12688 1 18 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.224 -0.524 26060 12689 1 18 . 1 1 55 55 VAL C C 55 173.800 173.800 173.867 -0.067 26060 12690 1 18 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.721 0.149 26060 12691 1 18 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.957 -2.857 26060 12692 1 18 . 1 1 55 55 VAL H H 55 9.260 9.260 9.044 0.216 26060 12693 1 18 . 1 1 56 56 PHE N N 56 126.130 126.130 123.875 2.255 26060 12694 1 18 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.051 -0.361 26060 12695 1 18 . 1 1 56 56 PHE C C 56 174.000 174.000 174.279 -0.279 26060 12696 1 18 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.624 -0.044 26060 12697 1 18 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.960 -2.070 26060 12698 1 18 . 1 1 56 56 PHE H H 56 9.290 9.290 9.336 -0.046 26060 12699 1 18 . 1 1 57 57 HIS N N 57 124.180 124.180 123.404 0.776 26060 12700 1 18 . 1 1 57 57 HIS HA H 57 4.800 4.800 5.032 -0.232 26060 12701 1 18 . 1 1 57 57 HIS C C 57 174.700 174.700 174.721 -0.021 26060 12702 1 18 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.041 0.279 26060 12703 1 18 . 1 1 57 57 HIS CB C 57 30.100 30.100 29.208 0.892 26060 12704 1 18 . 1 1 57 57 HIS H H 57 8.690 8.690 8.521 0.169 26060 12705 1 18 . 1 1 58 58 LEU N N 58 122.050 122.050 122.611 -0.561 26060 12706 1 18 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.487 -0.247 26060 12707 1 18 . 1 1 58 58 LEU C C 58 174.400 174.400 176.943 -2.543 26060 12708 1 18 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.681 0.729 26060 12709 1 18 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.550 -1.390 26060 12710 1 18 . 1 1 58 58 LEU H H 58 9.050 9.050 8.341 0.709 26060 12711 1 18 . 1 1 59 59 HIS N N 59 118.510 118.510 118.600 -0.090 26060 12712 1 18 . 1 1 59 59 HIS C C 59 175.300 175.300 176.746 -1.446 26060 12713 1 18 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.559 3.551 26060 12714 1 18 . 1 1 59 59 HIS CB C 59 30.930 30.930 31.119 -0.189 26060 12715 1 18 . 1 1 59 59 HIS H H 59 5.160 5.160 7.786 -2.626 26060 12716 1 18 . 1 1 60 60 GLU N N 60 122.190 122.190 124.460 -2.270 26060 12717 1 18 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.028 -0.068 26060 12718 1 18 . 1 1 60 60 GLU C C 60 175.130 175.130 177.273 -2.143 26060 12719 1 18 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.235 -0.225 26060 12720 1 18 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.724 0.096 26060 12721 1 18 . 1 1 60 60 GLU H H 60 7.960 7.960 8.546 -0.586 26060 12722 1 18 . 1 1 61 61 SER N N 61 116.940 116.940 112.879 4.061 26060 12723 1 18 . 1 1 61 61 SER HA H 61 4.200 4.200 4.301 -0.101 26060 12724 1 18 . 1 1 61 61 SER CA C 61 60.010 60.010 59.533 0.477 26060 12725 1 18 . 1 1 61 61 SER CB C 61 63.140 63.140 63.438 -0.298 26060 12726 1 18 . 1 1 61 61 SER H H 61 8.540 8.540 8.175 0.365 26060 12727 1 18 . 1 1 62 62 PHE N N 62 123.700 123.700 122.334 1.366 26060 12728 1 18 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.432 0.118 26060 12729 1 18 . 1 1 62 62 PHE CA C 62 57.940 57.940 56.396 1.544 26060 12730 1 18 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.627 -0.227 26060 12731 1 18 . 1 1 62 62 PHE H H 62 8.640 8.640 7.876 0.764 26060 12732 1 18 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.459 -0.049 26060 12733 1 18 . 1 1 63 63 PRO C C 63 176.400 176.400 176.332 0.068 26060 12734 1 18 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.348 -0.748 26060 12735 1 18 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.826 0.034 26060 12736 1 18 . 1 1 64 64 ARG N N 64 116.840 116.840 121.268 -4.428 26060 12737 1 18 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.074 0.026 26060 12738 1 18 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.157 -0.547 26060 12739 1 18 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.826 0.003 26060 12740 1 18 . 1 1 64 64 ARG H H 64 8.890 8.890 8.749 0.141 26060 12741 1 18 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.373 -0.383 26060 12742 1 18 . 1 1 65 65 PRO C C 65 175.800 175.800 177.111 -1.311 26060 12743 1 18 . 1 1 65 65 PRO CA C 65 65.810 65.810 64.177 1.633 26060 12744 1 18 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.951 -0.071 26060 12745 1 18 . 1 1 66 66 LYS N N 66 119.035 119.035 119.801 -0.766 26060 12746 1 18 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.190 -0.580 26060 12747 1 18 . 1 1 66 66 LYS C C 66 175.400 175.400 175.858 -0.458 26060 12748 1 18 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.119 0.334 26060 12749 1 18 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.198 -0.468 26060 12750 1 18 . 1 1 66 66 LYS H H 66 7.630 7.630 7.849 -0.219 26060 12751 1 18 . 1 1 67 67 ARG N N 67 127.394 127.394 127.149 0.245 26060 12752 1 18 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.643 0.097 26060 12753 1 18 . 1 1 67 67 ARG C C 67 174.500 174.500 174.777 -0.277 26060 12754 1 18 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.523 0.277 26060 12755 1 18 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.736 -2.022 26060 12756 1 18 . 1 1 67 67 ARG H H 67 8.855 8.855 8.630 0.225 26060 12757 1 18 . 1 1 68 68 VAL N N 68 124.388 124.388 119.284 5.104 26060 12758 1 18 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.169 -0.589 26060 12759 1 18 . 1 1 68 68 VAL C C 68 176.850 176.850 175.285 1.565 26060 12760 1 18 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.804 2.269 26060 12761 1 18 . 1 1 68 68 VAL CB C 68 33.604 33.604 34.126 -0.521 26060 12762 1 18 . 1 1 68 68 VAL H H 68 8.681 8.681 8.385 0.296 26060 12763 1 18 . 1 1 69 69 CYS N N 69 127.080 127.080 126.025 1.055 26060 12764 1 18 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.771 0.299 26060 12765 1 18 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.773 0.573 26060 12766 1 18 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.857 0.913 26060 12767 1 18 . 1 1 69 69 CYS H H 69 9.455 9.455 9.127 0.328 26060 12768 1 18 . 1 1 70 70 LYS N N 70 125.480 125.480 123.584 1.896 26060 12769 1 18 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.501 -0.011 26060 12770 1 18 . 1 1 70 70 LYS C C 70 174.300 174.300 175.401 -1.101 26060 12771 1 18 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.386 1.374 26060 12772 1 18 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.304 -0.134 26060 12773 1 18 . 1 1 70 70 LYS H H 70 9.050 9.050 8.644 0.406 26060 12774 1 18 . 1 1 71 71 ASP N N 71 116.940 116.940 119.203 -2.263 26060 12775 1 18 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.787 0.313 26060 12776 1 18 . 1 1 71 71 ASP CA C 71 51.080 51.080 52.061 -0.981 26060 12777 1 18 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.836 1.544 26060 12778 1 18 . 1 1 71 71 ASP H H 71 7.620 7.620 7.482 0.138 26060 12779 1 18 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.100 -0.840 26060 12780 1 18 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.931 -2.281 26060 12781 1 18 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.176 -1.136 26060 12782 1 18 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.126 -0.026 26060 12783 1 18 . 1 1 73 73 PRO C C 73 174.700 174.700 175.932 -1.232 26060 12784 1 18 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.335 -2.645 26060 12785 1 18 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.332 2.708 26060 12786 1 18 . 1 1 74 74 TYR N N 74 125.400 125.400 125.298 0.102 26060 12787 1 18 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.558 0.292 26060 12788 1 18 . 1 1 74 74 TYR C C 74 172.900 172.900 175.326 -2.426 26060 12789 1 18 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.158 -2.488 26060 12790 1 18 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.791 -3.391 26060 12791 1 18 . 1 1 74 74 TYR H H 74 8.960 8.960 8.249 0.711 26060 12792 1 18 . 1 1 75 75 LYS N N 75 121.400 121.400 120.069 1.331 26060 12793 1 18 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.195 0.395 26060 12794 1 18 . 1 1 75 75 LYS C C 75 173.800 173.800 174.070 -0.270 26060 12795 1 18 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.510 0.140 26060 12796 1 18 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.756 -0.866 26060 12797 1 18 . 1 1 75 75 LYS H H 75 7.670 7.670 8.296 -0.626 26060 12798 1 18 . 1 1 76 76 VAL N N 76 119.800 119.800 118.585 1.215 26060 12799 1 18 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.292 -0.402 26060 12800 1 18 . 1 1 76 76 VAL C C 76 173.900 173.900 173.711 0.189 26060 12801 1 18 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.331 1.399 26060 12802 1 18 . 1 1 76 76 VAL CB C 76 35.540 35.540 36.111 -0.571 26060 12803 1 18 . 1 1 76 76 VAL H H 76 8.180 8.180 8.002 0.178 26060 12804 1 18 . 1 1 77 77 GLU N N 77 126.190 126.190 126.510 -0.320 26060 12805 1 18 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.928 0.022 26060 12806 1 18 . 1 1 77 77 GLU C C 77 174.700 174.700 175.421 -0.721 26060 12807 1 18 . 1 1 77 77 GLU CA C 77 54.940 54.940 54.968 -0.028 26060 12808 1 18 . 1 1 77 77 GLU CB C 77 31.550 31.550 30.831 0.720 26060 12809 1 18 . 1 1 77 77 GLU H H 77 8.270 8.270 8.628 -0.358 26060 12810 1 18 . 1 1 78 78 GLU N N 78 126.180 126.180 123.952 2.228 26060 12811 1 18 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.627 -0.177 26060 12812 1 18 . 1 1 78 78 GLU C C 78 175.400 175.400 174.002 1.398 26060 12813 1 18 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.171 -0.129 26060 12814 1 18 . 1 1 78 78 GLU CB C 78 37.100 37.100 34.031 3.069 26060 12815 1 18 . 1 1 78 78 GLU H H 78 7.870 7.870 8.550 -0.680 26060 12816 1 18 . 1 1 79 79 SER N N 79 112.109 112.109 113.444 -1.335 26060 12817 1 18 . 1 1 79 79 SER HA H 79 5.560 5.560 5.455 0.105 26060 12818 1 18 . 1 1 79 79 SER C C 79 172.490 172.490 173.159 -0.669 26060 12819 1 18 . 1 1 79 79 SER CA C 79 57.754 57.754 56.581 1.173 26060 12820 1 18 . 1 1 79 79 SER CB C 79 65.861 65.861 65.355 0.506 26060 12821 1 18 . 1 1 79 79 SER H H 79 7.714 7.714 8.373 -0.659 26060 12822 1 18 . 1 1 80 80 GLY N N 80 106.048 106.048 110.837 -4.789 26060 12823 1 18 . 1 1 80 80 GLY C C 80 172.630 172.630 171.860 0.770 26060 12824 1 18 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.665 0.905 26060 12825 1 18 . 1 1 80 80 GLY H H 80 8.828 8.828 9.000 -0.172 26060 12826 1 18 . 1 1 81 81 TYR N N 81 115.280 115.280 114.000 1.280 26060 12827 1 18 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.291 0.389 26060 12828 1 18 . 1 1 81 81 TYR C C 81 174.100 174.100 174.128 -0.028 26060 12829 1 18 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.021 -1.521 26060 12830 1 18 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.398 1.942 26060 12831 1 18 . 1 1 81 81 TYR H H 81 8.770 8.770 8.121 0.649 26060 12832 1 18 . 1 1 82 82 ALA N N 82 122.350 122.350 122.832 -0.482 26060 12833 1 18 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.569 -0.169 26060 12834 1 18 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.676 0.364 26060 12835 1 18 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.186 1.214 26060 12836 1 18 . 1 1 82 82 ALA H H 82 7.160 7.160 7.410 -0.250 26060 12837 1 18 . 1 1 83 83 GLY N N 83 107.100 107.100 106.380 0.720 26060 12838 1 18 . 1 1 83 83 GLY C C 83 172.500 172.500 173.483 -0.983 26060 12839 1 18 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.045 0.565 26060 12840 1 18 . 1 1 83 83 GLY H H 83 8.220 8.220 8.208 0.012 26060 12841 1 18 . 1 1 84 84 PHE N N 84 111.660 111.660 115.522 -3.862 26060 12842 1 18 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.529 0.161 26060 12843 1 18 . 1 1 84 84 PHE C C 84 172.460 172.460 172.976 -0.516 26060 12844 1 18 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.315 0.185 26060 12845 1 18 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.521 -0.941 26060 12846 1 18 . 1 1 84 84 PHE H H 84 7.700 7.700 8.232 -0.532 26060 12847 1 18 . 1 1 85 85 ILE N N 85 117.810 117.810 121.322 -3.512 26060 12848 1 18 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.072 0.238 26060 12849 1 18 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.980 -1.640 26060 12850 1 18 . 1 1 85 85 ILE CB C 85 35.260 35.260 36.899 -1.639 26060 12851 1 18 . 1 1 85 85 ILE H H 85 8.340 8.340 8.293 0.047 26060 12852 1 18 . 1 1 86 86 LEU N N 86 108.130 108.130 129.242 -21.112 26060 12853 1 18 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.050 -0.070 26060 12854 1 18 . 1 1 86 86 LEU CA C 86 53.200 53.200 50.999 2.201 26060 12855 1 18 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.227 0.073 26060 12856 1 18 . 1 1 86 86 LEU H H 86 9.900 9.900 8.671 1.229 26060 12857 1 18 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.508 0.592 26060 12858 1 18 . 1 1 87 87 PRO C C 87 175.340 175.340 175.712 -0.372 26060 12859 1 18 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.712 0.399 26060 12860 1 18 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.650 0.910 26060 12861 1 18 . 1 1 88 88 ILE N N 88 126.000 126.000 126.187 -0.187 26060 12862 1 18 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.285 0.505 26060 12863 1 18 . 1 1 88 88 ILE C C 88 176.100 176.100 175.216 0.884 26060 12864 1 18 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.485 0.075 26060 12865 1 18 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.994 2.006 26060 12866 1 18 . 1 1 88 88 ILE H H 88 9.380 9.380 8.408 0.972 26060 12867 1 18 . 1 1 89 89 GLU N N 89 123.900 123.900 124.995 -1.095 26060 12868 1 18 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.317 -0.117 26060 12869 1 18 . 1 1 89 89 GLU C C 89 173.800 173.800 175.592 -1.792 26060 12870 1 18 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.340 -0.370 26060 12871 1 18 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.578 0.802 26060 12872 1 18 . 1 1 89 89 GLU H H 89 9.320 9.320 8.973 0.347 26060 12873 1 18 . 1 1 90 90 VAL N N 90 123.980 123.980 123.267 0.713 26060 12874 1 18 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.176 -0.016 26060 12875 1 18 . 1 1 90 90 VAL C C 90 174.800 174.800 174.527 0.273 26060 12876 1 18 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.110 0.880 26060 12877 1 18 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.273 -0.783 26060 12878 1 18 . 1 1 90 90 VAL H H 90 8.630 8.630 8.625 0.005 26060 12879 1 18 . 1 1 91 91 TYR N N 91 124.230 124.230 126.448 -2.218 26060 12880 1 18 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.687 -0.027 26060 12881 1 18 . 1 1 91 91 TYR C C 91 176.800 176.800 175.541 1.259 26060 12882 1 18 . 1 1 91 91 TYR CA C 91 56.700 56.700 56.874 -0.174 26060 12883 1 18 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.957 1.283 26060 12884 1 18 . 1 1 91 91 TYR H H 91 8.640 8.640 9.157 -0.517 26060 12885 1 18 . 1 1 92 92 PHE N N 92 121.200 121.200 122.351 -1.151 26060 12886 1 18 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.187 0.473 26060 12887 1 18 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.275 1.235 26060 12888 1 18 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.719 0.981 26060 12889 1 18 . 1 1 92 92 PHE H H 92 8.750 8.750 8.787 -0.037 26060 12890 1 18 . 1 1 93 93 LYS N N 93 123.450 123.450 122.833 0.617 26060 12891 1 18 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.572 0.028 26060 12892 1 18 . 1 1 93 93 LYS C C 93 174.200 174.200 175.179 -0.979 26060 12893 1 18 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.072 -0.892 26060 12894 1 18 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.150 -0.470 26060 12895 1 18 . 1 1 93 93 LYS H H 93 8.560 8.560 8.930 -0.370 26060 12896 1 18 . 1 1 94 94 ASN N N 94 118.800 118.800 121.703 -2.903 26060 12897 1 18 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.770 -0.330 26060 12898 1 18 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.232 -1.022 26060 12899 1 18 . 1 1 94 94 ASN CB C 94 39.800 39.800 39.853 -0.054 26060 12900 1 18 . 1 1 94 94 ASN H H 94 7.820 7.820 7.942 -0.122 26060 12901 1 18 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.326 0.004 26060 12902 1 18 . 1 1 95 95 LYS C C 95 175.800 175.800 176.004 -0.204 26060 12903 1 18 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.295 -0.085 26060 12904 1 18 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.165 -0.155 26060 12905 1 18 . 1 1 96 96 GLU N N 96 118.330 118.330 120.497 -2.167 26060 12906 1 18 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.294 0.216 26060 12907 1 18 . 1 1 96 96 GLU C C 96 173.200 173.200 175.572 -2.372 26060 12908 1 18 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.343 -1.243 26060 12909 1 18 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.121 2.349 26060 12910 1 18 . 1 1 96 96 GLU H H 96 7.120 7.120 7.626 -0.506 26060 12911 1 18 . 1 1 97 97 GLU N N 97 115.630 115.630 119.815 -4.185 26060 12912 1 18 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.169 0.261 26060 12913 1 18 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.950 -1.090 26060 12914 1 18 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.408 0.862 26060 12915 1 18 . 1 1 97 97 GLU H H 97 8.060 8.060 8.307 -0.247 26060 12916 1 18 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.195 0.805 26060 12917 1 18 . 1 1 98 98 PRO C C 98 175.900 175.900 176.817 -0.917 26060 12918 1 18 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.001 -1.841 26060 12919 1 18 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.727 2.273 26060 12920 1 18 . 1 1 99 99 ARG N N 99 122.800 122.800 119.806 2.994 26060 12921 1 18 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.470 0.160 26060 12922 1 18 . 1 1 99 99 ARG C C 99 175.800 175.800 175.792 0.008 26060 12923 1 18 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.437 0.053 26060 12924 1 18 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.680 -0.271 26060 12925 1 18 . 1 1 99 99 ARG H H 99 8.602 8.602 8.591 0.011 26060 12926 1 18 . 1 1 100 100 LYS N N 100 113.220 113.220 116.237 -3.017 26060 12927 1 18 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.835 0.105 26060 12928 1 18 . 1 1 100 100 LYS C C 100 174.100 174.100 174.325 -0.225 26060 12929 1 18 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.228 -0.318 26060 12930 1 18 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.742 -1.022 26060 12931 1 18 . 1 1 100 100 LYS H H 100 7.650 7.650 7.328 0.322 26060 12932 1 18 . 1 1 101 101 VAL N N 101 116.230 116.230 120.180 -3.950 26060 12933 1 18 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.274 -0.003 26060 12934 1 18 . 1 1 101 101 VAL C C 101 171.600 171.600 173.442 -1.842 26060 12935 1 18 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.577 0.683 26060 12936 1 18 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.249 -0.069 26060 12937 1 18 . 1 1 101 101 VAL H H 101 8.120 8.120 8.421 -0.301 26060 12938 1 18 . 1 1 102 102 ARG N N 102 124.980 124.980 127.880 -2.900 26060 12939 1 18 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.998 0.162 26060 12940 1 18 . 1 1 102 102 ARG C C 102 174.340 174.340 175.186 -0.846 26060 12941 1 18 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.467 -0.717 26060 12942 1 18 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.754 1.596 26060 12943 1 18 . 1 1 102 102 ARG H H 102 7.930 7.930 8.365 -0.435 26060 12944 1 18 . 1 1 103 103 PHE N N 103 124.590 124.590 126.771 -2.181 26060 12945 1 18 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.779 0.013 26060 12946 1 18 . 1 1 103 103 PHE C C 103 174.280 174.280 175.260 -0.980 26060 12947 1 18 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.246 1.734 26060 12948 1 18 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.785 2.465 26060 12949 1 18 . 1 1 103 103 PHE H H 103 9.390 9.390 9.100 0.290 26060 12950 1 18 . 1 1 104 104 ASP N N 104 124.700 124.700 124.624 0.076 26060 12951 1 18 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.547 0.252 26060 12952 1 18 . 1 1 104 104 ASP C C 104 174.500 174.500 175.285 -0.785 26060 12953 1 18 . 1 1 104 104 ASP CA C 104 54.390 54.390 53.800 0.590 26060 12954 1 18 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.196 1.034 26060 12955 1 18 . 1 1 104 104 ASP H H 104 9.010 9.010 8.868 0.142 26060 12956 1 18 . 1 1 105 105 TYR N N 105 129.840 129.840 123.632 6.208 26060 12957 1 18 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.458 -0.358 26060 12958 1 18 . 1 1 105 105 TYR C C 105 173.100 173.100 173.804 -0.704 26060 12959 1 18 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.691 0.989 26060 12960 1 18 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.961 0.889 26060 12961 1 18 . 1 1 105 105 TYR H H 105 8.140 8.140 8.097 0.043 26060 12962 1 18 . 1 1 106 106 ASP N N 106 126.800 126.800 128.008 -1.208 26060 12963 1 18 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.352 -0.132 26060 12964 1 18 . 1 1 106 106 ASP C C 106 172.900 172.900 174.524 -1.624 26060 12965 1 18 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.566 -0.056 26060 12966 1 18 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.000 -1.500 26060 12967 1 18 . 1 1 106 106 ASP H H 106 7.730 7.730 8.335 -0.605 26060 12968 1 18 . 1 1 107 107 LEU N N 107 132.150 132.150 128.103 4.047 26060 12969 1 18 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.371 -0.531 26060 12970 1 18 . 1 1 107 107 LEU C C 107 172.100 172.100 174.637 -2.537 26060 12971 1 18 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.920 -0.220 26060 12972 1 18 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.787 -1.547 26060 12973 1 18 . 1 1 107 107 LEU H H 107 7.770 7.770 7.549 0.221 26060 12974 1 18 . 1 1 108 108 PHE N N 108 118.960 118.960 121.776 -2.816 26060 12975 1 18 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.903 -0.213 26060 12976 1 18 . 1 1 108 108 PHE C C 108 174.300 174.300 173.579 0.721 26060 12977 1 18 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.161 -0.471 26060 12978 1 18 . 1 1 108 108 PHE CB C 108 40.290 40.290 41.038 -0.748 26060 12979 1 18 . 1 1 108 108 PHE H H 108 6.060 6.060 7.126 -1.066 26060 12980 1 18 . 1 1 109 109 LEU N N 109 118.900 118.900 121.755 -2.855 26060 12981 1 18 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.704 -0.304 26060 12982 1 18 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.193 -1.033 26060 12983 1 18 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.589 -1.509 26060 12984 1 18 . 1 1 109 109 LEU H H 109 8.388 8.388 8.309 0.079 26060 12985 1 18 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.200 0.240 26060 12986 1 18 . 1 1 111 111 LEU C C 111 177.300 177.300 176.809 0.491 26060 12987 1 18 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.037 -0.817 26060 12988 1 18 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.341 1.529 26060 12989 1 18 . 1 1 112 112 GLU N N 112 120.660 120.660 122.953 -2.293 26060 12990 1 18 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.051 0.119 26060 12991 1 18 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.666 -0.206 26060 12992 1 18 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.135 -0.445 26060 12993 1 18 . 1 1 112 112 GLU H H 112 8.780 8.780 8.669 0.111 26060 12994 1 18 . 1 1 113 113 GLY C C 113 173.900 173.900 174.012 -0.112 26060 12995 1 18 . 1 1 113 113 GLY CA C 113 44.950 44.950 45.619 -0.669 26060 12996 1 18 . 1 1 114 114 HIS N N 114 120.890 120.890 116.867 4.023 26060 12997 1 18 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.135 -0.229 26060 12998 1 18 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.137 1.633 26060 12999 1 18 . 1 1 114 114 HIS CB C 114 30.590 30.590 29.770 0.820 26060 13000 1 18 . 1 1 114 114 HIS H H 114 7.934 7.934 7.664 0.270 26060 13001 1 18 . 1 1 115 115 PRO HA H 115 4.800 4.800 5.377 -0.577 26060 13002 1 18 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.618 1.472 26060 13003 1 18 . 1 1 115 115 PRO CB C 115 30.680 30.680 32.737 -2.057 26060 13004 1 18 . 1 1 116 116 PRO C C 116 176.600 176.600 175.689 0.911 26060 13005 1 18 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.069 0.231 26060 13006 1 18 . 1 1 117 117 VAL N N 117 127.480 127.480 126.745 0.735 26060 13007 1 18 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.334 -0.544 26060 13008 1 18 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.901 0.799 26060 13009 1 18 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.429 -0.229 26060 13010 1 18 . 1 1 117 117 VAL H H 117 8.890 8.890 7.981 0.909 26060 13011 1 18 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.086 -0.096 26060 13012 1 18 . 1 1 118 118 ASN C C 118 172.700 172.700 173.674 -0.974 26060 13013 1 18 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.391 -0.031 26060 13014 1 18 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.055 -0.855 26060 13015 1 18 . 1 1 119 119 HIS N N 119 124.930 124.930 125.978 -1.048 26060 13016 1 18 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.119 -0.299 26060 13017 1 18 . 1 1 119 119 HIS C C 119 173.500 173.500 172.945 0.555 26060 13018 1 18 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.929 2.041 26060 13019 1 18 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.064 0.606 26060 13020 1 18 . 1 1 119 119 HIS H H 119 8.790 8.790 9.111 -0.321 26060 13021 1 18 . 1 1 120 120 LEU N N 120 128.280 128.280 124.140 4.140 26060 13022 1 18 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.128 -0.178 26060 13023 1 18 . 1 1 120 120 LEU C C 120 174.030 174.030 175.112 -1.082 26060 13024 1 18 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.465 0.975 26060 13025 1 18 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.432 0.168 26060 13026 1 18 . 1 1 120 120 LEU H H 120 7.460 7.460 8.377 -0.917 26060 13027 1 18 . 1 1 121 121 ARG N N 121 128.060 128.060 121.629 6.431 26060 13028 1 18 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.691 -0.051 26060 13029 1 18 . 1 1 121 121 ARG C C 121 173.400 173.400 173.466 -0.066 26060 13030 1 18 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.743 -0.383 26060 13031 1 18 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.224 2.036 26060 13032 1 18 . 1 1 121 121 ARG H H 121 9.860 9.860 9.000 0.860 26060 13033 1 18 . 1 1 122 122 CYS N N 122 125.290 125.290 120.079 5.211 26060 13034 1 18 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.197 -0.177 26060 13035 1 18 . 1 1 122 122 CYS C C 122 174.600 174.600 174.177 0.423 26060 13036 1 18 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.729 1.561 26060 13037 1 18 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.887 -2.857 26060 13038 1 18 . 1 1 122 122 CYS H H 122 8.835 8.835 8.554 0.281 26060 13039 1 18 . 1 1 123 123 GLU N N 123 125.920 125.920 123.744 2.176 26060 13040 1 18 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.472 0.208 26060 13041 1 18 . 1 1 123 123 GLU C C 123 174.500 174.500 175.013 -0.513 26060 13042 1 18 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.941 -0.521 26060 13043 1 18 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.749 -0.166 26060 13044 1 18 . 1 1 123 123 GLU H H 123 8.970 8.970 9.037 -0.067 26060 13045 1 18 . 1 1 124 124 LYS N N 124 121.837 121.837 123.191 -1.354 26060 13046 1 18 . 1 1 124 124 LYS HA H 124 4.960 4.960 5.104 -0.144 26060 13047 1 18 . 1 1 124 124 LYS C C 124 175.700 175.700 175.584 0.116 26060 13048 1 18 . 1 1 124 124 LYS CA C 124 55.357 55.357 54.984 0.373 26060 13049 1 18 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.849 -0.660 26060 13050 1 18 . 1 1 124 124 LYS H H 124 8.652 8.652 8.473 0.179 26060 13051 1 18 . 1 1 125 125 LEU N N 125 127.000 127.000 129.045 -2.045 26060 13052 1 18 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.568 0.082 26060 13053 1 18 . 1 1 125 125 LEU C C 125 175.110 175.110 175.274 -0.164 26060 13054 1 18 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.870 -0.016 26060 13055 1 18 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.361 0.906 26060 13056 1 18 . 1 1 125 125 LEU H H 125 9.175 9.175 9.255 -0.080 26060 13057 1 18 . 1 1 126 126 THR N N 126 117.779 117.779 120.028 -2.249 26060 13058 1 18 . 1 1 126 126 THR HA H 126 4.650 4.650 4.473 0.177 26060 13059 1 18 . 1 1 126 126 THR C C 126 173.200 173.200 173.553 -0.353 26060 13060 1 18 . 1 1 126 126 THR CA C 126 62.036 62.036 61.624 0.412 26060 13061 1 18 . 1 1 126 126 THR CB C 126 70.284 70.284 68.895 1.389 26060 13062 1 18 . 1 1 126 126 THR H H 126 8.331 8.331 8.411 -0.080 26060 13063 1 18 . 1 1 127 127 PHE N N 127 126.576 126.576 127.328 -0.752 26060 13064 1 18 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.619 -0.029 26060 13065 1 18 . 1 1 127 127 PHE C C 127 174.860 174.860 174.751 0.109 26060 13066 1 18 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.864 -0.000 26060 13067 1 18 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.425 -0.425 26060 13068 1 18 . 1 1 127 127 PHE H H 127 9.051 9.051 8.977 0.074 26060 13069 1 18 . 1 1 128 128 ASN N N 128 123.040 123.040 124.264 -1.224 26060 13070 1 18 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.643 -0.023 26060 13071 1 18 . 1 1 128 128 ASN CA C 128 54.480 54.480 54.248 0.232 26060 13072 1 18 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.831 0.629 26060 13073 1 18 . 1 1 128 128 ASN H H 128 8.880 8.880 8.745 0.135 26060 13074 1 18 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.539 0.221 26060 13075 1 18 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.410 -0.510 26060 13076 1 18 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.458 1.272 26060 13077 1 18 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.638 0.152 26060 13078 1 18 . 1 1 130 130 PRO C C 130 177.470 177.470 177.177 0.293 26060 13079 1 18 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.435 0.139 26060 13080 1 18 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.926 -0.616 26060 13081 1 18 . 1 1 131 131 THR N N 131 113.400 113.400 115.232 -1.832 26060 13082 1 18 . 1 1 131 131 THR HA H 131 4.300 4.300 4.167 0.133 26060 13083 1 18 . 1 1 131 131 THR C C 131 175.200 175.200 176.079 -0.879 26060 13084 1 18 . 1 1 131 131 THR CA C 131 62.200 62.200 61.884 0.316 26060 13085 1 18 . 1 1 131 131 THR CB C 131 70.600 70.600 70.356 0.244 26060 13086 1 18 . 1 1 131 131 THR H H 131 8.950 8.950 8.337 0.613 26060 13087 1 18 . 1 1 132 132 GLU N N 132 122.199 122.199 124.047 -1.848 26060 13088 1 18 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.025 -0.015 26060 13089 1 18 . 1 1 132 132 GLU C C 132 178.700 178.700 178.431 0.269 26060 13090 1 18 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.252 0.042 26060 13091 1 18 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.661 -0.500 26060 13092 1 18 . 1 1 132 132 GLU H H 132 8.932 8.932 9.011 -0.079 26060 13093 1 18 . 1 1 133 133 ASP N N 133 116.324 116.324 120.198 -3.874 26060 13094 1 18 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.399 -0.069 26060 13095 1 18 . 1 1 133 133 ASP C C 133 177.800 177.800 178.681 -0.881 26060 13096 1 18 . 1 1 133 133 ASP CA C 133 57.546 57.546 58.090 -0.543 26060 13097 1 18 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.548 1.275 26060 13098 1 18 . 1 1 133 133 ASP H H 133 8.490 8.490 8.056 0.434 26060 13099 1 18 . 1 1 134 134 PHE N N 134 119.914 119.914 120.604 -0.690 26060 13100 1 18 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.279 0.331 26060 13101 1 18 . 1 1 134 134 PHE C C 134 177.300 177.300 177.583 -0.283 26060 13102 1 18 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.586 -0.048 26060 13103 1 18 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.910 0.290 26060 13104 1 18 . 1 1 134 134 PHE H H 134 7.787 7.787 8.028 -0.241 26060 13105 1 18 . 1 1 135 135 ARG N N 135 119.794 119.794 120.233 -0.439 26060 13106 1 18 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.600 -0.250 26060 13107 1 18 . 1 1 135 135 ARG C C 135 177.370 177.370 178.356 -0.986 26060 13108 1 18 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.780 0.596 26060 13109 1 18 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.984 0.412 26060 13110 1 18 . 1 1 135 135 ARG H H 135 9.087 9.087 8.749 0.338 26060 13111 1 18 . 1 1 136 136 ARG N N 136 114.554 114.554 118.665 -4.111 26060 13112 1 18 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.873 -0.053 26060 13113 1 18 . 1 1 136 136 ARG C C 136 178.950 178.950 178.823 0.127 26060 13114 1 18 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.995 -0.195 26060 13115 1 18 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.171 0.046 26060 13116 1 18 . 1 1 136 136 ARG H H 136 7.747 7.747 8.407 -0.660 26060 13117 1 18 . 1 1 137 137 LYS N N 137 118.298 118.298 119.024 -0.726 26060 13118 1 18 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.017 -0.117 26060 13119 1 18 . 1 1 137 137 LYS C C 137 177.980 177.980 179.051 -1.071 26060 13120 1 18 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.620 0.775 26060 13121 1 18 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.477 -0.030 26060 13122 1 18 . 1 1 137 137 LYS H H 137 7.154 7.154 7.529 -0.375 26060 13123 1 18 . 1 1 138 138 LEU N N 138 117.159 117.159 118.757 -1.598 26060 13124 1 18 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.746 -0.326 26060 13125 1 18 . 1 1 138 138 LEU C C 138 179.100 179.100 178.368 0.732 26060 13126 1 18 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.138 0.093 26060 13127 1 18 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.424 0.904 26060 13128 1 18 . 1 1 138 138 LEU H H 138 7.709 7.709 7.794 -0.085 26060 13129 1 18 . 1 1 139 139 LEU N N 139 115.158 115.158 117.359 -2.201 26060 13130 1 18 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.098 0.052 26060 13131 1 18 . 1 1 139 139 LEU C C 139 177.600 177.600 178.659 -1.059 26060 13132 1 18 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.714 -1.185 26060 13133 1 18 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.894 -0.150 26060 13134 1 18 . 1 1 139 139 LEU H H 139 7.507 7.507 7.716 -0.209 26060 13135 1 18 . 1 1 140 140 LYS N N 140 120.256 120.256 118.296 1.960 26060 13136 1 18 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.981 0.129 26060 13137 1 18 . 1 1 140 140 LYS C C 140 175.800 175.800 177.126 -1.326 26060 13138 1 18 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.779 -0.727 26060 13139 1 18 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.327 0.319 26060 13140 1 18 . 1 1 140 140 LYS H H 140 7.304 7.304 7.553 -0.249 26060 13141 1 19 . 1 1 4 4 MET C C 4 175.800 175.800 175.262 0.538 26060 13142 1 19 . 1 1 4 4 MET CA C 4 55.350 55.350 55.075 0.275 26060 13143 1 19 . 1 1 4 4 MET CB C 4 32.880 32.880 32.350 0.530 26060 13144 1 19 . 1 1 5 5 ALA N N 5 125.230 125.230 126.532 -1.302 26060 13145 1 19 . 1 1 5 5 ALA HA H 5 4.350 4.350 3.970 0.380 26060 13146 1 19 . 1 1 5 5 ALA CA C 5 52.430 52.430 52.235 0.195 26060 13147 1 19 . 1 1 5 5 ALA CB C 5 19.370 19.370 18.133 1.237 26060 13148 1 19 . 1 1 5 5 ALA H H 5 8.320 8.320 8.494 -0.174 26060 13149 1 19 . 1 1 6 6 SER HA H 6 4.490 4.490 4.500 -0.010 26060 13150 1 19 . 1 1 6 6 SER CA C 6 58.200 58.200 58.167 0.033 26060 13151 1 19 . 1 1 6 6 SER CB C 6 63.700 63.700 63.588 0.112 26060 13152 1 19 . 1 1 7 7 SER HA H 7 4.530 4.530 4.448 0.082 26060 13153 1 19 . 1 1 7 7 SER CA C 7 58.200 58.200 58.799 -0.599 26060 13154 1 19 . 1 1 7 7 SER CB C 7 63.700 63.700 63.559 0.141 26060 13155 1 19 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.673 -0.063 26060 13156 1 19 . 1 1 8 8 CYS C C 8 173.500 173.500 173.549 -0.049 26060 13157 1 19 . 1 1 8 8 CYS CA C 8 58.340 58.340 56.733 1.607 26060 13158 1 19 . 1 1 8 8 CYS CB C 8 28.490 28.490 31.111 -2.621 26060 13159 1 19 . 1 1 9 9 ALA N N 9 124.700 124.700 123.676 1.024 26060 13160 1 19 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.736 0.054 26060 13161 1 19 . 1 1 9 9 ALA C C 9 177.400 177.400 177.048 0.352 26060 13162 1 19 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.740 0.329 26060 13163 1 19 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.143 1.486 26060 13164 1 19 . 1 1 9 9 ALA H H 9 7.960 7.960 8.344 -0.384 26060 13165 1 19 . 1 1 10 10 VAL N N 10 120.124 120.124 125.139 -5.015 26060 13166 1 19 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.059 0.231 26060 13167 1 19 . 1 1 10 10 VAL C C 10 173.900 173.900 175.165 -1.265 26060 13168 1 19 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.784 -0.234 26060 13169 1 19 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.122 2.778 26060 13170 1 19 . 1 1 10 10 VAL H H 10 8.424 8.424 8.412 0.012 26060 13171 1 19 . 1 1 11 11 GLN N N 11 125.818 125.818 127.042 -1.224 26060 13172 1 19 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.456 0.104 26060 13173 1 19 . 1 1 11 11 GLN C C 11 175.400 175.400 175.298 0.102 26060 13174 1 19 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.679 -0.556 26060 13175 1 19 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.328 1.700 26060 13176 1 19 . 1 1 11 11 GLN H H 11 8.636 8.636 8.537 0.099 26060 13177 1 19 . 1 1 12 12 VAL N N 12 119.106 119.106 119.305 -0.199 26060 13178 1 19 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.392 0.238 26060 13179 1 19 . 1 1 12 12 VAL C C 12 173.800 173.800 174.718 -0.918 26060 13180 1 19 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.244 0.556 26060 13181 1 19 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.851 1.860 26060 13182 1 19 . 1 1 12 12 VAL H H 12 8.827 8.827 8.848 -0.021 26060 13183 1 19 . 1 1 13 13 LYS N N 13 121.700 121.700 125.338 -3.638 26060 13184 1 19 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.347 -0.147 26060 13185 1 19 . 1 1 13 13 LYS C C 13 175.030 175.030 175.942 -0.912 26060 13186 1 19 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.026 0.404 26060 13187 1 19 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.169 1.750 26060 13188 1 19 . 1 1 13 13 LYS H H 13 8.234 8.234 8.544 -0.310 26060 13189 1 19 . 1 1 14 14 LEU N N 14 119.100 119.100 124.737 -5.637 26060 13190 1 19 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.291 -0.341 26060 13191 1 19 . 1 1 14 14 LEU C C 14 175.110 175.110 175.325 -0.215 26060 13192 1 19 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.377 -0.020 26060 13193 1 19 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.997 0.924 26060 13194 1 19 . 1 1 14 14 LEU H H 14 8.840 8.840 8.390 0.450 26060 13195 1 19 . 1 1 15 15 GLU N N 15 120.978 120.978 122.867 -1.889 26060 13196 1 19 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.159 -0.169 26060 13197 1 19 . 1 1 15 15 GLU C C 15 173.800 173.800 174.983 -1.183 26060 13198 1 19 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.608 0.820 26060 13199 1 19 . 1 1 15 15 GLU CB C 15 31.826 31.826 32.768 -0.942 26060 13200 1 19 . 1 1 15 15 GLU H H 15 9.181 9.181 9.285 -0.104 26060 13201 1 19 . 1 1 16 16 LEU N N 16 124.438 124.438 126.756 -2.318 26060 13202 1 19 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.421 -0.311 26060 13203 1 19 . 1 1 16 16 LEU C C 16 174.700 174.700 176.301 -1.601 26060 13204 1 19 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.547 0.529 26060 13205 1 19 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.626 2.266 26060 13206 1 19 . 1 1 16 16 LEU H H 16 8.891 8.891 8.904 -0.013 26060 13207 1 19 . 1 1 17 17 GLY N N 17 108.067 108.067 108.401 -0.334 26060 13208 1 19 . 1 1 17 17 GLY C C 17 170.350 170.350 172.363 -2.013 26060 13209 1 19 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.300 1.684 26060 13210 1 19 . 1 1 17 17 GLY H H 17 7.227 7.227 8.400 -1.173 26060 13211 1 19 . 1 1 18 18 HIS N N 18 111.200 111.200 118.522 -7.322 26060 13212 1 19 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.897 -0.277 26060 13213 1 19 . 1 1 18 18 HIS C C 18 172.400 172.400 172.748 -0.348 26060 13214 1 19 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.750 -0.810 26060 13215 1 19 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.556 1.604 26060 13216 1 19 . 1 1 18 18 HIS H H 18 8.150 8.150 9.187 -1.037 26060 13217 1 19 . 1 1 19 19 ARG N N 19 117.800 117.800 122.439 -4.639 26060 13218 1 19 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.934 0.166 26060 13219 1 19 . 1 1 19 19 ARG C C 19 175.800 175.800 174.306 1.494 26060 13220 1 19 . 1 1 19 19 ARG CA C 19 53.500 53.500 53.960 -0.460 26060 13221 1 19 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.017 -0.367 26060 13222 1 19 . 1 1 19 19 ARG H H 19 9.010 9.010 8.915 0.095 26060 13223 1 19 . 1 1 20 20 ALA N N 20 120.390 120.390 121.529 -1.139 26060 13224 1 19 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.548 -0.018 26060 13225 1 19 . 1 1 20 20 ALA C C 20 175.800 175.800 175.018 0.782 26060 13226 1 19 . 1 1 20 20 ALA CA C 20 52.190 52.190 51.184 1.006 26060 13227 1 19 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.108 0.641 26060 13228 1 19 . 1 1 20 20 ALA H H 20 8.070 8.070 8.383 -0.313 26060 13229 1 19 . 1 1 21 21 GLN N N 21 121.790 121.790 121.742 0.048 26060 13230 1 19 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.879 0.351 26060 13231 1 19 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.726 -0.396 26060 13232 1 19 . 1 1 21 21 GLN CB C 21 32.900 32.900 32.741 0.159 26060 13233 1 19 . 1 1 21 21 GLN H H 21 9.240 9.240 9.045 0.195 26060 13234 1 19 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.569 -0.939 26060 13235 1 19 . 1 1 22 22 VAL C C 22 176.500 176.500 175.497 1.003 26060 13236 1 19 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.218 2.812 26060 13237 1 19 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.708 -2.108 26060 13238 1 19 . 1 1 23 23 ARG N N 23 127.840 127.840 126.352 1.488 26060 13239 1 19 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.655 -0.525 26060 13240 1 19 . 1 1 23 23 ARG CA C 23 56.600 56.600 54.730 1.870 26060 13241 1 19 . 1 1 23 23 ARG CB C 23 32.150 32.150 31.032 1.118 26060 13242 1 19 . 1 1 23 23 ARG H H 23 8.720 8.720 8.199 0.521 26060 13243 1 19 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.200 -0.160 26060 13244 1 19 . 1 1 24 24 LYS C C 24 176.960 176.960 175.997 0.963 26060 13245 1 19 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.868 0.932 26060 13246 1 19 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.411 -0.351 26060 13247 1 19 . 1 1 25 25 LYS N N 25 115.870 115.870 119.114 -3.244 26060 13248 1 19 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.649 0.181 26060 13249 1 19 . 1 1 25 25 LYS CA C 25 52.960 52.960 52.924 0.036 26060 13250 1 19 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.530 1.550 26060 13251 1 19 . 1 1 25 25 LYS H H 25 7.720 7.720 7.613 0.107 26060 13252 1 19 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.614 0.216 26060 13253 1 19 . 1 1 26 26 PRO C C 26 177.400 177.400 176.803 0.597 26060 13254 1 19 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.554 0.096 26060 13255 1 19 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.541 -0.151 26060 13256 1 19 . 1 1 27 27 THR N N 27 111.270 111.270 115.095 -3.825 26060 13257 1 19 . 1 1 27 27 THR HA H 27 4.530 4.530 4.166 0.364 26060 13258 1 19 . 1 1 27 27 THR C C 27 177.300 177.300 176.937 0.363 26060 13259 1 19 . 1 1 27 27 THR CA C 27 61.300 61.300 61.787 -0.487 26060 13260 1 19 . 1 1 27 27 THR CB C 27 71.460 71.460 69.973 1.487 26060 13261 1 19 . 1 1 27 27 THR H H 27 8.380 8.380 8.360 0.020 26060 13262 1 19 . 1 1 28 28 VAL N N 28 121.170 121.170 122.608 -1.438 26060 13263 1 19 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.795 0.088 26060 13264 1 19 . 1 1 28 28 VAL C C 28 177.030 177.030 176.161 0.869 26060 13265 1 19 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.169 0.031 26060 13266 1 19 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.623 -0.223 26060 13267 1 19 . 1 1 28 28 VAL H H 28 8.910 8.910 8.550 0.360 26060 13268 1 19 . 1 1 29 29 GLU N N 29 116.800 116.800 118.773 -1.973 26060 13269 1 19 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.086 -0.166 26060 13270 1 19 . 1 1 29 29 GLU C C 29 176.200 176.200 175.917 0.283 26060 13271 1 19 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.390 1.860 26060 13272 1 19 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.214 -1.044 26060 13273 1 19 . 1 1 29 29 GLU H H 29 7.990 7.990 8.069 -0.079 26060 13274 1 19 . 1 1 30 30 GLY N N 30 105.500 105.500 107.177 -1.677 26060 13275 1 19 . 1 1 30 30 GLY C C 30 174.900 174.900 173.739 1.161 26060 13276 1 19 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.163 -0.702 26060 13277 1 19 . 1 1 30 30 GLY H H 30 7.950 7.950 7.585 0.365 26060 13278 1 19 . 1 1 31 31 PHE N N 31 119.300 119.300 118.101 1.199 26060 13279 1 19 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.990 -0.230 26060 13280 1 19 . 1 1 31 31 PHE C C 31 176.400 176.400 175.854 0.546 26060 13281 1 19 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.648 1.252 26060 13282 1 19 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.986 -4.486 26060 13283 1 19 . 1 1 31 31 PHE H H 31 7.520 7.520 7.245 0.275 26060 13284 1 19 . 1 1 32 32 THR N N 32 112.300 112.300 115.187 -2.887 26060 13285 1 19 . 1 1 32 32 THR HA H 32 4.330 4.330 4.499 -0.169 26060 13286 1 19 . 1 1 32 32 THR C C 32 175.200 175.200 174.369 0.831 26060 13287 1 19 . 1 1 32 32 THR CA C 32 62.780 62.780 62.673 0.107 26060 13288 1 19 . 1 1 32 32 THR CB C 32 70.350 70.350 70.163 0.187 26060 13289 1 19 . 1 1 32 32 THR H H 32 7.770 7.770 9.222 -1.452 26060 13290 1 19 . 1 1 33 33 HIS N N 33 121.900 121.900 122.199 -0.299 26060 13291 1 19 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.008 0.492 26060 13292 1 19 . 1 1 33 33 HIS C C 33 173.880 173.880 173.684 0.196 26060 13293 1 19 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.694 0.086 26060 13294 1 19 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.558 4.082 26060 13295 1 19 . 1 1 33 33 HIS H H 33 9.110 9.110 8.816 0.294 26060 13296 1 19 . 1 1 34 34 ASP N N 34 120.300 120.300 124.832 -4.532 26060 13297 1 19 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.421 -0.021 26060 13298 1 19 . 1 1 34 34 ASP C C 34 175.100 175.100 175.308 -0.208 26060 13299 1 19 . 1 1 34 34 ASP CA C 34 53.310 53.310 54.154 -0.843 26060 13300 1 19 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.456 -0.356 26060 13301 1 19 . 1 1 34 34 ASP H H 34 8.810 8.810 8.757 0.053 26060 13302 1 19 . 1 1 35 35 TRP N N 35 119.800 119.800 119.643 0.157 26060 13303 1 19 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.464 0.266 26060 13304 1 19 . 1 1 35 35 TRP C C 35 174.900 174.900 173.287 1.613 26060 13305 1 19 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.167 -0.267 26060 13306 1 19 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.174 1.896 26060 13307 1 19 . 1 1 35 35 TRP H H 35 9.250 9.250 8.922 0.328 26060 13308 1 19 . 1 1 36 36 MET N N 36 120.980 120.980 121.674 -0.694 26060 13309 1 19 . 1 1 36 36 MET HA H 36 5.750 5.750 5.915 -0.165 26060 13310 1 19 . 1 1 36 36 MET C C 36 173.700 173.700 174.292 -0.592 26060 13311 1 19 . 1 1 36 36 MET CA C 36 54.830 54.830 54.385 0.445 26060 13312 1 19 . 1 1 36 36 MET CB C 36 35.220 35.220 36.688 -1.468 26060 13313 1 19 . 1 1 36 36 MET H H 36 9.080 9.080 8.754 0.326 26060 13314 1 19 . 1 1 37 37 VAL N N 37 126.220 126.220 120.887 5.333 26060 13315 1 19 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.207 0.103 26060 13316 1 19 . 1 1 37 37 VAL C C 37 172.300 172.300 174.361 -2.061 26060 13317 1 19 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.662 -1.122 26060 13318 1 19 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.789 1.281 26060 13319 1 19 . 1 1 37 37 VAL H H 37 9.080 9.080 8.852 0.228 26060 13320 1 19 . 1 1 38 38 PHE N N 38 120.640 120.640 121.616 -0.976 26060 13321 1 19 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.308 0.662 26060 13322 1 19 . 1 1 38 38 PHE C C 38 172.960 172.960 175.155 -2.195 26060 13323 1 19 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.797 -0.667 26060 13324 1 19 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.528 -0.528 26060 13325 1 19 . 1 1 38 38 PHE H H 38 8.320 8.320 8.890 -0.570 26060 13326 1 19 . 1 1 39 39 VAL N N 39 116.500 116.500 120.804 -4.304 26060 13327 1 19 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.643 -0.633 26060 13328 1 19 . 1 1 39 39 VAL C C 39 174.700 174.700 174.363 0.337 26060 13329 1 19 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.068 1.572 26060 13330 1 19 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.807 1.593 26060 13331 1 19 . 1 1 39 39 VAL H H 39 8.580 8.580 9.313 -0.733 26060 13332 1 19 . 1 1 40 40 ARG N N 40 124.100 124.100 124.260 -0.160 26060 13333 1 19 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.973 0.107 26060 13334 1 19 . 1 1 40 40 ARG C C 40 173.800 173.800 174.275 -0.475 26060 13335 1 19 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.862 -0.932 26060 13336 1 19 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.696 0.884 26060 13337 1 19 . 1 1 40 40 ARG H H 40 9.880 9.880 8.590 1.290 26060 13338 1 19 . 1 1 41 41 GLY N N 41 107.640 107.640 106.662 0.978 26060 13339 1 19 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.593 1.377 26060 13340 1 19 . 1 1 41 41 GLY H H 41 8.910 8.910 8.654 0.256 26060 13341 1 19 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.391 0.099 26060 13342 1 19 . 1 1 42 42 PRO C C 42 177.300 177.300 176.792 0.508 26060 13343 1 19 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.521 -0.081 26060 13344 1 19 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.510 -0.400 26060 13345 1 19 . 1 1 43 43 GLU N N 43 121.050 121.050 121.266 -0.216 26060 13346 1 19 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.105 -0.315 26060 13347 1 19 . 1 1 43 43 GLU C C 43 176.110 176.110 176.899 -0.789 26060 13348 1 19 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.461 -0.611 26060 13349 1 19 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.621 -0.771 26060 13350 1 19 . 1 1 43 43 GLU H H 43 9.060 9.060 8.755 0.305 26060 13351 1 19 . 1 1 44 44 HIS N N 44 114.100 114.100 117.712 -3.612 26060 13352 1 19 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.290 0.061 26060 13353 1 19 . 1 1 44 44 HIS C C 44 175.170 175.170 174.211 0.959 26060 13354 1 19 . 1 1 44 44 HIS CA C 44 57.650 57.650 56.682 0.968 26060 13355 1 19 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.674 -0.303 26060 13356 1 19 . 1 1 44 44 HIS H H 44 8.420 8.420 8.629 -0.209 26060 13357 1 19 . 1 1 45 45 SER N N 45 115.540 115.540 117.037 -1.497 26060 13358 1 19 . 1 1 45 45 SER HA H 45 4.560 4.560 4.450 0.110 26060 13359 1 19 . 1 1 45 45 SER C C 45 173.700 173.700 174.186 -0.486 26060 13360 1 19 . 1 1 45 45 SER CA C 45 58.710 58.710 56.692 2.018 26060 13361 1 19 . 1 1 45 45 SER CB C 45 65.040 65.040 63.543 1.497 26060 13362 1 19 . 1 1 45 45 SER H H 45 7.870 7.870 7.631 0.239 26060 13363 1 19 . 1 1 46 46 ASN N N 46 123.900 123.900 124.078 -0.178 26060 13364 1 19 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.688 0.432 26060 13365 1 19 . 1 1 46 46 ASN C C 46 176.300 176.300 175.073 1.227 26060 13366 1 19 . 1 1 46 46 ASN CA C 46 52.690 52.690 53.358 -0.668 26060 13367 1 19 . 1 1 46 46 ASN CB C 46 38.730 38.730 39.492 -0.762 26060 13368 1 19 . 1 1 46 46 ASN H H 46 9.480 9.480 8.386 1.094 26060 13369 1 19 . 1 1 47 47 ILE N N 47 115.240 115.240 117.090 -1.850 26060 13370 1 19 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.246 0.694 26060 13371 1 19 . 1 1 47 47 ILE C C 47 176.000 176.000 177.219 -1.219 26060 13372 1 19 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.026 1.174 26060 13373 1 19 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.502 -1.802 26060 13374 1 19 . 1 1 47 47 ILE H H 47 8.170 8.170 8.304 -0.134 26060 13375 1 19 . 1 1 48 48 GLN N N 48 123.200 123.200 120.685 2.515 26060 13376 1 19 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.176 0.104 26060 13377 1 19 . 1 1 48 48 GLN C C 48 175.670 175.670 177.437 -1.767 26060 13378 1 19 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.319 -0.419 26060 13379 1 19 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.287 -0.297 26060 13380 1 19 . 1 1 48 48 GLN H H 48 8.850 8.850 8.695 0.155 26060 13381 1 19 . 1 1 49 49 HIS N N 49 115.400 115.400 115.399 0.001 26060 13382 1 19 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.401 0.169 26060 13383 1 19 . 1 1 49 49 HIS C C 49 176.380 176.380 176.180 0.200 26060 13384 1 19 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.227 0.523 26060 13385 1 19 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.390 1.230 26060 13386 1 19 . 1 1 49 49 HIS H H 49 7.400 7.400 8.078 -0.678 26060 13387 1 19 . 1 1 50 50 PHE N N 50 109.800 109.800 111.628 -1.828 26060 13388 1 19 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.837 0.393 26060 13389 1 19 . 1 1 50 50 PHE C C 50 173.800 173.800 174.237 -0.437 26060 13390 1 19 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.945 -0.285 26060 13391 1 19 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.747 1.253 26060 13392 1 19 . 1 1 50 50 PHE H H 50 7.570 7.570 7.598 -0.028 26060 13393 1 19 . 1 1 51 51 VAL N N 51 127.810 127.810 120.146 7.664 26060 13394 1 19 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.841 -0.471 26060 13395 1 19 . 1 1 51 51 VAL C C 51 174.500 174.500 174.412 0.088 26060 13396 1 19 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.469 1.531 26060 13397 1 19 . 1 1 51 51 VAL CB C 51 33.280 33.280 35.218 -1.938 26060 13398 1 19 . 1 1 51 51 VAL H H 51 7.810 7.810 7.927 -0.117 26060 13399 1 19 . 1 1 52 52 GLU N N 52 130.700 130.700 126.914 3.786 26060 13400 1 19 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.600 -0.620 26060 13401 1 19 . 1 1 52 52 GLU C C 52 175.400 175.400 175.611 -0.211 26060 13402 1 19 . 1 1 52 52 GLU CA C 52 58.100 58.100 56.829 1.271 26060 13403 1 19 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.623 -1.043 26060 13404 1 19 . 1 1 52 52 GLU H H 52 9.380 9.380 9.022 0.358 26060 13405 1 19 . 1 1 53 53 LYS N N 53 109.200 109.200 114.911 -5.711 26060 13406 1 19 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.964 -0.164 26060 13407 1 19 . 1 1 53 53 LYS C C 53 172.300 172.300 174.699 -2.399 26060 13408 1 19 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.552 0.288 26060 13409 1 19 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.094 -1.844 26060 13410 1 19 . 1 1 53 53 LYS H H 53 7.190 7.190 7.433 -0.243 26060 13411 1 19 . 1 1 54 54 VAL N N 54 120.380 120.380 117.767 2.613 26060 13412 1 19 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.686 0.084 26060 13413 1 19 . 1 1 54 54 VAL C C 54 173.600 173.600 173.834 -0.234 26060 13414 1 19 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.531 -0.491 26060 13415 1 19 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.615 -1.915 26060 13416 1 19 . 1 1 54 54 VAL H H 54 8.450 8.450 8.312 0.138 26060 13417 1 19 . 1 1 55 55 VAL N N 55 126.920 126.920 122.811 4.109 26060 13418 1 19 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.177 -0.477 26060 13419 1 19 . 1 1 55 55 VAL C C 55 173.800 173.800 173.713 0.087 26060 13420 1 19 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.689 0.181 26060 13421 1 19 . 1 1 55 55 VAL CB C 55 34.100 34.100 37.033 -2.933 26060 13422 1 19 . 1 1 55 55 VAL H H 55 9.260 9.260 8.799 0.461 26060 13423 1 19 . 1 1 56 56 PHE N N 56 126.130 126.130 123.606 2.524 26060 13424 1 19 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.013 -0.323 26060 13425 1 19 . 1 1 56 56 PHE C C 56 174.000 174.000 174.442 -0.442 26060 13426 1 19 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.725 -0.145 26060 13427 1 19 . 1 1 56 56 PHE CB C 56 40.890 40.890 41.998 -1.108 26060 13428 1 19 . 1 1 56 56 PHE H H 56 9.290 9.290 9.214 0.076 26060 13429 1 19 . 1 1 57 57 HIS N N 57 124.180 124.180 124.987 -0.807 26060 13430 1 19 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.873 -0.073 26060 13431 1 19 . 1 1 57 57 HIS C C 57 174.700 174.700 175.122 -0.422 26060 13432 1 19 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.198 0.122 26060 13433 1 19 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.220 1.880 26060 13434 1 19 . 1 1 57 57 HIS H H 57 8.690 8.690 8.542 0.148 26060 13435 1 19 . 1 1 58 58 LEU N N 58 122.050 122.050 121.837 0.213 26060 13436 1 19 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.380 -0.140 26060 13437 1 19 . 1 1 58 58 LEU C C 58 174.400 174.400 176.446 -2.046 26060 13438 1 19 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.880 0.530 26060 13439 1 19 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.707 -1.547 26060 13440 1 19 . 1 1 58 58 LEU H H 58 9.050 9.050 7.432 1.618 26060 13441 1 19 . 1 1 59 59 HIS N N 59 118.510 118.510 118.472 0.038 26060 13442 1 19 . 1 1 59 59 HIS C C 59 175.300 175.300 176.532 -1.232 26060 13443 1 19 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.110 3.000 26060 13444 1 19 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.076 0.854 26060 13445 1 19 . 1 1 59 59 HIS H H 59 5.160 5.160 7.851 -2.691 26060 13446 1 19 . 1 1 60 60 GLU N N 60 122.190 122.190 126.655 -4.465 26060 13447 1 19 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.010 -0.050 26060 13448 1 19 . 1 1 60 60 GLU C C 60 175.130 175.130 177.135 -2.005 26060 13449 1 19 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.129 -0.119 26060 13450 1 19 . 1 1 60 60 GLU CB C 60 28.820 28.820 29.135 -0.315 26060 13451 1 19 . 1 1 60 60 GLU H H 60 7.960 7.960 8.409 -0.449 26060 13452 1 19 . 1 1 61 61 SER N N 61 116.940 116.940 113.050 3.890 26060 13453 1 19 . 1 1 61 61 SER HA H 61 4.200 4.200 4.344 -0.144 26060 13454 1 19 . 1 1 61 61 SER CA C 61 60.010 60.010 59.767 0.243 26060 13455 1 19 . 1 1 61 61 SER CB C 61 63.140 63.140 63.572 -0.432 26060 13456 1 19 . 1 1 61 61 SER H H 61 8.540 8.540 8.186 0.354 26060 13457 1 19 . 1 1 62 62 PHE N N 62 123.700 123.700 121.277 2.423 26060 13458 1 19 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.671 -0.121 26060 13459 1 19 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.130 2.810 26060 13460 1 19 . 1 1 62 62 PHE CB C 62 38.400 38.400 39.238 -0.838 26060 13461 1 19 . 1 1 62 62 PHE H H 62 8.640 8.640 8.089 0.551 26060 13462 1 19 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.463 -0.053 26060 13463 1 19 . 1 1 63 63 PRO C C 63 176.400 176.400 176.050 0.350 26060 13464 1 19 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.305 -0.705 26060 13465 1 19 . 1 1 63 63 PRO CB C 63 31.860 31.860 31.964 -0.104 26060 13466 1 19 . 1 1 64 64 ARG N N 64 116.840 116.840 121.160 -4.320 26060 13467 1 19 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.079 0.021 26060 13468 1 19 . 1 1 64 64 ARG CA C 64 55.610 55.610 55.886 -0.276 26060 13469 1 19 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.474 0.356 26060 13470 1 19 . 1 1 64 64 ARG H H 64 8.890 8.890 8.555 0.335 26060 13471 1 19 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.342 -0.352 26060 13472 1 19 . 1 1 65 65 PRO C C 65 175.800 175.800 177.454 -1.654 26060 13473 1 19 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.804 2.006 26060 13474 1 19 . 1 1 65 65 PRO CB C 65 31.880 31.880 32.018 -0.138 26060 13475 1 19 . 1 1 66 66 LYS N N 66 119.035 119.035 120.316 -1.281 26060 13476 1 19 . 1 1 66 66 LYS HA H 66 4.610 4.610 4.812 -0.202 26060 13477 1 19 . 1 1 66 66 LYS C C 66 175.400 175.400 175.882 -0.482 26060 13478 1 19 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.811 -0.358 26060 13479 1 19 . 1 1 66 66 LYS CB C 66 31.730 31.730 31.719 0.011 26060 13480 1 19 . 1 1 66 66 LYS H H 66 7.630 7.630 7.895 -0.265 26060 13481 1 19 . 1 1 67 67 ARG N N 67 127.394 127.394 127.371 0.023 26060 13482 1 19 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.583 0.157 26060 13483 1 19 . 1 1 67 67 ARG C C 67 174.500 174.500 174.909 -0.409 26060 13484 1 19 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.557 0.243 26060 13485 1 19 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.209 -1.495 26060 13486 1 19 . 1 1 67 67 ARG H H 67 8.855 8.855 8.657 0.198 26060 13487 1 19 . 1 1 68 68 VAL N N 68 124.388 124.388 119.203 5.185 26060 13488 1 19 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.081 -0.501 26060 13489 1 19 . 1 1 68 68 VAL C C 68 176.850 176.850 175.320 1.530 26060 13490 1 19 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.757 2.316 26060 13491 1 19 . 1 1 68 68 VAL CB C 68 33.604 33.604 34.083 -0.479 26060 13492 1 19 . 1 1 68 68 VAL H H 68 8.681 8.681 8.372 0.309 26060 13493 1 19 . 1 1 69 69 CYS N N 69 127.080 127.080 125.551 1.529 26060 13494 1 19 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.774 0.296 26060 13495 1 19 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.746 0.600 26060 13496 1 19 . 1 1 69 69 CYS CB C 69 30.770 30.770 30.329 0.441 26060 13497 1 19 . 1 1 69 69 CYS H H 69 9.455 9.455 9.183 0.272 26060 13498 1 19 . 1 1 70 70 LYS N N 70 125.480 125.480 122.812 2.668 26060 13499 1 19 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.513 -0.023 26060 13500 1 19 . 1 1 70 70 LYS C C 70 174.300 174.300 175.697 -1.397 26060 13501 1 19 . 1 1 70 70 LYS CA C 70 57.760 57.760 55.966 1.794 26060 13502 1 19 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.089 0.081 26060 13503 1 19 . 1 1 70 70 LYS H H 70 9.050 9.050 8.676 0.374 26060 13504 1 19 . 1 1 71 71 ASP N N 71 116.940 116.940 119.717 -2.777 26060 13505 1 19 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.710 0.390 26060 13506 1 19 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.852 -0.772 26060 13507 1 19 . 1 1 71 71 ASP CB C 71 43.380 43.380 40.740 2.640 26060 13508 1 19 . 1 1 71 71 ASP H H 71 7.620 7.620 7.570 0.050 26060 13509 1 19 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.126 -0.866 26060 13510 1 19 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.942 -2.292 26060 13511 1 19 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.139 -1.099 26060 13512 1 19 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.159 -0.059 26060 13513 1 19 . 1 1 73 73 PRO C C 73 174.700 174.700 175.898 -1.198 26060 13514 1 19 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.344 -2.654 26060 13515 1 19 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.288 2.752 26060 13516 1 19 . 1 1 74 74 TYR N N 74 125.400 125.400 124.723 0.677 26060 13517 1 19 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.501 0.349 26060 13518 1 19 . 1 1 74 74 TYR C C 74 172.900 172.900 175.371 -2.471 26060 13519 1 19 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.715 -2.045 26060 13520 1 19 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.264 -3.864 26060 13521 1 19 . 1 1 74 74 TYR H H 74 8.960 8.960 8.317 0.643 26060 13522 1 19 . 1 1 75 75 LYS N N 75 121.400 121.400 119.934 1.466 26060 13523 1 19 . 1 1 75 75 LYS HA H 75 5.590 5.590 4.961 0.629 26060 13524 1 19 . 1 1 75 75 LYS C C 75 173.800 173.800 174.508 -0.708 26060 13525 1 19 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.860 -0.210 26060 13526 1 19 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.529 -0.639 26060 13527 1 19 . 1 1 75 75 LYS H H 75 7.670 7.670 7.975 -0.305 26060 13528 1 19 . 1 1 76 76 VAL N N 76 119.800 119.800 121.798 -1.998 26060 13529 1 19 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.127 -0.237 26060 13530 1 19 . 1 1 76 76 VAL C C 76 173.900 173.900 174.571 -0.671 26060 13531 1 19 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.290 1.440 26060 13532 1 19 . 1 1 76 76 VAL CB C 76 35.540 35.540 34.600 0.940 26060 13533 1 19 . 1 1 76 76 VAL H H 76 8.180 8.180 7.786 0.394 26060 13534 1 19 . 1 1 77 77 GLU N N 77 126.190 126.190 128.016 -1.826 26060 13535 1 19 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.951 -0.001 26060 13536 1 19 . 1 1 77 77 GLU C C 77 174.700 174.700 175.217 -0.517 26060 13537 1 19 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.318 -0.378 26060 13538 1 19 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.571 -0.021 26060 13539 1 19 . 1 1 77 77 GLU H H 77 8.270 8.270 8.650 -0.380 26060 13540 1 19 . 1 1 78 78 GLU N N 78 126.180 126.180 122.948 3.232 26060 13541 1 19 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.586 -0.136 26060 13542 1 19 . 1 1 78 78 GLU C C 78 175.400 175.400 173.957 1.443 26060 13543 1 19 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.064 -0.022 26060 13544 1 19 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.868 3.232 26060 13545 1 19 . 1 1 78 78 GLU H H 78 7.870 7.870 8.442 -0.572 26060 13546 1 19 . 1 1 79 79 SER N N 79 112.109 112.109 113.189 -1.080 26060 13547 1 19 . 1 1 79 79 SER HA H 79 5.560 5.560 5.320 0.240 26060 13548 1 19 . 1 1 79 79 SER C C 79 172.490 172.490 172.970 -0.480 26060 13549 1 19 . 1 1 79 79 SER CA C 79 57.754 57.754 56.720 1.034 26060 13550 1 19 . 1 1 79 79 SER CB C 79 65.861 65.861 65.254 0.607 26060 13551 1 19 . 1 1 79 79 SER H H 79 7.714 7.714 8.306 -0.592 26060 13552 1 19 . 1 1 80 80 GLY N N 80 106.048 106.048 110.554 -4.506 26060 13553 1 19 . 1 1 80 80 GLY C C 80 172.630 172.630 171.720 0.910 26060 13554 1 19 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.716 0.854 26060 13555 1 19 . 1 1 80 80 GLY H H 80 8.828 8.828 8.860 -0.032 26060 13556 1 19 . 1 1 81 81 TYR N N 81 115.280 115.280 114.810 0.470 26060 13557 1 19 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.396 0.284 26060 13558 1 19 . 1 1 81 81 TYR C C 81 174.100 174.100 174.301 -0.201 26060 13559 1 19 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.666 -1.166 26060 13560 1 19 . 1 1 81 81 TYR CB C 81 41.340 41.340 38.586 2.754 26060 13561 1 19 . 1 1 81 81 TYR H H 81 8.770 8.770 8.051 0.719 26060 13562 1 19 . 1 1 82 82 ALA N N 82 122.350 122.350 122.567 -0.217 26060 13563 1 19 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.433 -0.033 26060 13564 1 19 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.893 0.147 26060 13565 1 19 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.023 1.377 26060 13566 1 19 . 1 1 82 82 ALA H H 82 7.160 7.160 7.512 -0.352 26060 13567 1 19 . 1 1 83 83 GLY N N 83 107.100 107.100 106.849 0.251 26060 13568 1 19 . 1 1 83 83 GLY C C 83 172.500 172.500 173.581 -1.081 26060 13569 1 19 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.068 0.542 26060 13570 1 19 . 1 1 83 83 GLY H H 83 8.220 8.220 8.260 -0.040 26060 13571 1 19 . 1 1 84 84 PHE N N 84 111.660 111.660 115.227 -3.567 26060 13572 1 19 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.554 0.136 26060 13573 1 19 . 1 1 84 84 PHE C C 84 172.460 172.460 173.083 -0.623 26060 13574 1 19 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.305 0.195 26060 13575 1 19 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.588 -1.008 26060 13576 1 19 . 1 1 84 84 PHE H H 84 7.700 7.700 7.960 -0.260 26060 13577 1 19 . 1 1 85 85 ILE N N 85 117.810 117.810 121.177 -3.367 26060 13578 1 19 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.064 0.246 26060 13579 1 19 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.139 -1.799 26060 13580 1 19 . 1 1 85 85 ILE CB C 85 35.260 35.260 36.977 -1.717 26060 13581 1 19 . 1 1 85 85 ILE H H 85 8.340 8.340 8.379 -0.039 26060 13582 1 19 . 1 1 86 86 LEU N N 86 108.130 108.130 129.672 -21.542 26060 13583 1 19 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.021 -0.041 26060 13584 1 19 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.072 2.127 26060 13585 1 19 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.679 -0.379 26060 13586 1 19 . 1 1 86 86 LEU H H 86 9.900 9.900 8.830 1.070 26060 13587 1 19 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.488 0.612 26060 13588 1 19 . 1 1 87 87 PRO C C 87 175.340 175.340 175.864 -0.524 26060 13589 1 19 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.998 0.112 26060 13590 1 19 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.474 1.086 26060 13591 1 19 . 1 1 88 88 ILE N N 88 126.000 126.000 125.779 0.221 26060 13592 1 19 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.213 0.577 26060 13593 1 19 . 1 1 88 88 ILE C C 88 176.100 176.100 175.073 1.027 26060 13594 1 19 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.511 0.049 26060 13595 1 19 . 1 1 88 88 ILE CB C 88 42.000 42.000 39.867 2.133 26060 13596 1 19 . 1 1 88 88 ILE H H 88 9.380 9.380 8.394 0.986 26060 13597 1 19 . 1 1 89 89 GLU N N 89 123.900 123.900 125.034 -1.134 26060 13598 1 19 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.266 -0.067 26060 13599 1 19 . 1 1 89 89 GLU C C 89 173.800 173.800 175.391 -1.591 26060 13600 1 19 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.500 -0.530 26060 13601 1 19 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.422 0.958 26060 13602 1 19 . 1 1 89 89 GLU H H 89 9.320 9.320 8.478 0.842 26060 13603 1 19 . 1 1 90 90 VAL N N 90 123.980 123.980 123.146 0.834 26060 13604 1 19 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.128 0.032 26060 13605 1 19 . 1 1 90 90 VAL C C 90 174.800 174.800 174.532 0.268 26060 13606 1 19 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.191 0.799 26060 13607 1 19 . 1 1 90 90 VAL CB C 90 32.490 32.490 33.155 -0.665 26060 13608 1 19 . 1 1 90 90 VAL H H 90 8.630 8.630 8.300 0.330 26060 13609 1 19 . 1 1 91 91 TYR N N 91 124.230 124.230 126.495 -2.265 26060 13610 1 19 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.500 0.160 26060 13611 1 19 . 1 1 91 91 TYR C C 91 176.800 176.800 175.431 1.369 26060 13612 1 19 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.648 -0.948 26060 13613 1 19 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.635 1.605 26060 13614 1 19 . 1 1 91 91 TYR H H 91 8.640 8.640 9.011 -0.371 26060 13615 1 19 . 1 1 92 92 PHE N N 92 121.200 121.200 122.773 -1.573 26060 13616 1 19 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.178 0.482 26060 13617 1 19 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.070 1.440 26060 13618 1 19 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.616 1.084 26060 13619 1 19 . 1 1 92 92 PHE H H 92 8.750 8.750 9.005 -0.255 26060 13620 1 19 . 1 1 93 93 LYS N N 93 123.450 123.450 122.232 1.218 26060 13621 1 19 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.519 0.081 26060 13622 1 19 . 1 1 93 93 LYS C C 93 174.200 174.200 175.000 -0.800 26060 13623 1 19 . 1 1 93 93 LYS CA C 93 55.180 55.180 56.251 -1.071 26060 13624 1 19 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.453 -0.773 26060 13625 1 19 . 1 1 93 93 LYS H H 93 8.560 8.560 8.724 -0.164 26060 13626 1 19 . 1 1 94 94 ASN N N 94 118.800 118.800 120.691 -1.891 26060 13627 1 19 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.802 -0.362 26060 13628 1 19 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.267 -1.058 26060 13629 1 19 . 1 1 94 94 ASN CB C 94 39.800 39.800 41.958 -2.158 26060 13630 1 19 . 1 1 94 94 ASN H H 94 7.820 7.820 8.010 -0.190 26060 13631 1 19 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.301 0.029 26060 13632 1 19 . 1 1 95 95 LYS C C 95 175.800 175.800 175.664 0.136 26060 13633 1 19 . 1 1 95 95 LYS CA C 95 56.210 56.210 57.269 -1.059 26060 13634 1 19 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.655 -0.645 26060 13635 1 19 . 1 1 96 96 GLU N N 96 118.330 118.330 119.568 -1.238 26060 13636 1 19 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.307 0.203 26060 13637 1 19 . 1 1 96 96 GLU C C 96 173.200 173.200 176.057 -2.857 26060 13638 1 19 . 1 1 96 96 GLU CA C 96 54.100 54.100 54.931 -0.831 26060 13639 1 19 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.615 1.855 26060 13640 1 19 . 1 1 96 96 GLU H H 96 7.120 7.120 7.878 -0.758 26060 13641 1 19 . 1 1 97 97 GLU N N 97 115.630 115.630 119.425 -3.795 26060 13642 1 19 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.162 0.268 26060 13643 1 19 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.254 -1.393 26060 13644 1 19 . 1 1 97 97 GLU CB C 97 29.270 29.270 29.065 0.205 26060 13645 1 19 . 1 1 97 97 GLU H H 97 8.060 8.060 8.440 -0.380 26060 13646 1 19 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.198 0.802 26060 13647 1 19 . 1 1 98 98 PRO C C 98 175.900 175.900 176.006 -0.106 26060 13648 1 19 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.317 -2.157 26060 13649 1 19 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.078 1.922 26060 13650 1 19 . 1 1 99 99 ARG N N 99 122.800 122.800 119.582 3.218 26060 13651 1 19 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.383 0.247 26060 13652 1 19 . 1 1 99 99 ARG C C 99 175.800 175.800 175.287 0.513 26060 13653 1 19 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.167 0.323 26060 13654 1 19 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.939 -0.529 26060 13655 1 19 . 1 1 99 99 ARG H H 99 8.602 8.602 8.527 0.075 26060 13656 1 19 . 1 1 100 100 LYS N N 100 113.220 113.220 116.755 -3.535 26060 13657 1 19 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.623 0.317 26060 13658 1 19 . 1 1 100 100 LYS C C 100 174.100 174.100 174.300 -0.200 26060 13659 1 19 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.372 -0.462 26060 13660 1 19 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.628 -0.908 26060 13661 1 19 . 1 1 100 100 LYS H H 100 7.650 7.650 7.347 0.303 26060 13662 1 19 . 1 1 101 101 VAL N N 101 116.230 116.230 120.525 -4.295 26060 13663 1 19 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.169 0.101 26060 13664 1 19 . 1 1 101 101 VAL C C 101 171.600 171.600 173.640 -2.040 26060 13665 1 19 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.020 1.240 26060 13666 1 19 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.432 -0.252 26060 13667 1 19 . 1 1 101 101 VAL H H 101 8.120 8.120 8.090 0.030 26060 13668 1 19 . 1 1 102 102 ARG N N 102 124.980 124.980 126.692 -1.712 26060 13669 1 19 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.764 0.396 26060 13670 1 19 . 1 1 102 102 ARG C C 102 174.340 174.340 175.228 -0.888 26060 13671 1 19 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.812 -1.062 26060 13672 1 19 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.697 1.653 26060 13673 1 19 . 1 1 102 102 ARG H H 102 7.930 7.930 8.237 -0.307 26060 13674 1 19 . 1 1 103 103 PHE N N 103 124.590 124.590 126.664 -2.074 26060 13675 1 19 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.786 0.006 26060 13676 1 19 . 1 1 103 103 PHE C C 103 174.280 174.280 175.112 -0.832 26060 13677 1 19 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.374 1.606 26060 13678 1 19 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.789 2.461 26060 13679 1 19 . 1 1 103 103 PHE H H 103 9.390 9.390 9.199 0.191 26060 13680 1 19 . 1 1 104 104 ASP N N 104 124.700 124.700 124.567 0.133 26060 13681 1 19 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.569 0.230 26060 13682 1 19 . 1 1 104 104 ASP C C 104 174.500 174.500 175.297 -0.797 26060 13683 1 19 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.071 0.319 26060 13684 1 19 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.294 0.936 26060 13685 1 19 . 1 1 104 104 ASP H H 104 9.010 9.010 8.929 0.081 26060 13686 1 19 . 1 1 105 105 TYR N N 105 129.840 129.840 123.792 6.048 26060 13687 1 19 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.492 -0.392 26060 13688 1 19 . 1 1 105 105 TYR C C 105 173.100 173.100 173.664 -0.564 26060 13689 1 19 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.863 0.817 26060 13690 1 19 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.784 1.066 26060 13691 1 19 . 1 1 105 105 TYR H H 105 8.140 8.140 8.285 -0.145 26060 13692 1 19 . 1 1 106 106 ASP N N 106 126.800 126.800 127.664 -0.864 26060 13693 1 19 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.375 -0.155 26060 13694 1 19 . 1 1 106 106 ASP C C 106 172.900 172.900 174.637 -1.737 26060 13695 1 19 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.692 -0.182 26060 13696 1 19 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.160 -1.661 26060 13697 1 19 . 1 1 106 106 ASP H H 106 7.730 7.730 8.327 -0.597 26060 13698 1 19 . 1 1 107 107 LEU N N 107 132.150 132.150 128.120 4.030 26060 13699 1 19 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.472 -0.632 26060 13700 1 19 . 1 1 107 107 LEU C C 107 172.100 172.100 174.841 -2.741 26060 13701 1 19 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.723 -0.023 26060 13702 1 19 . 1 1 107 107 LEU CB C 107 39.240 39.240 41.221 -1.981 26060 13703 1 19 . 1 1 107 107 LEU H H 107 7.770 7.770 7.704 0.066 26060 13704 1 19 . 1 1 108 108 PHE N N 108 118.960 118.960 121.502 -2.542 26060 13705 1 19 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.888 -0.198 26060 13706 1 19 . 1 1 108 108 PHE C C 108 174.300 174.300 173.868 0.432 26060 13707 1 19 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.216 -0.526 26060 13708 1 19 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.233 0.057 26060 13709 1 19 . 1 1 108 108 PHE H H 108 6.060 6.060 7.152 -1.092 26060 13710 1 19 . 1 1 109 109 LEU N N 109 118.900 118.900 124.300 -5.400 26060 13711 1 19 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.720 -0.320 26060 13712 1 19 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.401 -1.241 26060 13713 1 19 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.296 -1.216 26060 13714 1 19 . 1 1 109 109 LEU H H 109 8.388 8.388 8.402 -0.014 26060 13715 1 19 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.507 -0.067 26060 13716 1 19 . 1 1 111 111 LEU C C 111 177.300 177.300 176.917 0.383 26060 13717 1 19 . 1 1 111 111 LEU CA C 111 54.220 54.220 54.602 -0.382 26060 13718 1 19 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.870 1.000 26060 13719 1 19 . 1 1 112 112 GLU N N 112 120.660 120.660 124.012 -3.352 26060 13720 1 19 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.052 0.118 26060 13721 1 19 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.604 -0.144 26060 13722 1 19 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.971 -0.281 26060 13723 1 19 . 1 1 112 112 GLU H H 112 8.780 8.780 8.822 -0.042 26060 13724 1 19 . 1 1 113 113 GLY C C 113 173.900 173.900 174.014 -0.114 26060 13725 1 19 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.899 0.051 26060 13726 1 19 . 1 1 114 114 HIS N N 114 120.890 120.890 121.610 -0.720 26060 13727 1 19 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.089 -0.183 26060 13728 1 19 . 1 1 114 114 HIS CA C 114 54.770 54.770 54.174 0.596 26060 13729 1 19 . 1 1 114 114 HIS CB C 114 30.590 30.590 32.166 -1.575 26060 13730 1 19 . 1 1 114 114 HIS H H 114 7.934 7.934 7.934 -0.000 26060 13731 1 19 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.958 -0.158 26060 13732 1 19 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.076 1.014 26060 13733 1 19 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.747 -1.067 26060 13734 1 19 . 1 1 116 116 PRO C C 116 176.600 176.600 175.485 1.115 26060 13735 1 19 . 1 1 116 116 PRO CB C 116 32.300 32.300 31.993 0.307 26060 13736 1 19 . 1 1 117 117 VAL N N 117 127.480 127.480 124.815 2.665 26060 13737 1 19 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.255 -0.465 26060 13738 1 19 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.531 1.169 26060 13739 1 19 . 1 1 117 117 VAL CB C 117 33.200 33.200 32.959 0.241 26060 13740 1 19 . 1 1 117 117 VAL H H 117 8.890 8.890 7.757 1.133 26060 13741 1 19 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.978 0.012 26060 13742 1 19 . 1 1 118 118 ASN C C 118 172.700 172.700 173.617 -0.917 26060 13743 1 19 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.308 0.052 26060 13744 1 19 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.003 -0.803 26060 13745 1 19 . 1 1 119 119 HIS N N 119 124.930 124.930 126.069 -1.139 26060 13746 1 19 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.066 -0.246 26060 13747 1 19 . 1 1 119 119 HIS C C 119 173.500 173.500 172.818 0.682 26060 13748 1 19 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.971 1.999 26060 13749 1 19 . 1 1 119 119 HIS CB C 119 34.670 34.670 33.970 0.700 26060 13750 1 19 . 1 1 119 119 HIS H H 119 8.790 8.790 9.029 -0.239 26060 13751 1 19 . 1 1 120 120 LEU N N 120 128.280 128.280 125.408 2.872 26060 13752 1 19 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.148 -0.198 26060 13753 1 19 . 1 1 120 120 LEU C C 120 174.030 174.030 175.088 -1.058 26060 13754 1 19 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.698 0.742 26060 13755 1 19 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.080 0.520 26060 13756 1 19 . 1 1 120 120 LEU H H 120 7.460 7.460 8.526 -1.066 26060 13757 1 19 . 1 1 121 121 ARG N N 121 128.060 128.060 122.460 5.600 26060 13758 1 19 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.701 -0.061 26060 13759 1 19 . 1 1 121 121 ARG C C 121 173.400 173.400 173.598 -0.198 26060 13760 1 19 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.188 0.172 26060 13761 1 19 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.410 1.850 26060 13762 1 19 . 1 1 121 121 ARG H H 121 9.860 9.860 9.052 0.808 26060 13763 1 19 . 1 1 122 122 CYS N N 122 125.290 125.290 119.704 5.586 26060 13764 1 19 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.385 -0.365 26060 13765 1 19 . 1 1 122 122 CYS C C 122 174.600 174.600 174.509 0.091 26060 13766 1 19 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.002 2.288 26060 13767 1 19 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.723 -1.693 26060 13768 1 19 . 1 1 122 122 CYS H H 122 8.835 8.835 8.703 0.132 26060 13769 1 19 . 1 1 123 123 GLU N N 123 125.920 125.920 123.455 2.465 26060 13770 1 19 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.523 0.157 26060 13771 1 19 . 1 1 123 123 GLU C C 123 174.500 174.500 174.570 -0.070 26060 13772 1 19 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.743 -0.323 26060 13773 1 19 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.985 0.598 26060 13774 1 19 . 1 1 123 123 GLU H H 123 8.970 8.970 9.162 -0.192 26060 13775 1 19 . 1 1 124 124 LYS N N 124 121.837 121.837 122.609 -0.772 26060 13776 1 19 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.943 0.017 26060 13777 1 19 . 1 1 124 124 LYS C C 124 175.700 175.700 175.615 0.085 26060 13778 1 19 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.014 0.343 26060 13779 1 19 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.616 -0.427 26060 13780 1 19 . 1 1 124 124 LYS H H 124 8.652 8.652 8.407 0.245 26060 13781 1 19 . 1 1 125 125 LEU N N 125 127.000 127.000 129.424 -2.424 26060 13782 1 19 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.629 0.021 26060 13783 1 19 . 1 1 125 125 LEU C C 125 175.110 175.110 175.655 -0.545 26060 13784 1 19 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.011 0.843 26060 13785 1 19 . 1 1 125 125 LEU CB C 125 44.267 44.267 42.040 2.227 26060 13786 1 19 . 1 1 125 125 LEU H H 125 9.175 9.175 9.210 -0.035 26060 13787 1 19 . 1 1 126 126 THR N N 126 117.779 117.779 119.513 -1.734 26060 13788 1 19 . 1 1 126 126 THR HA H 126 4.650 4.650 4.413 0.237 26060 13789 1 19 . 1 1 126 126 THR C C 126 173.200 173.200 173.385 -0.185 26060 13790 1 19 . 1 1 126 126 THR CA C 126 62.036 62.036 61.191 0.845 26060 13791 1 19 . 1 1 126 126 THR CB C 126 70.284 70.284 69.676 0.608 26060 13792 1 19 . 1 1 126 126 THR H H 126 8.331 8.331 8.310 0.021 26060 13793 1 19 . 1 1 127 127 PHE N N 127 126.576 126.576 125.932 0.644 26060 13794 1 19 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.707 -0.117 26060 13795 1 19 . 1 1 127 127 PHE C C 127 174.860 174.860 174.449 0.411 26060 13796 1 19 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.482 0.382 26060 13797 1 19 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.492 -1.492 26060 13798 1 19 . 1 1 127 127 PHE H H 127 9.051 9.051 8.230 0.821 26060 13799 1 19 . 1 1 128 128 ASN N N 128 123.040 123.040 122.323 0.717 26060 13800 1 19 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.612 0.008 26060 13801 1 19 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.190 1.290 26060 13802 1 19 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.328 1.133 26060 13803 1 19 . 1 1 128 128 ASN H H 128 8.880 8.880 8.771 0.109 26060 13804 1 19 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.499 0.261 26060 13805 1 19 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.563 -0.663 26060 13806 1 19 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.041 1.689 26060 13807 1 19 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.645 0.145 26060 13808 1 19 . 1 1 130 130 PRO C C 130 177.470 177.470 176.690 0.780 26060 13809 1 19 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.722 -0.148 26060 13810 1 19 . 1 1 130 130 PRO CB C 130 32.310 32.310 32.551 -0.241 26060 13811 1 19 . 1 1 131 131 THR N N 131 113.400 113.400 115.507 -2.107 26060 13812 1 19 . 1 1 131 131 THR HA H 131 4.300 4.300 4.130 0.170 26060 13813 1 19 . 1 1 131 131 THR C C 131 175.200 175.200 176.058 -0.858 26060 13814 1 19 . 1 1 131 131 THR CA C 131 62.200 62.200 61.153 1.047 26060 13815 1 19 . 1 1 131 131 THR CB C 131 70.600 70.600 70.339 0.261 26060 13816 1 19 . 1 1 131 131 THR H H 131 8.950 8.950 8.363 0.587 26060 13817 1 19 . 1 1 132 132 GLU N N 132 122.199 122.199 125.888 -3.689 26060 13818 1 19 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.868 0.142 26060 13819 1 19 . 1 1 132 132 GLU C C 132 178.700 178.700 178.254 0.446 26060 13820 1 19 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.390 -0.096 26060 13821 1 19 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.730 -0.569 26060 13822 1 19 . 1 1 132 132 GLU H H 132 8.932 8.932 8.966 -0.034 26060 13823 1 19 . 1 1 133 133 ASP N N 133 116.324 116.324 119.421 -3.097 26060 13824 1 19 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.309 0.021 26060 13825 1 19 . 1 1 133 133 ASP C C 133 177.800 177.800 178.448 -0.648 26060 13826 1 19 . 1 1 133 133 ASP CA C 133 57.546 57.546 58.116 -0.570 26060 13827 1 19 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.316 1.507 26060 13828 1 19 . 1 1 133 133 ASP H H 133 8.490 8.490 7.978 0.512 26060 13829 1 19 . 1 1 134 134 PHE N N 134 119.914 119.914 120.454 -0.540 26060 13830 1 19 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.131 0.479 26060 13831 1 19 . 1 1 134 134 PHE C C 134 177.300 177.300 176.826 0.474 26060 13832 1 19 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.850 -0.312 26060 13833 1 19 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.973 0.227 26060 13834 1 19 . 1 1 134 134 PHE H H 134 7.787 7.787 7.426 0.361 26060 13835 1 19 . 1 1 135 135 ARG N N 135 119.794 119.794 120.332 -0.538 26060 13836 1 19 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.556 -0.206 26060 13837 1 19 . 1 1 135 135 ARG C C 135 177.370 177.370 178.293 -0.923 26060 13838 1 19 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.088 0.288 26060 13839 1 19 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.024 0.372 26060 13840 1 19 . 1 1 135 135 ARG H H 135 9.087 9.087 8.891 0.196 26060 13841 1 19 . 1 1 136 136 ARG N N 136 114.554 114.554 118.649 -4.095 26060 13842 1 19 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.885 -0.065 26060 13843 1 19 . 1 1 136 136 ARG C C 136 178.950 178.950 178.906 0.044 26060 13844 1 19 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.735 0.065 26060 13845 1 19 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.006 0.211 26060 13846 1 19 . 1 1 136 136 ARG H H 136 7.747 7.747 8.579 -0.832 26060 13847 1 19 . 1 1 137 137 LYS N N 137 118.298 118.298 119.544 -1.246 26060 13848 1 19 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.959 -0.059 26060 13849 1 19 . 1 1 137 137 LYS C C 137 177.980 177.980 179.019 -1.039 26060 13850 1 19 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.632 0.763 26060 13851 1 19 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.390 0.057 26060 13852 1 19 . 1 1 137 137 LYS H H 137 7.154 7.154 7.457 -0.303 26060 13853 1 19 . 1 1 138 138 LEU N N 138 117.159 117.159 118.718 -1.559 26060 13854 1 19 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.726 -0.306 26060 13855 1 19 . 1 1 138 138 LEU C C 138 179.100 179.100 178.444 0.656 26060 13856 1 19 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.101 0.130 26060 13857 1 19 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.448 0.880 26060 13858 1 19 . 1 1 138 138 LEU H H 138 7.709 7.709 7.742 -0.033 26060 13859 1 19 . 1 1 139 139 LEU N N 139 115.158 115.158 116.927 -1.769 26060 13860 1 19 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.056 0.094 26060 13861 1 19 . 1 1 139 139 LEU C C 139 177.600 177.600 178.615 -1.015 26060 13862 1 19 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.651 -1.122 26060 13863 1 19 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.870 -0.126 26060 13864 1 19 . 1 1 139 139 LEU H H 139 7.507 7.507 8.003 -0.496 26060 13865 1 19 . 1 1 140 140 LYS N N 140 120.256 120.256 118.055 2.201 26060 13866 1 19 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.989 0.121 26060 13867 1 19 . 1 1 140 140 LYS C C 140 175.800 175.800 176.859 -1.059 26060 13868 1 19 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.696 -0.644 26060 13869 1 19 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.330 0.316 26060 13870 1 19 . 1 1 140 140 LYS H H 140 7.304 7.304 7.730 -0.426 26060 13871 1 20 . 1 1 4 4 MET C C 4 175.800 175.800 176.827 -1.027 26060 13872 1 20 . 1 1 4 4 MET CA C 4 55.350 55.350 58.174 -2.824 26060 13873 1 20 . 1 1 4 4 MET CB C 4 32.880 32.880 33.404 -0.524 26060 13874 1 20 . 1 1 5 5 ALA N N 5 125.230 125.230 118.566 6.664 26060 13875 1 20 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.436 -0.086 26060 13876 1 20 . 1 1 5 5 ALA CA C 5 52.430 52.430 51.866 0.564 26060 13877 1 20 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.027 0.343 26060 13878 1 20 . 1 1 5 5 ALA H H 5 8.320 8.320 8.065 0.255 26060 13879 1 20 . 1 1 6 6 SER HA H 6 4.490 4.490 4.439 0.051 26060 13880 1 20 . 1 1 6 6 SER CA C 6 58.200 58.200 58.528 -0.328 26060 13881 1 20 . 1 1 6 6 SER CB C 6 63.700 63.700 63.559 0.141 26060 13882 1 20 . 1 1 7 7 SER HA H 7 4.530 4.530 4.749 -0.219 26060 13883 1 20 . 1 1 7 7 SER CA C 7 58.200 58.200 57.730 0.471 26060 13884 1 20 . 1 1 7 7 SER CB C 7 63.700 63.700 64.259 -0.559 26060 13885 1 20 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.589 0.021 26060 13886 1 20 . 1 1 8 8 CYS C C 8 173.500 173.500 172.741 0.759 26060 13887 1 20 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.525 0.815 26060 13888 1 20 . 1 1 8 8 CYS CB C 8 28.490 28.490 30.459 -1.970 26060 13889 1 20 . 1 1 9 9 ALA N N 9 124.700 124.700 125.699 -0.999 26060 13890 1 20 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.991 -0.201 26060 13891 1 20 . 1 1 9 9 ALA C C 9 177.400 177.400 176.585 0.815 26060 13892 1 20 . 1 1 9 9 ALA CA C 9 52.070 52.070 51.514 0.556 26060 13893 1 20 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.260 1.369 26060 13894 1 20 . 1 1 9 9 ALA H H 9 7.960 7.960 8.279 -0.319 26060 13895 1 20 . 1 1 10 10 VAL N N 10 120.124 120.124 124.947 -4.823 26060 13896 1 20 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.246 0.044 26060 13897 1 20 . 1 1 10 10 VAL C C 10 173.900 173.900 175.047 -1.147 26060 13898 1 20 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.747 -0.197 26060 13899 1 20 . 1 1 10 10 VAL CB C 10 34.900 34.900 33.252 1.648 26060 13900 1 20 . 1 1 10 10 VAL H H 10 8.424 8.424 8.443 -0.019 26060 13901 1 20 . 1 1 11 11 GLN N N 11 125.818 125.818 125.358 0.460 26060 13902 1 20 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.450 0.110 26060 13903 1 20 . 1 1 11 11 GLN C C 11 175.400 175.400 175.110 0.290 26060 13904 1 20 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.343 -0.220 26060 13905 1 20 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.946 1.083 26060 13906 1 20 . 1 1 11 11 GLN H H 11 8.636 8.636 8.508 0.128 26060 13907 1 20 . 1 1 12 12 VAL N N 12 119.106 119.106 118.952 0.154 26060 13908 1 20 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.420 0.210 26060 13909 1 20 . 1 1 12 12 VAL C C 12 173.800 173.800 174.702 -0.902 26060 13910 1 20 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.323 0.477 26060 13911 1 20 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.730 1.980 26060 13912 1 20 . 1 1 12 12 VAL H H 12 8.827 8.827 9.005 -0.178 26060 13913 1 20 . 1 1 13 13 LYS N N 13 121.700 121.700 125.919 -4.219 26060 13914 1 20 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.173 0.027 26060 13915 1 20 . 1 1 13 13 LYS C C 13 175.030 175.030 176.241 -1.211 26060 13916 1 20 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.216 0.214 26060 13917 1 20 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.052 1.868 26060 13918 1 20 . 1 1 13 13 LYS H H 13 8.234 8.234 8.563 -0.329 26060 13919 1 20 . 1 1 14 14 LEU N N 14 119.100 119.100 123.899 -4.799 26060 13920 1 20 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.184 -0.234 26060 13921 1 20 . 1 1 14 14 LEU C C 14 175.110 175.110 176.672 -1.562 26060 13922 1 20 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.373 -0.016 26060 13923 1 20 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.367 1.554 26060 13924 1 20 . 1 1 14 14 LEU H H 14 8.840 8.840 8.210 0.630 26060 13925 1 20 . 1 1 15 15 GLU N N 15 120.978 120.978 120.700 0.278 26060 13926 1 20 . 1 1 15 15 GLU HA H 15 4.990 4.990 4.800 0.190 26060 13927 1 20 . 1 1 15 15 GLU C C 15 173.800 173.800 174.559 -0.759 26060 13928 1 20 . 1 1 15 15 GLU CA C 15 55.428 55.428 55.109 0.319 26060 13929 1 20 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.563 -1.737 26060 13930 1 20 . 1 1 15 15 GLU H H 15 9.181 9.181 9.145 0.036 26060 13931 1 20 . 1 1 16 16 LEU N N 16 124.438 124.438 126.093 -1.655 26060 13932 1 20 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.469 -0.359 26060 13933 1 20 . 1 1 16 16 LEU C C 16 174.700 174.700 176.034 -1.334 26060 13934 1 20 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.197 0.879 26060 13935 1 20 . 1 1 16 16 LEU CB C 16 44.892 44.892 44.330 0.562 26060 13936 1 20 . 1 1 16 16 LEU H H 16 8.891 8.891 7.770 1.121 26060 13937 1 20 . 1 1 17 17 GLY N N 17 108.067 108.067 107.951 0.116 26060 13938 1 20 . 1 1 17 17 GLY C C 17 170.350 170.350 172.230 -1.880 26060 13939 1 20 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.561 1.423 26060 13940 1 20 . 1 1 17 17 GLY H H 17 7.227 7.227 8.212 -0.985 26060 13941 1 20 . 1 1 18 18 HIS N N 18 111.200 111.200 118.501 -7.301 26060 13942 1 20 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.843 -0.223 26060 13943 1 20 . 1 1 18 18 HIS C C 18 172.400 172.400 172.719 -0.319 26060 13944 1 20 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.800 -0.860 26060 13945 1 20 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.660 1.500 26060 13946 1 20 . 1 1 18 18 HIS H H 18 8.150 8.150 9.130 -0.980 26060 13947 1 20 . 1 1 19 19 ARG N N 19 117.800 117.800 122.360 -4.560 26060 13948 1 20 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.855 0.245 26060 13949 1 20 . 1 1 19 19 ARG C C 19 175.800 175.800 174.228 1.572 26060 13950 1 20 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.036 -0.536 26060 13951 1 20 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.133 -0.483 26060 13952 1 20 . 1 1 19 19 ARG H H 19 9.010 9.010 8.897 0.113 26060 13953 1 20 . 1 1 20 20 ALA N N 20 120.390 120.390 121.557 -1.167 26060 13954 1 20 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.548 -0.018 26060 13955 1 20 . 1 1 20 20 ALA C C 20 175.800 175.800 175.063 0.737 26060 13956 1 20 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.954 1.236 26060 13957 1 20 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.291 0.459 26060 13958 1 20 . 1 1 20 20 ALA H H 20 8.070 8.070 8.524 -0.454 26060 13959 1 20 . 1 1 21 21 GLN N N 21 121.790 121.790 122.015 -0.225 26060 13960 1 20 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.838 0.392 26060 13961 1 20 . 1 1 21 21 GLN CA C 21 54.330 54.330 53.996 0.334 26060 13962 1 20 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.399 -0.499 26060 13963 1 20 . 1 1 21 21 GLN H H 21 9.240 9.240 9.085 0.155 26060 13964 1 20 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.541 -0.911 26060 13965 1 20 . 1 1 22 22 VAL C C 22 176.500 176.500 175.945 0.555 26060 13966 1 20 . 1 1 22 22 VAL CA C 22 63.030 63.030 61.165 1.865 26060 13967 1 20 . 1 1 22 22 VAL CB C 22 31.600 31.600 32.700 -1.100 26060 13968 1 20 . 1 1 23 23 ARG N N 23 127.840 127.840 127.361 0.479 26060 13969 1 20 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.463 -0.333 26060 13970 1 20 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.707 0.893 26060 13971 1 20 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.730 1.419 26060 13972 1 20 . 1 1 23 23 ARG H H 23 8.720 8.720 8.019 0.701 26060 13973 1 20 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.162 -0.122 26060 13974 1 20 . 1 1 24 24 LYS C C 24 176.960 176.960 176.165 0.795 26060 13975 1 20 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.795 1.005 26060 13976 1 20 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.462 -0.402 26060 13977 1 20 . 1 1 25 25 LYS N N 25 115.870 115.870 118.794 -2.924 26060 13978 1 20 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.681 0.149 26060 13979 1 20 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.403 -0.443 26060 13980 1 20 . 1 1 25 25 LYS CB C 25 35.080 35.080 34.197 0.883 26060 13981 1 20 . 1 1 25 25 LYS H H 25 7.720 7.720 7.511 0.209 26060 13982 1 20 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.643 0.187 26060 13983 1 20 . 1 1 26 26 PRO C C 26 177.400 177.400 176.987 0.413 26060 13984 1 20 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.809 -0.159 26060 13985 1 20 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.332 0.058 26060 13986 1 20 . 1 1 27 27 THR N N 27 111.270 111.270 115.193 -3.923 26060 13987 1 20 . 1 1 27 27 THR HA H 27 4.530 4.530 4.195 0.335 26060 13988 1 20 . 1 1 27 27 THR C C 27 177.300 177.300 176.992 0.308 26060 13989 1 20 . 1 1 27 27 THR CA C 27 61.300 61.300 61.501 -0.201 26060 13990 1 20 . 1 1 27 27 THR CB C 27 71.460 71.460 69.978 1.482 26060 13991 1 20 . 1 1 27 27 THR H H 27 8.380 8.380 8.201 0.179 26060 13992 1 20 . 1 1 28 28 VAL N N 28 121.170 121.170 122.340 -1.170 26060 13993 1 20 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.798 0.085 26060 13994 1 20 . 1 1 28 28 VAL C C 28 177.030 177.030 176.073 0.957 26060 13995 1 20 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.177 0.023 26060 13996 1 20 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.634 -0.234 26060 13997 1 20 . 1 1 28 28 VAL H H 28 8.910 8.910 8.540 0.370 26060 13998 1 20 . 1 1 29 29 GLU N N 29 116.800 116.800 118.746 -1.946 26060 13999 1 20 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.106 -0.186 26060 14000 1 20 . 1 1 29 29 GLU C C 29 176.200 176.200 175.727 0.473 26060 14001 1 20 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.323 1.927 26060 14002 1 20 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.164 -0.994 26060 14003 1 20 . 1 1 29 29 GLU H H 29 7.990 7.990 8.006 -0.016 26060 14004 1 20 . 1 1 30 30 GLY N N 30 105.500 105.500 107.177 -1.677 26060 14005 1 20 . 1 1 30 30 GLY C C 30 174.900 174.900 173.675 1.225 26060 14006 1 20 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.182 -0.722 26060 14007 1 20 . 1 1 30 30 GLY H H 30 7.950 7.950 7.640 0.310 26060 14008 1 20 . 1 1 31 31 PHE N N 31 119.300 119.300 118.591 0.709 26060 14009 1 20 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.976 -0.216 26060 14010 1 20 . 1 1 31 31 PHE C C 31 176.400 176.400 175.947 0.453 26060 14011 1 20 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.558 1.342 26060 14012 1 20 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.773 -4.273 26060 14013 1 20 . 1 1 31 31 PHE H H 31 7.520 7.520 7.353 0.167 26060 14014 1 20 . 1 1 32 32 THR N N 32 112.300 112.300 116.055 -3.755 26060 14015 1 20 . 1 1 32 32 THR HA H 32 4.330 4.330 4.480 -0.150 26060 14016 1 20 . 1 1 32 32 THR C C 32 175.200 175.200 174.425 0.775 26060 14017 1 20 . 1 1 32 32 THR CA C 32 62.780 62.780 62.863 -0.083 26060 14018 1 20 . 1 1 32 32 THR CB C 32 70.350 70.350 69.984 0.366 26060 14019 1 20 . 1 1 32 32 THR H H 32 7.770 7.770 9.127 -1.357 26060 14020 1 20 . 1 1 33 33 HIS N N 33 121.900 121.900 122.225 -0.325 26060 14021 1 20 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.267 0.233 26060 14022 1 20 . 1 1 33 33 HIS C C 33 173.880 173.880 173.763 0.117 26060 14023 1 20 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.637 0.143 26060 14024 1 20 . 1 1 33 33 HIS CB C 33 35.640 35.640 31.383 4.257 26060 14025 1 20 . 1 1 33 33 HIS H H 33 9.110 9.110 8.812 0.298 26060 14026 1 20 . 1 1 34 34 ASP N N 34 120.300 120.300 125.129 -4.829 26060 14027 1 20 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.496 -0.096 26060 14028 1 20 . 1 1 34 34 ASP C C 34 175.100 175.100 175.038 0.062 26060 14029 1 20 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.956 -0.646 26060 14030 1 20 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.745 -0.645 26060 14031 1 20 . 1 1 34 34 ASP H H 34 8.810 8.810 8.821 -0.011 26060 14032 1 20 . 1 1 35 35 TRP N N 35 119.800 119.800 120.379 -0.579 26060 14033 1 20 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.496 0.234 26060 14034 1 20 . 1 1 35 35 TRP C C 35 174.900 174.900 173.320 1.580 26060 14035 1 20 . 1 1 35 35 TRP CA C 35 54.900 54.900 55.097 -0.197 26060 14036 1 20 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.020 2.050 26060 14037 1 20 . 1 1 35 35 TRP H H 35 9.250 9.250 8.895 0.355 26060 14038 1 20 . 1 1 36 36 MET N N 36 120.980 120.980 121.456 -0.476 26060 14039 1 20 . 1 1 36 36 MET HA H 36 5.750 5.750 5.912 -0.162 26060 14040 1 20 . 1 1 36 36 MET C C 36 173.700 173.700 174.294 -0.594 26060 14041 1 20 . 1 1 36 36 MET CA C 36 54.830 54.830 54.376 0.454 26060 14042 1 20 . 1 1 36 36 MET CB C 36 35.220 35.220 36.712 -1.492 26060 14043 1 20 . 1 1 36 36 MET H H 36 9.080 9.080 8.791 0.289 26060 14044 1 20 . 1 1 37 37 VAL N N 37 126.220 126.220 120.835 5.385 26060 14045 1 20 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.151 0.159 26060 14046 1 20 . 1 1 37 37 VAL C C 37 172.300 172.300 174.350 -2.050 26060 14047 1 20 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.754 -1.214 26060 14048 1 20 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.815 1.255 26060 14049 1 20 . 1 1 37 37 VAL H H 37 9.080 9.080 8.801 0.279 26060 14050 1 20 . 1 1 38 38 PHE N N 38 120.640 120.640 122.472 -1.832 26060 14051 1 20 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.240 0.730 26060 14052 1 20 . 1 1 38 38 PHE C C 38 172.960 172.960 175.119 -2.159 26060 14053 1 20 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.866 -0.736 26060 14054 1 20 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.235 -0.235 26060 14055 1 20 . 1 1 38 38 PHE H H 38 8.320 8.320 9.009 -0.689 26060 14056 1 20 . 1 1 39 39 VAL N N 39 116.500 116.500 121.380 -4.880 26060 14057 1 20 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.625 -0.615 26060 14058 1 20 . 1 1 39 39 VAL C C 39 174.700 174.700 174.310 0.390 26060 14059 1 20 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.005 1.635 26060 14060 1 20 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.935 1.465 26060 14061 1 20 . 1 1 39 39 VAL H H 39 8.580 8.580 9.129 -0.549 26060 14062 1 20 . 1 1 40 40 ARG N N 40 124.100 124.100 123.141 0.959 26060 14063 1 20 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.729 0.351 26060 14064 1 20 . 1 1 40 40 ARG C C 40 173.800 173.800 173.719 0.081 26060 14065 1 20 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.442 -0.512 26060 14066 1 20 . 1 1 40 40 ARG CB C 40 33.580 33.580 31.964 1.616 26060 14067 1 20 . 1 1 40 40 ARG H H 40 9.880 9.880 8.641 1.239 26060 14068 1 20 . 1 1 41 41 GLY N N 41 107.640 107.640 106.186 1.454 26060 14069 1 20 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.474 1.496 26060 14070 1 20 . 1 1 41 41 GLY H H 41 8.910 8.910 8.521 0.389 26060 14071 1 20 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.501 -0.011 26060 14072 1 20 . 1 1 42 42 PRO C C 42 177.300 177.300 176.742 0.558 26060 14073 1 20 . 1 1 42 42 PRO CA C 42 62.440 62.440 61.763 0.677 26060 14074 1 20 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.681 -0.571 26060 14075 1 20 . 1 1 43 43 GLU N N 43 121.050 121.050 121.453 -0.403 26060 14076 1 20 . 1 1 43 43 GLU HA H 43 3.790 3.790 3.936 -0.146 26060 14077 1 20 . 1 1 43 43 GLU C C 43 176.110 176.110 176.228 -0.118 26060 14078 1 20 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.462 -0.612 26060 14079 1 20 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.595 -0.745 26060 14080 1 20 . 1 1 43 43 GLU H H 43 9.060 9.060 8.682 0.378 26060 14081 1 20 . 1 1 44 44 HIS N N 44 114.100 114.100 115.199 -1.099 26060 14082 1 20 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.302 0.049 26060 14083 1 20 . 1 1 44 44 HIS C C 44 175.170 175.170 175.122 0.048 26060 14084 1 20 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.355 0.295 26060 14085 1 20 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.811 -0.441 26060 14086 1 20 . 1 1 44 44 HIS H H 44 8.420 8.420 8.606 -0.186 26060 14087 1 20 . 1 1 45 45 SER N N 45 115.540 115.540 117.738 -2.198 26060 14088 1 20 . 1 1 45 45 SER HA H 45 4.560 4.560 4.665 -0.105 26060 14089 1 20 . 1 1 45 45 SER C C 45 173.700 173.700 173.646 0.054 26060 14090 1 20 . 1 1 45 45 SER CA C 45 58.710 58.710 57.513 1.197 26060 14091 1 20 . 1 1 45 45 SER CB C 45 65.040 65.040 63.808 1.232 26060 14092 1 20 . 1 1 45 45 SER H H 45 7.870 7.870 8.039 -0.169 26060 14093 1 20 . 1 1 46 46 ASN N N 46 123.900 123.900 124.251 -0.351 26060 14094 1 20 . 1 1 46 46 ASN HA H 46 5.120 5.120 5.073 0.047 26060 14095 1 20 . 1 1 46 46 ASN C C 46 176.300 176.300 175.586 0.714 26060 14096 1 20 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.859 -0.169 26060 14097 1 20 . 1 1 46 46 ASN CB C 46 38.730 38.730 41.189 -2.459 26060 14098 1 20 . 1 1 46 46 ASN H H 46 9.480 9.480 8.819 0.661 26060 14099 1 20 . 1 1 47 47 ILE N N 47 115.240 115.240 120.181 -4.941 26060 14100 1 20 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.319 0.621 26060 14101 1 20 . 1 1 47 47 ILE C C 47 176.000 176.000 176.573 -0.573 26060 14102 1 20 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.580 0.620 26060 14103 1 20 . 1 1 47 47 ILE CB C 47 36.700 36.700 37.790 -1.090 26060 14104 1 20 . 1 1 47 47 ILE H H 47 8.170 8.170 8.671 -0.501 26060 14105 1 20 . 1 1 48 48 GLN N N 48 123.200 123.200 119.542 3.658 26060 14106 1 20 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.051 0.229 26060 14107 1 20 . 1 1 48 48 GLN C C 48 175.670 175.670 176.761 -1.091 26060 14108 1 20 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.267 -0.367 26060 14109 1 20 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.790 -0.800 26060 14110 1 20 . 1 1 48 48 GLN H H 48 8.850 8.850 8.516 0.334 26060 14111 1 20 . 1 1 49 49 HIS N N 49 115.400 115.400 116.720 -1.320 26060 14112 1 20 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.409 0.161 26060 14113 1 20 . 1 1 49 49 HIS C C 49 176.380 176.380 177.062 -0.682 26060 14114 1 20 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.767 -0.017 26060 14115 1 20 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.744 0.876 26060 14116 1 20 . 1 1 49 49 HIS H H 49 7.400 7.400 7.505 -0.105 26060 14117 1 20 . 1 1 50 50 PHE N N 50 109.800 109.800 113.013 -3.213 26060 14118 1 20 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.946 0.284 26060 14119 1 20 . 1 1 50 50 PHE C C 50 173.800 173.800 174.161 -0.361 26060 14120 1 20 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.661 -0.001 26060 14121 1 20 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.770 1.230 26060 14122 1 20 . 1 1 50 50 PHE H H 50 7.570 7.570 7.653 -0.083 26060 14123 1 20 . 1 1 51 51 VAL N N 51 127.810 127.810 121.002 6.808 26060 14124 1 20 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.854 -0.484 26060 14125 1 20 . 1 1 51 51 VAL C C 51 174.500 174.500 174.744 -0.244 26060 14126 1 20 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.417 1.583 26060 14127 1 20 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.617 -1.337 26060 14128 1 20 . 1 1 51 51 VAL H H 51 7.810 7.810 8.108 -0.298 26060 14129 1 20 . 1 1 52 52 GLU N N 52 130.700 130.700 128.381 2.319 26060 14130 1 20 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.273 -0.293 26060 14131 1 20 . 1 1 52 52 GLU C C 52 175.400 175.400 175.680 -0.280 26060 14132 1 20 . 1 1 52 52 GLU CA C 52 58.100 58.100 58.244 -0.144 26060 14133 1 20 . 1 1 52 52 GLU CB C 52 31.580 31.580 31.171 0.409 26060 14134 1 20 . 1 1 52 52 GLU H H 52 9.380 9.380 9.016 0.364 26060 14135 1 20 . 1 1 53 53 LYS N N 53 109.200 109.200 114.843 -5.643 26060 14136 1 20 . 1 1 53 53 LYS HA H 53 4.800 4.800 4.790 0.010 26060 14137 1 20 . 1 1 53 53 LYS C C 53 172.300 172.300 174.240 -1.940 26060 14138 1 20 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.775 0.065 26060 14139 1 20 . 1 1 53 53 LYS CB C 53 34.250 34.250 35.822 -1.572 26060 14140 1 20 . 1 1 53 53 LYS H H 53 7.190 7.190 7.765 -0.575 26060 14141 1 20 . 1 1 54 54 VAL N N 54 120.380 120.380 118.240 2.140 26060 14142 1 20 . 1 1 54 54 VAL HA H 54 4.770 4.770 5.050 -0.280 26060 14143 1 20 . 1 1 54 54 VAL C C 54 173.600 173.600 174.063 -0.463 26060 14144 1 20 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.646 -0.606 26060 14145 1 20 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.543 -1.843 26060 14146 1 20 . 1 1 54 54 VAL H H 54 8.450 8.450 8.324 0.126 26060 14147 1 20 . 1 1 55 55 VAL N N 55 126.920 126.920 125.279 1.641 26060 14148 1 20 . 1 1 55 55 VAL HA H 55 4.700 4.700 4.994 -0.294 26060 14149 1 20 . 1 1 55 55 VAL C C 55 173.800 173.800 174.032 -0.232 26060 14150 1 20 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.806 0.064 26060 14151 1 20 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.793 -2.693 26060 14152 1 20 . 1 1 55 55 VAL H H 55 9.260 9.260 9.203 0.057 26060 14153 1 20 . 1 1 56 56 PHE N N 56 126.130 126.130 124.858 1.272 26060 14154 1 20 . 1 1 56 56 PHE HA H 56 4.690 4.690 4.992 -0.302 26060 14155 1 20 . 1 1 56 56 PHE C C 56 174.000 174.000 174.370 -0.370 26060 14156 1 20 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.821 -0.241 26060 14157 1 20 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.333 -1.443 26060 14158 1 20 . 1 1 56 56 PHE H H 56 9.290 9.290 8.991 0.299 26060 14159 1 20 . 1 1 57 57 HIS N N 57 124.180 124.180 123.929 0.251 26060 14160 1 20 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.996 -0.196 26060 14161 1 20 . 1 1 57 57 HIS C C 57 174.700 174.700 174.823 -0.123 26060 14162 1 20 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.079 0.241 26060 14163 1 20 . 1 1 57 57 HIS CB C 57 30.100 30.100 29.066 1.034 26060 14164 1 20 . 1 1 57 57 HIS H H 57 8.690 8.690 8.537 0.153 26060 14165 1 20 . 1 1 58 58 LEU N N 58 122.050 122.050 123.547 -1.497 26060 14166 1 20 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.361 -0.121 26060 14167 1 20 . 1 1 58 58 LEU C C 58 174.400 174.400 176.952 -2.552 26060 14168 1 20 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.901 0.509 26060 14169 1 20 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.398 -1.238 26060 14170 1 20 . 1 1 58 58 LEU H H 58 9.050 9.050 8.331 0.719 26060 14171 1 20 . 1 1 59 59 HIS N N 59 118.510 118.510 118.073 0.437 26060 14172 1 20 . 1 1 59 59 HIS C C 59 175.300 175.300 176.609 -1.309 26060 14173 1 20 . 1 1 59 59 HIS CA C 59 59.110 59.110 56.334 2.776 26060 14174 1 20 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.720 0.210 26060 14175 1 20 . 1 1 59 59 HIS H H 59 5.160 5.160 7.755 -2.595 26060 14176 1 20 . 1 1 60 60 GLU N N 60 122.190 122.190 125.776 -3.586 26060 14177 1 20 . 1 1 60 60 GLU HA H 60 3.960 3.960 3.986 -0.026 26060 14178 1 20 . 1 1 60 60 GLU C C 60 175.130 175.130 177.126 -1.996 26060 14179 1 20 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.397 -0.387 26060 14180 1 20 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.577 0.243 26060 14181 1 20 . 1 1 60 60 GLU H H 60 7.960 7.960 8.435 -0.475 26060 14182 1 20 . 1 1 61 61 SER N N 61 116.940 116.940 112.902 4.038 26060 14183 1 20 . 1 1 61 61 SER HA H 61 4.200 4.200 4.370 -0.170 26060 14184 1 20 . 1 1 61 61 SER CA C 61 60.010 60.010 58.993 1.017 26060 14185 1 20 . 1 1 61 61 SER CB C 61 63.140 63.140 63.547 -0.407 26060 14186 1 20 . 1 1 61 61 SER H H 61 8.540 8.540 8.070 0.470 26060 14187 1 20 . 1 1 62 62 PHE N N 62 123.700 123.700 122.001 1.699 26060 14188 1 20 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.682 -0.132 26060 14189 1 20 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.776 2.164 26060 14190 1 20 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.936 -0.536 26060 14191 1 20 . 1 1 62 62 PHE H H 62 8.640 8.640 8.148 0.492 26060 14192 1 20 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.466 -0.056 26060 14193 1 20 . 1 1 63 63 PRO C C 63 176.400 176.400 176.005 0.395 26060 14194 1 20 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.344 -0.744 26060 14195 1 20 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.037 -0.177 26060 14196 1 20 . 1 1 64 64 ARG N N 64 116.840 116.840 120.105 -3.265 26060 14197 1 20 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.117 -0.017 26060 14198 1 20 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.129 -0.519 26060 14199 1 20 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.852 -0.022 26060 14200 1 20 . 1 1 64 64 ARG H H 64 8.890 8.890 8.559 0.331 26060 14201 1 20 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.409 -0.419 26060 14202 1 20 . 1 1 65 65 PRO C C 65 175.800 175.800 177.007 -1.207 26060 14203 1 20 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.899 1.911 26060 14204 1 20 . 1 1 65 65 PRO CB C 65 31.880 31.880 32.001 -0.121 26060 14205 1 20 . 1 1 66 66 LYS N N 66 119.035 119.035 120.314 -1.279 26060 14206 1 20 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.100 -0.490 26060 14207 1 20 . 1 1 66 66 LYS C C 66 175.400 175.400 175.855 -0.455 26060 14208 1 20 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.512 -0.059 26060 14209 1 20 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.160 -0.430 26060 14210 1 20 . 1 1 66 66 LYS H H 66 7.630 7.630 7.905 -0.275 26060 14211 1 20 . 1 1 67 67 ARG N N 67 127.394 127.394 128.202 -0.808 26060 14212 1 20 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.658 0.082 26060 14213 1 20 . 1 1 67 67 ARG C C 67 174.500 174.500 175.009 -0.509 26060 14214 1 20 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.611 0.189 26060 14215 1 20 . 1 1 67 67 ARG CB C 67 29.714 29.714 30.423 -0.709 26060 14216 1 20 . 1 1 67 67 ARG H H 67 8.855 8.855 8.930 -0.075 26060 14217 1 20 . 1 1 68 68 VAL N N 68 124.388 124.388 120.686 3.702 26060 14218 1 20 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.077 -0.497 26060 14219 1 20 . 1 1 68 68 VAL C C 68 176.850 176.850 175.577 1.273 26060 14220 1 20 . 1 1 68 68 VAL CA C 68 62.073 62.073 60.453 1.620 26060 14221 1 20 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.121 0.483 26060 14222 1 20 . 1 1 68 68 VAL H H 68 8.681 8.681 8.454 0.227 26060 14223 1 20 . 1 1 69 69 CYS N N 69 127.080 127.080 126.527 0.553 26060 14224 1 20 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.790 0.280 26060 14225 1 20 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.937 0.409 26060 14226 1 20 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.823 0.947 26060 14227 1 20 . 1 1 69 69 CYS H H 69 9.455 9.455 9.159 0.296 26060 14228 1 20 . 1 1 70 70 LYS N N 70 125.480 125.480 122.778 2.702 26060 14229 1 20 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.567 -0.078 26060 14230 1 20 . 1 1 70 70 LYS C C 70 174.300 174.300 175.691 -1.391 26060 14231 1 20 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.340 1.420 26060 14232 1 20 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.316 -0.146 26060 14233 1 20 . 1 1 70 70 LYS H H 70 9.050 9.050 8.684 0.366 26060 14234 1 20 . 1 1 71 71 ASP N N 71 116.940 116.940 119.808 -2.868 26060 14235 1 20 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.710 0.390 26060 14236 1 20 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.959 -0.879 26060 14237 1 20 . 1 1 71 71 ASP CB C 71 43.380 43.380 40.778 2.602 26060 14238 1 20 . 1 1 71 71 ASP H H 71 7.620 7.620 7.557 0.063 26060 14239 1 20 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.149 -0.889 26060 14240 1 20 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.849 -2.199 26060 14241 1 20 . 1 1 72 72 PRO CB C 72 30.040 30.040 30.914 -0.874 26060 14242 1 20 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.152 -0.052 26060 14243 1 20 . 1 1 73 73 PRO C C 73 174.700 174.700 175.937 -1.237 26060 14244 1 20 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.342 -2.652 26060 14245 1 20 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.310 2.730 26060 14246 1 20 . 1 1 74 74 TYR N N 74 125.400 125.400 124.626 0.774 26060 14247 1 20 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.546 0.304 26060 14248 1 20 . 1 1 74 74 TYR C C 74 172.900 172.900 175.507 -2.607 26060 14249 1 20 . 1 1 74 74 TYR CA C 74 55.670 55.670 57.753 -2.083 26060 14250 1 20 . 1 1 74 74 TYR CB C 74 35.400 35.400 39.464 -4.064 26060 14251 1 20 . 1 1 74 74 TYR H H 74 8.960 8.960 8.313 0.647 26060 14252 1 20 . 1 1 75 75 LYS N N 75 121.400 121.400 119.385 2.015 26060 14253 1 20 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.067 0.523 26060 14254 1 20 . 1 1 75 75 LYS C C 75 173.800 173.800 174.327 -0.527 26060 14255 1 20 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.650 -0.000 26060 14256 1 20 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.743 -0.853 26060 14257 1 20 . 1 1 75 75 LYS H H 75 7.670 7.670 7.978 -0.308 26060 14258 1 20 . 1 1 76 76 VAL N N 76 119.800 119.800 120.786 -0.986 26060 14259 1 20 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.142 -0.252 26060 14260 1 20 . 1 1 76 76 VAL C C 76 173.900 173.900 174.327 -0.427 26060 14261 1 20 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.544 1.186 26060 14262 1 20 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.207 0.333 26060 14263 1 20 . 1 1 76 76 VAL H H 76 8.180 8.180 7.795 0.385 26060 14264 1 20 . 1 1 77 77 GLU N N 77 126.190 126.190 127.166 -0.976 26060 14265 1 20 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.884 0.066 26060 14266 1 20 . 1 1 77 77 GLU C C 77 174.700 174.700 175.021 -0.321 26060 14267 1 20 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.266 -0.326 26060 14268 1 20 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.255 0.295 26060 14269 1 20 . 1 1 77 77 GLU H H 77 8.270 8.270 8.581 -0.311 26060 14270 1 20 . 1 1 78 78 GLU N N 78 126.180 126.180 123.936 2.244 26060 14271 1 20 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.598 -0.148 26060 14272 1 20 . 1 1 78 78 GLU C C 78 175.400 175.400 173.912 1.488 26060 14273 1 20 . 1 1 78 78 GLU CA C 78 54.042 54.042 53.847 0.195 26060 14274 1 20 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.823 3.277 26060 14275 1 20 . 1 1 78 78 GLU H H 78 7.870 7.870 8.343 -0.473 26060 14276 1 20 . 1 1 79 79 SER N N 79 112.109 112.109 113.324 -1.215 26060 14277 1 20 . 1 1 79 79 SER HA H 79 5.560 5.560 5.334 0.226 26060 14278 1 20 . 1 1 79 79 SER C C 79 172.490 172.490 173.270 -0.780 26060 14279 1 20 . 1 1 79 79 SER CA C 79 57.754 57.754 56.597 1.157 26060 14280 1 20 . 1 1 79 79 SER CB C 79 65.861 65.861 65.308 0.553 26060 14281 1 20 . 1 1 79 79 SER H H 79 7.714 7.714 8.355 -0.641 26060 14282 1 20 . 1 1 80 80 GLY N N 80 106.048 106.048 110.597 -4.549 26060 14283 1 20 . 1 1 80 80 GLY C C 80 172.630 172.630 171.962 0.668 26060 14284 1 20 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.610 0.960 26060 14285 1 20 . 1 1 80 80 GLY H H 80 8.828 8.828 9.004 -0.176 26060 14286 1 20 . 1 1 81 81 TYR N N 81 115.280 115.280 114.111 1.169 26060 14287 1 20 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.240 0.440 26060 14288 1 20 . 1 1 81 81 TYR C C 81 174.100 174.100 173.884 0.216 26060 14289 1 20 . 1 1 81 81 TYR CA C 81 55.500 55.500 57.076 -1.576 26060 14290 1 20 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.494 1.846 26060 14291 1 20 . 1 1 81 81 TYR H H 81 8.770 8.770 8.111 0.659 26060 14292 1 20 . 1 1 82 82 ALA N N 82 122.350 122.350 122.504 -0.154 26060 14293 1 20 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.482 -0.082 26060 14294 1 20 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.619 0.421 26060 14295 1 20 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.105 1.295 26060 14296 1 20 . 1 1 82 82 ALA H H 82 7.160 7.160 7.305 -0.145 26060 14297 1 20 . 1 1 83 83 GLY N N 83 107.100 107.100 106.951 0.149 26060 14298 1 20 . 1 1 83 83 GLY C C 83 172.500 172.500 173.577 -1.077 26060 14299 1 20 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.199 0.411 26060 14300 1 20 . 1 1 83 83 GLY H H 83 8.220 8.220 8.267 -0.047 26060 14301 1 20 . 1 1 84 84 PHE N N 84 111.660 111.660 115.601 -3.941 26060 14302 1 20 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.578 0.112 26060 14303 1 20 . 1 1 84 84 PHE C C 84 172.460 172.460 173.109 -0.649 26060 14304 1 20 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.211 0.289 26060 14305 1 20 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.707 -1.127 26060 14306 1 20 . 1 1 84 84 PHE H H 84 7.700 7.700 7.915 -0.215 26060 14307 1 20 . 1 1 85 85 ILE N N 85 117.810 117.810 121.211 -3.401 26060 14308 1 20 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.131 0.179 26060 14309 1 20 . 1 1 85 85 ILE CA C 85 59.340 59.340 61.155 -1.815 26060 14310 1 20 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.025 -1.765 26060 14311 1 20 . 1 1 85 85 ILE H H 85 8.340 8.340 8.380 -0.040 26060 14312 1 20 . 1 1 86 86 LEU N N 86 108.130 108.130 129.559 -21.429 26060 14313 1 20 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.086 -0.106 26060 14314 1 20 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.165 2.035 26060 14315 1 20 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.448 -0.148 26060 14316 1 20 . 1 1 86 86 LEU H H 86 9.900 9.900 8.843 1.057 26060 14317 1 20 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.537 0.563 26060 14318 1 20 . 1 1 87 87 PRO C C 87 175.340 175.340 175.847 -0.507 26060 14319 1 20 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.661 0.449 26060 14320 1 20 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.413 1.147 26060 14321 1 20 . 1 1 88 88 ILE N N 88 126.000 126.000 125.876 0.124 26060 14322 1 20 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.415 0.375 26060 14323 1 20 . 1 1 88 88 ILE C C 88 176.100 176.100 175.021 1.079 26060 14324 1 20 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.295 0.265 26060 14325 1 20 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.323 1.677 26060 14326 1 20 . 1 1 88 88 ILE H H 88 9.380 9.380 8.521 0.859 26060 14327 1 20 . 1 1 89 89 GLU N N 89 123.900 123.900 123.480 0.420 26060 14328 1 20 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.087 0.113 26060 14329 1 20 . 1 1 89 89 GLU C C 89 173.800 173.800 175.212 -1.412 26060 14330 1 20 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.255 -0.285 26060 14331 1 20 . 1 1 89 89 GLU CB C 89 34.380 34.380 32.835 1.545 26060 14332 1 20 . 1 1 89 89 GLU H H 89 9.320 9.320 8.852 0.468 26060 14333 1 20 . 1 1 90 90 VAL N N 90 123.980 123.980 123.204 0.776 26060 14334 1 20 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.072 0.088 26060 14335 1 20 . 1 1 90 90 VAL C C 90 174.800 174.800 174.697 0.103 26060 14336 1 20 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.185 0.805 26060 14337 1 20 . 1 1 90 90 VAL CB C 90 32.490 32.490 31.636 0.854 26060 14338 1 20 . 1 1 90 90 VAL H H 90 8.630 8.630 8.074 0.556 26060 14339 1 20 . 1 1 91 91 TYR N N 91 124.230 124.230 127.000 -2.770 26060 14340 1 20 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.323 0.337 26060 14341 1 20 . 1 1 91 91 TYR C C 91 176.800 176.800 175.738 1.062 26060 14342 1 20 . 1 1 91 91 TYR CA C 91 56.700 56.700 58.055 -1.355 26060 14343 1 20 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.988 1.252 26060 14344 1 20 . 1 1 91 91 TYR H H 91 8.640 8.640 8.894 -0.254 26060 14345 1 20 . 1 1 92 92 PHE N N 92 121.200 121.200 121.334 -0.134 26060 14346 1 20 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.281 0.379 26060 14347 1 20 . 1 1 92 92 PHE CA C 92 56.510 56.510 54.897 1.613 26060 14348 1 20 . 1 1 92 92 PHE CB C 92 42.700 42.700 42.731 -0.031 26060 14349 1 20 . 1 1 92 92 PHE H H 92 8.750 8.750 9.188 -0.438 26060 14350 1 20 . 1 1 93 93 LYS N N 93 123.450 123.450 121.935 1.515 26060 14351 1 20 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.686 -0.086 26060 14352 1 20 . 1 1 93 93 LYS C C 93 174.200 174.200 175.098 -0.898 26060 14353 1 20 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.524 -0.344 26060 14354 1 20 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.220 -0.540 26060 14355 1 20 . 1 1 93 93 LYS H H 93 8.560 8.560 8.907 -0.347 26060 14356 1 20 . 1 1 94 94 ASN N N 94 118.800 118.800 122.839 -4.039 26060 14357 1 20 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.713 -0.273 26060 14358 1 20 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.478 -1.268 26060 14359 1 20 . 1 1 94 94 ASN CB C 94 39.800 39.800 39.523 0.277 26060 14360 1 20 . 1 1 94 94 ASN H H 94 7.820 7.820 8.089 -0.269 26060 14361 1 20 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.475 -0.145 26060 14362 1 20 . 1 1 95 95 LYS C C 95 175.800 175.800 175.941 -0.141 26060 14363 1 20 . 1 1 95 95 LYS CA C 95 56.210 56.210 55.605 0.605 26060 14364 1 20 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.249 -0.239 26060 14365 1 20 . 1 1 96 96 GLU N N 96 118.330 118.330 119.606 -1.276 26060 14366 1 20 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.256 0.254 26060 14367 1 20 . 1 1 96 96 GLU C C 96 173.200 173.200 175.395 -2.195 26060 14368 1 20 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.267 -1.167 26060 14369 1 20 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.430 2.040 26060 14370 1 20 . 1 1 96 96 GLU H H 96 7.120 7.120 7.609 -0.489 26060 14371 1 20 . 1 1 97 97 GLU N N 97 115.630 115.630 119.234 -3.604 26060 14372 1 20 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.197 0.233 26060 14373 1 20 . 1 1 97 97 GLU CA C 97 54.860 54.860 55.687 -0.827 26060 14374 1 20 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.637 0.633 26060 14375 1 20 . 1 1 97 97 GLU H H 97 8.060 8.060 8.285 -0.225 26060 14376 1 20 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.263 0.737 26060 14377 1 20 . 1 1 98 98 PRO C C 98 175.900 175.900 176.388 -0.488 26060 14378 1 20 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.055 -1.895 26060 14379 1 20 . 1 1 98 98 PRO CB C 98 34.000 34.000 32.212 1.788 26060 14380 1 20 . 1 1 99 99 ARG N N 99 122.800 122.800 119.942 2.858 26060 14381 1 20 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.396 0.234 26060 14382 1 20 . 1 1 99 99 ARG C C 99 175.800 175.800 175.648 0.152 26060 14383 1 20 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.867 -0.377 26060 14384 1 20 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.694 -0.284 26060 14385 1 20 . 1 1 99 99 ARG H H 99 8.602 8.602 8.742 -0.140 26060 14386 1 20 . 1 1 100 100 LYS N N 100 113.220 113.220 116.396 -3.176 26060 14387 1 20 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.237 0.703 26060 14388 1 20 . 1 1 100 100 LYS C C 100 174.100 174.100 174.178 -0.078 26060 14389 1 20 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.429 -0.519 26060 14390 1 20 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.612 -0.892 26060 14391 1 20 . 1 1 100 100 LYS H H 100 7.650 7.650 7.424 0.226 26060 14392 1 20 . 1 1 101 101 VAL N N 101 116.230 116.230 121.413 -5.183 26060 14393 1 20 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.071 0.199 26060 14394 1 20 . 1 1 101 101 VAL C C 101 171.600 171.600 173.571 -1.971 26060 14395 1 20 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.174 1.086 26060 14396 1 20 . 1 1 101 101 VAL CB C 101 35.180 35.180 34.947 0.233 26060 14397 1 20 . 1 1 101 101 VAL H H 101 8.120 8.120 7.593 0.527 26060 14398 1 20 . 1 1 102 102 ARG N N 102 124.980 124.980 128.129 -3.149 26060 14399 1 20 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.615 0.545 26060 14400 1 20 . 1 1 102 102 ARG C C 102 174.340 174.340 175.260 -0.920 26060 14401 1 20 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.833 -1.083 26060 14402 1 20 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.143 2.207 26060 14403 1 20 . 1 1 102 102 ARG H H 102 7.930 7.930 8.267 -0.337 26060 14404 1 20 . 1 1 103 103 PHE N N 103 124.590 124.590 127.146 -2.556 26060 14405 1 20 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.728 0.064 26060 14406 1 20 . 1 1 103 103 PHE C C 103 174.280 174.280 174.962 -0.682 26060 14407 1 20 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.302 1.678 26060 14408 1 20 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.465 2.785 26060 14409 1 20 . 1 1 103 103 PHE H H 103 9.390 9.390 9.096 0.294 26060 14410 1 20 . 1 1 104 104 ASP N N 104 124.700 124.700 124.430 0.270 26060 14411 1 20 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.458 0.341 26060 14412 1 20 . 1 1 104 104 ASP C C 104 174.500 174.500 175.016 -0.516 26060 14413 1 20 . 1 1 104 104 ASP CA C 104 54.390 54.390 53.971 0.419 26060 14414 1 20 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.337 0.893 26060 14415 1 20 . 1 1 104 104 ASP H H 104 9.010 9.010 8.758 0.252 26060 14416 1 20 . 1 1 105 105 TYR N N 105 129.840 129.840 123.769 6.071 26060 14417 1 20 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.509 -0.409 26060 14418 1 20 . 1 1 105 105 TYR C C 105 173.100 173.100 173.807 -0.707 26060 14419 1 20 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.874 0.806 26060 14420 1 20 . 1 1 105 105 TYR CB C 105 41.850 41.850 41.128 0.722 26060 14421 1 20 . 1 1 105 105 TYR H H 105 8.140 8.140 8.257 -0.117 26060 14422 1 20 . 1 1 106 106 ASP N N 106 126.800 126.800 127.610 -0.810 26060 14423 1 20 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.424 -0.204 26060 14424 1 20 . 1 1 106 106 ASP C C 106 172.900 172.900 174.610 -1.710 26060 14425 1 20 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.386 0.124 26060 14426 1 20 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.143 -1.643 26060 14427 1 20 . 1 1 106 106 ASP H H 106 7.730 7.730 8.300 -0.570 26060 14428 1 20 . 1 1 107 107 LEU N N 107 132.150 132.150 128.328 3.822 26060 14429 1 20 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.434 -0.594 26060 14430 1 20 . 1 1 107 107 LEU C C 107 172.100 172.100 174.842 -2.742 26060 14431 1 20 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.856 -0.156 26060 14432 1 20 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.547 -1.308 26060 14433 1 20 . 1 1 107 107 LEU H H 107 7.770 7.770 7.578 0.192 26060 14434 1 20 . 1 1 108 108 PHE N N 108 118.960 118.960 122.036 -3.076 26060 14435 1 20 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.907 -0.217 26060 14436 1 20 . 1 1 108 108 PHE C C 108 174.300 174.300 173.725 0.575 26060 14437 1 20 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.434 -0.745 26060 14438 1 20 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.760 -0.470 26060 14439 1 20 . 1 1 108 108 PHE H H 108 6.060 6.060 7.146 -1.086 26060 14440 1 20 . 1 1 109 109 LEU N N 109 118.900 118.900 121.837 -2.937 26060 14441 1 20 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.834 -0.434 26060 14442 1 20 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.209 -1.049 26060 14443 1 20 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.904 -1.824 26060 14444 1 20 . 1 1 109 109 LEU H H 109 8.388 8.388 8.235 0.153 26060 14445 1 20 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.363 0.077 26060 14446 1 20 . 1 1 111 111 LEU C C 111 177.300 177.300 176.941 0.359 26060 14447 1 20 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.241 -1.021 26060 14448 1 20 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.516 1.354 26060 14449 1 20 . 1 1 112 112 GLU N N 112 120.660 120.660 123.155 -2.495 26060 14450 1 20 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.050 0.120 26060 14451 1 20 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.346 0.114 26060 14452 1 20 . 1 1 112 112 GLU CB C 112 29.690 29.690 30.180 -0.490 26060 14453 1 20 . 1 1 112 112 GLU H H 112 8.780 8.780 8.652 0.128 26060 14454 1 20 . 1 1 113 113 GLY C C 113 173.900 173.900 173.780 0.120 26060 14455 1 20 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.998 -0.048 26060 14456 1 20 . 1 1 114 114 HIS N N 114 120.890 120.890 118.524 2.366 26060 14457 1 20 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.033 -0.127 26060 14458 1 20 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.162 1.608 26060 14459 1 20 . 1 1 114 114 HIS CB C 114 30.590 30.590 30.346 0.244 26060 14460 1 20 . 1 1 114 114 HIS H H 114 7.934 7.934 7.662 0.272 26060 14461 1 20 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.594 0.206 26060 14462 1 20 . 1 1 115 115 PRO CA C 115 62.090 62.090 60.929 1.161 26060 14463 1 20 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.948 -1.268 26060 14464 1 20 . 1 1 116 116 PRO C C 116 176.600 176.600 175.628 0.972 26060 14465 1 20 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.318 -0.018 26060 14466 1 20 . 1 1 117 117 VAL N N 117 127.480 127.480 126.678 0.802 26060 14467 1 20 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.369 -0.579 26060 14468 1 20 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.914 0.785 26060 14469 1 20 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.622 -0.422 26060 14470 1 20 . 1 1 117 117 VAL H H 117 8.890 8.890 8.028 0.862 26060 14471 1 20 . 1 1 118 118 ASN HA H 118 4.990 4.990 5.002 -0.012 26060 14472 1 20 . 1 1 118 118 ASN C C 118 172.700 172.700 173.595 -0.895 26060 14473 1 20 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.564 -0.204 26060 14474 1 20 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.013 -0.813 26060 14475 1 20 . 1 1 119 119 HIS N N 119 124.930 124.930 126.053 -1.123 26060 14476 1 20 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.070 -0.250 26060 14477 1 20 . 1 1 119 119 HIS C C 119 173.500 173.500 172.846 0.654 26060 14478 1 20 . 1 1 119 119 HIS CA C 119 56.970 56.970 54.893 2.077 26060 14479 1 20 . 1 1 119 119 HIS CB C 119 34.670 34.670 33.935 0.735 26060 14480 1 20 . 1 1 119 119 HIS H H 119 8.790 8.790 9.029 -0.239 26060 14481 1 20 . 1 1 120 120 LEU N N 120 128.280 128.280 124.777 3.503 26060 14482 1 20 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.049 -0.099 26060 14483 1 20 . 1 1 120 120 LEU C C 120 174.030 174.030 175.528 -1.498 26060 14484 1 20 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.513 0.927 26060 14485 1 20 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.034 0.566 26060 14486 1 20 . 1 1 120 120 LEU H H 120 7.460 7.460 8.516 -1.056 26060 14487 1 20 . 1 1 121 121 ARG N N 121 128.060 128.060 123.145 4.915 26060 14488 1 20 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.680 -0.040 26060 14489 1 20 . 1 1 121 121 ARG C C 121 173.400 173.400 173.679 -0.279 26060 14490 1 20 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.258 0.102 26060 14491 1 20 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.454 1.806 26060 14492 1 20 . 1 1 121 121 ARG H H 121 9.860 9.860 8.879 0.981 26060 14493 1 20 . 1 1 122 122 CYS N N 122 125.290 125.290 118.083 7.207 26060 14494 1 20 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.020 -0.000 26060 14495 1 20 . 1 1 122 122 CYS C C 122 174.600 174.600 173.975 0.625 26060 14496 1 20 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.623 1.667 26060 14497 1 20 . 1 1 122 122 CYS CB C 122 28.030 28.030 30.308 -2.278 26060 14498 1 20 . 1 1 122 122 CYS H H 122 8.835 8.835 8.638 0.197 26060 14499 1 20 . 1 1 123 123 GLU N N 123 125.920 125.920 124.609 1.311 26060 14500 1 20 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.552 0.128 26060 14501 1 20 . 1 1 123 123 GLU C C 123 174.500 174.500 174.453 0.047 26060 14502 1 20 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.742 -0.322 26060 14503 1 20 . 1 1 123 123 GLU CB C 123 32.583 32.583 32.945 -0.362 26060 14504 1 20 . 1 1 123 123 GLU H H 123 8.970 8.970 8.544 0.426 26060 14505 1 20 . 1 1 124 124 LYS N N 124 121.837 121.837 122.410 -0.573 26060 14506 1 20 . 1 1 124 124 LYS HA H 124 4.960 4.960 5.020 -0.060 26060 14507 1 20 . 1 1 124 124 LYS C C 124 175.700 175.700 175.691 0.009 26060 14508 1 20 . 1 1 124 124 LYS CA C 124 55.357 55.357 54.923 0.434 26060 14509 1 20 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.900 -0.711 26060 14510 1 20 . 1 1 124 124 LYS H H 124 8.652 8.652 8.368 0.284 26060 14511 1 20 . 1 1 125 125 LEU N N 125 127.000 127.000 128.785 -1.785 26060 14512 1 20 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.632 0.018 26060 14513 1 20 . 1 1 125 125 LEU C C 125 175.110 175.110 175.466 -0.356 26060 14514 1 20 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.894 -0.040 26060 14515 1 20 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.802 0.465 26060 14516 1 20 . 1 1 125 125 LEU H H 125 9.175 9.175 9.170 0.005 26060 14517 1 20 . 1 1 126 126 THR N N 126 117.779 117.779 119.353 -1.574 26060 14518 1 20 . 1 1 126 126 THR HA H 126 4.650 4.650 4.624 0.026 26060 14519 1 20 . 1 1 126 126 THR C C 126 173.200 173.200 173.539 -0.339 26060 14520 1 20 . 1 1 126 126 THR CA C 126 62.036 62.036 61.373 0.663 26060 14521 1 20 . 1 1 126 126 THR CB C 126 70.284 70.284 69.429 0.855 26060 14522 1 20 . 1 1 126 126 THR H H 126 8.331 8.331 8.388 -0.057 26060 14523 1 20 . 1 1 127 127 PHE N N 127 126.576 126.576 125.769 0.807 26060 14524 1 20 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.682 -0.092 26060 14525 1 20 . 1 1 127 127 PHE C C 127 174.860 174.860 174.337 0.523 26060 14526 1 20 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.625 0.239 26060 14527 1 20 . 1 1 127 127 PHE CB C 127 39.000 39.000 40.006 -1.006 26060 14528 1 20 . 1 1 127 127 PHE H H 127 9.051 9.051 8.965 0.086 26060 14529 1 20 . 1 1 128 128 ASN N N 128 123.040 123.040 124.069 -1.029 26060 14530 1 20 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.720 -0.100 26060 14531 1 20 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.909 0.571 26060 14532 1 20 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.923 0.537 26060 14533 1 20 . 1 1 128 128 ASN H H 128 8.880 8.880 8.795 0.085 26060 14534 1 20 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.572 0.188 26060 14535 1 20 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.473 -0.573 26060 14536 1 20 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.400 1.330 26060 14537 1 20 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.703 0.087 26060 14538 1 20 . 1 1 130 130 PRO C C 130 177.470 177.470 176.240 1.230 26060 14539 1 20 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.349 0.225 26060 14540 1 20 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.435 -1.125 26060 14541 1 20 . 1 1 131 131 THR N N 131 113.400 113.400 114.798 -1.398 26060 14542 1 20 . 1 1 131 131 THR HA H 131 4.300 4.300 4.199 0.101 26060 14543 1 20 . 1 1 131 131 THR C C 131 175.200 175.200 176.006 -0.806 26060 14544 1 20 . 1 1 131 131 THR CA C 131 62.200 62.200 62.771 -0.571 26060 14545 1 20 . 1 1 131 131 THR CB C 131 70.600 70.600 70.622 -0.022 26060 14546 1 20 . 1 1 131 131 THR H H 131 8.950 8.950 9.320 -0.370 26060 14547 1 20 . 1 1 132 132 GLU N N 132 122.199 122.199 126.824 -4.625 26060 14548 1 20 . 1 1 132 132 GLU HA H 132 4.010 4.010 4.037 -0.027 26060 14549 1 20 . 1 1 132 132 GLU C C 132 178.700 178.700 178.286 0.414 26060 14550 1 20 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.315 -0.021 26060 14551 1 20 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.688 -0.527 26060 14552 1 20 . 1 1 132 132 GLU H H 132 8.932 8.932 9.061 -0.129 26060 14553 1 20 . 1 1 133 133 ASP N N 133 116.324 116.324 119.576 -3.252 26060 14554 1 20 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.379 -0.049 26060 14555 1 20 . 1 1 133 133 ASP C C 133 177.800 177.800 178.500 -0.700 26060 14556 1 20 . 1 1 133 133 ASP CA C 133 57.546 57.546 58.045 -0.499 26060 14557 1 20 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.577 1.246 26060 14558 1 20 . 1 1 133 133 ASP H H 133 8.490 8.490 8.028 0.462 26060 14559 1 20 . 1 1 134 134 PHE N N 134 119.914 119.914 121.379 -1.465 26060 14560 1 20 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.242 0.368 26060 14561 1 20 . 1 1 134 134 PHE C C 134 177.300 177.300 177.111 0.189 26060 14562 1 20 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.682 -0.144 26060 14563 1 20 . 1 1 134 134 PHE CB C 134 39.200 39.200 39.005 0.195 26060 14564 1 20 . 1 1 134 134 PHE H H 134 7.787 7.787 7.439 0.348 26060 14565 1 20 . 1 1 135 135 ARG N N 135 119.794 119.794 119.715 0.079 26060 14566 1 20 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.621 -0.271 26060 14567 1 20 . 1 1 135 135 ARG C C 135 177.370 177.370 178.356 -0.986 26060 14568 1 20 . 1 1 135 135 ARG CA C 135 60.376 60.376 60.068 0.308 26060 14569 1 20 . 1 1 135 135 ARG CB C 135 30.396 30.396 30.079 0.317 26060 14570 1 20 . 1 1 135 135 ARG H H 135 9.087 9.087 8.421 0.666 26060 14571 1 20 . 1 1 136 136 ARG N N 136 114.554 114.554 118.481 -3.927 26060 14572 1 20 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.880 -0.060 26060 14573 1 20 . 1 1 136 136 ARG C C 136 178.950 178.950 178.747 0.203 26060 14574 1 20 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.906 -0.106 26060 14575 1 20 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.081 0.136 26060 14576 1 20 . 1 1 136 136 ARG H H 136 7.747 7.747 8.454 -0.707 26060 14577 1 20 . 1 1 137 137 LYS N N 137 118.298 118.298 119.584 -1.286 26060 14578 1 20 . 1 1 137 137 LYS HA H 137 3.900 3.900 3.986 -0.086 26060 14579 1 20 . 1 1 137 137 LYS C C 137 177.980 177.980 178.967 -0.987 26060 14580 1 20 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.606 0.789 26060 14581 1 20 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.362 0.085 26060 14582 1 20 . 1 1 137 137 LYS H H 137 7.154 7.154 7.499 -0.345 26060 14583 1 20 . 1 1 138 138 LEU N N 138 117.159 117.159 118.612 -1.453 26060 14584 1 20 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.674 -0.254 26060 14585 1 20 . 1 1 138 138 LEU C C 138 179.100 179.100 178.696 0.404 26060 14586 1 20 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.277 -0.046 26060 14587 1 20 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.313 1.015 26060 14588 1 20 . 1 1 138 138 LEU H H 138 7.709 7.709 7.778 -0.069 26060 14589 1 20 . 1 1 139 139 LEU N N 139 115.158 115.158 117.105 -1.947 26060 14590 1 20 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.080 0.070 26060 14591 1 20 . 1 1 139 139 LEU C C 139 177.600 177.600 178.713 -1.113 26060 14592 1 20 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.688 -1.159 26060 14593 1 20 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.825 -0.081 26060 14594 1 20 . 1 1 139 139 LEU H H 139 7.507 7.507 7.788 -0.281 26060 14595 1 20 . 1 1 140 140 LYS N N 140 120.256 120.256 118.429 1.827 26060 14596 1 20 . 1 1 140 140 LYS HA H 140 4.110 4.110 3.966 0.144 26060 14597 1 20 . 1 1 140 140 LYS C C 140 175.800 175.800 177.176 -1.376 26060 14598 1 20 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.730 -0.678 26060 14599 1 20 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.242 0.404 26060 14600 1 20 . 1 1 140 140 LYS H H 140 7.304 7.304 7.696 -0.392 26060 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 114 3.521 1.037 3.380 26060 2 1 1 "Average Difference" HA 139 0.334 0.037 0.333 26060 3 1 1 "Average Difference" C 110 1.008 0.340 0.953 26060 4 1 1 "Average Difference" CA 135 0.989 -0.171 0.978 26060 5 1 1 "Average Difference" CB 130 1.330 -0.137 1.328 26060 6 1 1 "Average Difference" HN 114 0.536 0.048 0.536 26060 7 1 2 "Average Difference" N 114 3.457 0.973 3.332 26060 8 1 2 "Average Difference" HA 139 0.317 0.018 0.317 26060 9 1 2 "Average Difference" C 110 1.053 0.326 1.005 26060 10 1 2 "Average Difference" CA 135 1.004 -0.202 0.987 26060 11 1 2 "Average Difference" CB 130 1.351 -0.094 1.353 26060 12 1 2 "Average Difference" HN 114 0.545 -0.007 0.547 26060 13 1 3 "Average Difference" N 114 3.537 1.045 3.394 26060 14 1 3 "Average Difference" HA 139 0.326 0.041 0.324 26060 15 1 3 "Average Difference" C 110 1.026 0.341 0.972 26060 16 1 3 "Average Difference" CA 135 1.003 -0.178 0.991 26060 17 1 3 "Average Difference" CB 130 1.328 -0.101 1.330 26060 18 1 3 "Average Difference" HN 114 0.537 0.032 0.539 26060 19 1 4 "Average Difference" N 114 3.614 1.097 3.459 26060 20 1 4 "Average Difference" HA 139 0.315 0.023 0.315 26060 21 1 4 "Average Difference" C 110 0.990 0.368 0.923 26060 22 1 4 "Average Difference" CA 135 1.018 -0.169 1.007 26060 23 1 4 "Average Difference" CB 130 1.331 -0.162 1.326 26060 24 1 4 "Average Difference" HN 114 0.528 0.027 0.530 26060 25 1 5 "Average Difference" N 114 3.484 0.890 3.384 26060 26 1 5 "Average Difference" HA 139 0.318 0.037 0.317 26060 27 1 5 "Average Difference" C 110 1.027 0.331 0.977 26060 28 1 5 "Average Difference" CA 135 0.993 -0.191 0.978 26060 29 1 5 "Average Difference" CB 130 1.298 -0.067 1.301 26060 30 1 5 "Average Difference" HN 114 0.534 0.019 0.536 26060 31 1 6 "Average Difference" N 114 3.654 1.122 3.493 26060 32 1 6 "Average Difference" HA 139 0.311 0.015 0.312 26060 33 1 6 "Average Difference" C 110 0.977 0.317 0.928 26060 34 1 6 "Average Difference" CA 135 1.025 -0.208 1.007 26060 35 1 6 "Average Difference" CB 130 1.357 -0.162 1.352 26060 36 1 6 "Average Difference" HN 114 0.523 0.018 0.525 26060 37 1 7 "Average Difference" N 114 3.536 1.063 3.388 26060 38 1 7 "Average Difference" HA 139 0.324 0.022 0.325 26060 39 1 7 "Average Difference" C 110 1.059 0.355 1.003 26060 40 1 7 "Average Difference" CA 135 1.044 -0.183 1.032 26060 41 1 7 "Average Difference" CB 130 1.365 -0.162 1.360 26060 42 1 7 "Average Difference" HN 114 0.538 0.017 0.540 26060 43 1 8 "Average Difference" N 114 3.587 0.941 3.477 26060 44 1 8 "Average Difference" HA 139 0.309 0.029 0.309 26060 45 1 8 "Average Difference" C 110 1.016 0.330 0.965 26060 46 1 8 "Average Difference" CA 135 1.025 -0.233 1.001 26060 47 1 8 "Average Difference" CB 130 1.326 -0.119 1.326 26060 48 1 8 "Average Difference" HN 114 0.521 0.019 0.523 26060 49 1 9 "Average Difference" N 114 3.603 0.991 3.479 26060 50 1 9 "Average Difference" HA 139 0.325 0.022 0.325 26060 51 1 9 "Average Difference" C 110 1.057 0.339 1.006 26060 52 1 9 "Average Difference" CA 135 1.068 -0.219 1.049 26060 53 1 9 "Average Difference" CB 130 1.359 -0.142 1.357 26060 54 1 9 "Average Difference" HN 114 0.545 0.009 0.547 26060 55 1 10 "Average Difference" N 114 3.535 1.035 3.395 26060 56 1 10 "Average Difference" HA 139 0.310 0.014 0.311 26060 57 1 10 "Average Difference" C 110 1.036 0.337 0.984 26060 58 1 10 "Average Difference" CA 135 0.999 -0.150 0.992 26060 59 1 10 "Average Difference" CB 130 1.361 -0.214 1.350 26060 60 1 10 "Average Difference" HN 114 0.524 -0.007 0.527 26060 61 1 11 "Average Difference" N 114 3.561 1.003 3.432 26060 62 1 11 "Average Difference" HA 139 0.305 0.030 0.305 26060 63 1 11 "Average Difference" C 110 1.095 0.367 1.036 26060 64 1 11 "Average Difference" CA 135 1.048 -0.187 1.035 26060 65 1 11 "Average Difference" CB 130 1.309 -0.111 1.309 26060 66 1 11 "Average Difference" HN 114 0.527 0.019 0.529 26060 67 1 12 "Average Difference" N 114 3.562 0.874 3.469 26060 68 1 12 "Average Difference" HA 139 0.311 0.033 0.311 26060 69 1 12 "Average Difference" C 110 1.058 0.348 1.004 26060 70 1 12 "Average Difference" CA 135 1.014 -0.193 0.999 26060 71 1 12 "Average Difference" CB 130 1.356 -0.114 1.357 26060 72 1 12 "Average Difference" HN 114 0.532 0.013 0.534 26060 73 1 13 "Average Difference" N 114 3.571 1.047 3.430 26060 74 1 13 "Average Difference" HA 139 0.319 0.006 0.320 26060 75 1 13 "Average Difference" C 110 1.022 0.378 0.953 26060 76 1 13 "Average Difference" CA 135 0.978 -0.134 0.972 26060 77 1 13 "Average Difference" CB 130 1.337 -0.206 1.326 26060 78 1 13 "Average Difference" HN 114 0.517 0.016 0.519 26060 79 1 14 "Average Difference" N 114 3.455 0.910 3.348 26060 80 1 14 "Average Difference" HA 139 0.323 0.006 0.324 26060 81 1 14 "Average Difference" C 110 1.068 0.392 0.998 26060 82 1 14 "Average Difference" CA 135 1.078 -0.174 1.067 26060 83 1 14 "Average Difference" CB 130 1.339 -0.200 1.329 26060 84 1 14 "Average Difference" HN 114 0.536 0.010 0.538 26060 85 1 15 "Average Difference" N 114 3.454 1.068 3.299 26060 86 1 15 "Average Difference" HA 139 0.312 0.023 0.313 26060 87 1 15 "Average Difference" C 110 1.054 0.374 0.990 26060 88 1 15 "Average Difference" CA 135 1.013 -0.197 0.997 26060 89 1 15 "Average Difference" CB 130 1.357 -0.107 1.358 26060 90 1 15 "Average Difference" HN 114 0.537 0.004 0.539 26060 91 1 16 "Average Difference" N 114 3.522 1.018 3.386 26060 92 1 16 "Average Difference" HA 139 0.314 0.025 0.314 26060 93 1 16 "Average Difference" C 110 1.012 0.313 0.967 26060 94 1 16 "Average Difference" CA 135 1.023 -0.182 1.010 26060 95 1 16 "Average Difference" CB 130 1.333 -0.152 1.330 26060 96 1 16 "Average Difference" HN 114 0.527 0.001 0.529 26060 97 1 17 "Average Difference" N 114 3.586 1.038 3.448 26060 98 1 17 "Average Difference" HA 139 0.309 0.001 0.310 26060 99 1 17 "Average Difference" C 110 0.991 0.354 0.930 26060 100 1 17 "Average Difference" CA 135 1.046 -0.178 1.035 26060 101 1 17 "Average Difference" CB 130 1.403 -0.196 1.394 26060 102 1 17 "Average Difference" HN 114 0.520 0.022 0.522 26060 103 1 18 "Average Difference" N 114 3.531 0.749 3.466 26060 104 1 18 "Average Difference" HA 139 0.316 0.027 0.316 26060 105 1 18 "Average Difference" C 110 0.999 0.342 0.942 26060 106 1 18 "Average Difference" CA 135 1.040 -0.192 1.026 26060 107 1 18 "Average Difference" CB 130 1.370 -0.133 1.369 26060 108 1 18 "Average Difference" HN 114 0.523 0.017 0.525 26060 109 1 19 "Average Difference" N 114 3.516 0.829 3.432 26060 110 1 19 "Average Difference" HA 139 0.331 0.004 0.333 26060 111 1 19 "Average Difference" C 110 1.051 0.324 1.004 26060 112 1 19 "Average Difference" CA 135 1.064 -0.208 1.047 26060 113 1 19 "Average Difference" CB 130 1.438 -0.169 1.433 26060 114 1 19 "Average Difference" HN 114 0.562 -0.011 0.564 26060 115 1 20 "Average Difference" N 114 3.520 0.833 3.435 26060 116 1 20 "Average Difference" HA 139 0.314 0.012 0.315 26060 117 1 20 "Average Difference" C 110 1.017 0.330 0.966 26060 118 1 20 "Average Difference" CA 135 0.999 -0.142 0.992 26060 119 1 20 "Average Difference" CB 130 1.343 -0.132 1.341 26060 120 1 20 "Average Difference" HN 114 0.531 -0.019 0.533 26060 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 26060 _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 4 4 MET C C 4 175.800 175.800 175.879 -0.079 26060 2 1 . 1 1 4 4 MET CA C 4 55.350 55.350 55.515 -0.165 26060 3 1 . 1 1 4 4 MET CB C 4 32.880 32.880 32.841 0.039 26060 4 1 . 1 1 5 5 ALA N N 5 125.230 125.230 123.355 1.875 26060 5 1 . 1 1 5 5 ALA HA H 5 4.350 4.350 4.321 0.029 26060 6 1 . 1 1 5 5 ALA CA C 5 52.430 52.430 52.403 0.027 26060 7 1 . 1 1 5 5 ALA CB C 5 19.370 19.370 19.207 0.163 26060 8 1 . 1 1 5 5 ALA H H 5 8.320 8.320 8.224 0.096 26060 9 1 . 1 1 6 6 SER HA H 6 4.490 4.490 4.544 -0.054 26060 10 1 . 1 1 6 6 SER CA C 6 58.200 58.200 57.697 0.503 26060 11 1 . 1 1 6 6 SER CB C 6 63.700 63.700 63.572 0.128 26060 12 1 . 1 1 7 7 SER HA H 7 4.530 4.530 4.668 -0.138 26060 13 1 . 1 1 7 7 SER CA C 7 58.200 58.200 58.292 -0.092 26060 14 1 . 1 1 7 7 SER CB C 7 63.700 63.700 63.362 0.338 26060 15 1 . 1 1 8 8 CYS HA H 8 4.610 4.610 4.679 -0.069 26060 16 1 . 1 1 8 8 CYS C C 8 173.500 173.500 173.267 0.233 26060 17 1 . 1 1 8 8 CYS CA C 8 58.340 58.340 57.258 1.082 26060 18 1 . 1 1 8 8 CYS CB C 8 28.490 28.490 29.444 -0.954 26060 19 1 . 1 1 9 9 ALA N N 9 124.700 124.700 128.182 -3.482 26060 20 1 . 1 1 9 9 ALA HA H 9 4.790 4.790 4.982 -0.192 26060 21 1 . 1 1 9 9 ALA C C 9 177.400 177.400 176.761 0.639 26060 22 1 . 1 1 9 9 ALA CA C 9 52.070 52.070 50.989 1.081 26060 23 1 . 1 1 9 9 ALA CB C 9 20.629 20.629 19.831 0.798 26060 24 1 . 1 1 9 9 ALA H H 9 7.960 7.960 8.475 -0.515 26060 25 1 . 1 1 10 10 VAL N N 10 120.124 120.124 124.891 -4.767 26060 26 1 . 1 1 10 10 VAL HA H 10 4.290 4.290 4.166 0.124 26060 27 1 . 1 1 10 10 VAL C C 10 173.900 173.900 175.062 -1.162 26060 28 1 . 1 1 10 10 VAL CA C 10 61.550 61.550 61.609 -0.059 26060 29 1 . 1 1 10 10 VAL CB C 10 34.900 34.900 32.584 2.316 26060 30 1 . 1 1 10 10 VAL H H 10 8.424 8.424 8.533 -0.109 26060 31 1 . 1 1 11 11 GLN N N 11 125.818 125.818 126.669 -0.851 26060 32 1 . 1 1 11 11 GLN HA H 11 5.560 5.560 5.370 0.190 26060 33 1 . 1 1 11 11 GLN C C 11 175.400 175.400 175.242 0.158 26060 34 1 . 1 1 11 11 GLN CA C 11 54.123 54.123 54.422 -0.299 26060 35 1 . 1 1 11 11 GLN CB C 11 32.029 32.029 30.543 1.486 26060 36 1 . 1 1 11 11 GLN H H 11 8.636 8.636 8.561 0.075 26060 37 1 . 1 1 12 12 VAL N N 12 119.106 119.106 119.071 0.035 26060 38 1 . 1 1 12 12 VAL HA H 12 4.630 4.630 4.382 0.248 26060 39 1 . 1 1 12 12 VAL C C 12 173.800 173.800 174.668 -0.868 26060 40 1 . 1 1 12 12 VAL CA C 12 59.800 59.800 59.440 0.360 26060 41 1 . 1 1 12 12 VAL CB C 12 35.711 35.711 33.712 1.999 26060 42 1 . 1 1 12 12 VAL H H 12 8.827 8.827 8.840 -0.013 26060 43 1 . 1 1 13 13 LYS N N 13 121.700 121.700 125.657 -3.957 26060 44 1 . 1 1 13 13 LYS HA H 13 5.200 5.200 5.283 -0.083 26060 45 1 . 1 1 13 13 LYS C C 13 175.030 175.030 175.819 -0.789 26060 46 1 . 1 1 13 13 LYS CA C 13 55.430 55.430 55.041 0.389 26060 47 1 . 1 1 13 13 LYS CB C 13 35.920 35.920 34.239 1.681 26060 48 1 . 1 1 13 13 LYS H H 13 8.234 8.234 8.555 -0.321 26060 49 1 . 1 1 14 14 LEU N N 14 119.100 119.100 124.943 -5.843 26060 50 1 . 1 1 14 14 LEU HA H 14 4.950 4.950 5.272 -0.322 26060 51 1 . 1 1 14 14 LEU C C 14 175.110 175.110 175.466 -0.356 26060 52 1 . 1 1 14 14 LEU CA C 14 53.357 53.357 53.433 -0.076 26060 53 1 . 1 1 14 14 LEU CB C 14 46.921 46.921 45.804 1.117 26060 54 1 . 1 1 14 14 LEU H H 14 8.840 8.840 8.489 0.351 26060 55 1 . 1 1 15 15 GLU N N 15 120.978 120.978 122.227 -1.249 26060 56 1 . 1 1 15 15 GLU HA H 15 4.990 4.990 5.125 -0.135 26060 57 1 . 1 1 15 15 GLU C C 15 173.800 173.800 174.858 -1.058 26060 58 1 . 1 1 15 15 GLU CA C 15 55.428 55.428 54.679 0.749 26060 59 1 . 1 1 15 15 GLU CB C 15 31.826 31.826 33.047 -1.221 26060 60 1 . 1 1 15 15 GLU H H 15 9.181 9.181 9.262 -0.081 26060 61 1 . 1 1 16 16 LEU N N 16 124.438 124.438 126.352 -1.914 26060 62 1 . 1 1 16 16 LEU HA H 16 5.110 5.110 5.211 -0.101 26060 63 1 . 1 1 16 16 LEU C C 16 174.700 174.700 176.148 -1.448 26060 64 1 . 1 1 16 16 LEU CA C 16 53.076 53.076 52.721 0.355 26060 65 1 . 1 1 16 16 LEU CB C 16 44.892 44.892 42.606 2.286 26060 66 1 . 1 1 16 16 LEU H H 16 8.891 8.891 8.729 0.162 26060 67 1 . 1 1 17 17 GLY N N 17 108.067 108.067 108.646 -0.579 26060 68 1 . 1 1 17 17 GLY C C 17 170.350 170.350 172.213 -1.863 26060 69 1 . 1 1 17 17 GLY CA C 17 46.984 46.984 45.221 1.763 26060 70 1 . 1 1 17 17 GLY H H 17 7.227 7.227 8.367 -1.140 26060 71 1 . 1 1 18 18 HIS N N 18 111.200 111.200 118.923 -7.723 26060 72 1 . 1 1 18 18 HIS HA H 18 5.620 5.620 5.829 -0.209 26060 73 1 . 1 1 18 18 HIS C C 18 172.400 172.400 172.718 -0.318 26060 74 1 . 1 1 18 18 HIS CA C 18 54.940 54.940 55.647 -0.707 26060 75 1 . 1 1 18 18 HIS CB C 18 34.160 34.160 32.658 1.502 26060 76 1 . 1 1 18 18 HIS H H 18 8.150 8.150 9.098 -0.948 26060 77 1 . 1 1 19 19 ARG N N 19 117.800 117.800 121.888 -4.088 26060 78 1 . 1 1 19 19 ARG HA H 19 5.100 5.100 4.845 0.255 26060 79 1 . 1 1 19 19 ARG C C 19 175.800 175.800 174.206 1.594 26060 80 1 . 1 1 19 19 ARG CA C 19 53.500 53.500 54.014 -0.514 26060 81 1 . 1 1 19 19 ARG CB C 19 34.650 34.650 35.033 -0.383 26060 82 1 . 1 1 19 19 ARG H H 19 9.010 9.010 8.949 0.060 26060 83 1 . 1 1 20 20 ALA N N 20 120.390 120.390 122.074 -1.684 26060 84 1 . 1 1 20 20 ALA HA H 20 5.530 5.530 5.556 -0.026 26060 85 1 . 1 1 20 20 ALA C C 20 175.800 175.800 175.133 0.667 26060 86 1 . 1 1 20 20 ALA CA C 20 52.190 52.190 50.917 1.273 26060 87 1 . 1 1 20 20 ALA CB C 20 23.750 23.750 23.081 0.669 26060 88 1 . 1 1 20 20 ALA H H 20 8.070 8.070 8.410 -0.340 26060 89 1 . 1 1 21 21 GLN N N 21 121.790 121.790 121.556 0.234 26060 90 1 . 1 1 21 21 GLN HA H 21 5.230 5.230 4.964 0.266 26060 91 1 . 1 1 21 21 GLN CA C 21 54.330 54.330 54.297 0.033 26060 92 1 . 1 1 21 21 GLN CB C 21 32.900 32.900 33.016 -0.116 26060 93 1 . 1 1 21 21 GLN H H 21 9.240 9.240 9.127 0.113 26060 94 1 . 1 1 22 22 VAL HA H 22 3.630 3.630 4.509 -0.879 26060 95 1 . 1 1 22 22 VAL C C 22 176.500 176.500 175.415 1.085 26060 96 1 . 1 1 22 22 VAL CA C 22 63.030 63.030 60.154 2.876 26060 97 1 . 1 1 22 22 VAL CB C 22 31.600 31.600 33.670 -2.070 26060 98 1 . 1 1 23 23 ARG N N 23 127.840 127.840 127.016 0.824 26060 99 1 . 1 1 23 23 ARG HA H 23 4.130 4.130 4.579 -0.450 26060 100 1 . 1 1 23 23 ARG CA C 23 56.600 56.600 55.205 1.395 26060 101 1 . 1 1 23 23 ARG CB C 23 32.150 32.150 30.883 1.267 26060 102 1 . 1 1 23 23 ARG H H 23 8.720 8.720 8.367 0.353 26060 103 1 . 1 1 24 24 LYS HA H 24 4.040 4.040 4.142 -0.102 26060 104 1 . 1 1 24 24 LYS C C 24 176.960 176.960 176.294 0.666 26060 105 1 . 1 1 24 24 LYS CA C 24 58.800 58.800 57.871 0.929 26060 106 1 . 1 1 24 24 LYS CB C 24 32.060 32.060 32.510 -0.450 26060 107 1 . 1 1 25 25 LYS N N 25 115.870 115.870 119.185 -3.315 26060 108 1 . 1 1 25 25 LYS HA H 25 4.830 4.830 4.661 0.169 26060 109 1 . 1 1 25 25 LYS CA C 25 52.960 52.960 53.289 -0.329 26060 110 1 . 1 1 25 25 LYS CB C 25 35.080 35.080 33.619 1.461 26060 111 1 . 1 1 25 25 LYS H H 25 7.720 7.720 7.614 0.106 26060 112 1 . 1 1 26 26 PRO HA H 26 4.830 4.830 4.675 0.155 26060 113 1 . 1 1 26 26 PRO C C 26 177.400 177.400 176.882 0.518 26060 114 1 . 1 1 26 26 PRO CA C 26 62.650 62.650 62.710 -0.060 26060 115 1 . 1 1 26 26 PRO CB C 26 32.390 32.390 32.459 -0.068 26060 116 1 . 1 1 27 27 THR N N 27 111.270 111.270 114.527 -3.257 26060 117 1 . 1 1 27 27 THR HA H 27 4.530 4.530 4.229 0.300 26060 118 1 . 1 1 27 27 THR C C 27 177.300 177.300 176.898 0.402 26060 119 1 . 1 1 27 27 THR CA C 27 61.300 61.300 61.079 0.221 26060 120 1 . 1 1 27 27 THR CB C 27 71.460 71.460 69.988 1.472 26060 121 1 . 1 1 27 27 THR H H 27 8.380 8.380 8.113 0.267 26060 122 1 . 1 1 28 28 VAL N N 28 121.170 121.170 122.685 -1.515 26060 123 1 . 1 1 28 28 VAL HA H 28 3.883 3.883 3.807 0.076 26060 124 1 . 1 1 28 28 VAL C C 28 177.030 177.030 176.072 0.958 26060 125 1 . 1 1 28 28 VAL CA C 28 65.200 65.200 65.114 0.086 26060 126 1 . 1 1 28 28 VAL CB C 28 31.400 31.400 31.648 -0.248 26060 127 1 . 1 1 28 28 VAL H H 28 8.910 8.910 8.535 0.375 26060 128 1 . 1 1 29 29 GLU N N 29 116.800 116.800 117.597 -0.797 26060 129 1 . 1 1 29 29 GLU HA H 29 3.920 3.920 4.149 -0.229 26060 130 1 . 1 1 29 29 GLU C C 29 176.200 176.200 175.900 0.300 26060 131 1 . 1 1 29 29 GLU CA C 29 57.250 57.250 55.376 1.874 26060 132 1 . 1 1 29 29 GLU CB C 29 28.170 28.170 29.342 -1.172 26060 133 1 . 1 1 29 29 GLU H H 29 7.990 7.990 7.954 0.036 26060 134 1 . 1 1 30 30 GLY N N 30 105.500 105.500 107.572 -2.072 26060 135 1 . 1 1 30 30 GLY C C 30 174.900 174.900 173.861 1.039 26060 136 1 . 1 1 30 30 GLY CA C 30 44.460 44.460 45.191 -0.731 26060 137 1 . 1 1 30 30 GLY H H 30 7.950 7.950 7.752 0.198 26060 138 1 . 1 1 31 31 PHE N N 31 119.300 119.300 118.859 0.441 26060 139 1 . 1 1 31 31 PHE HA H 31 4.760 4.760 4.955 -0.195 26060 140 1 . 1 1 31 31 PHE C C 31 176.400 176.400 175.912 0.488 26060 141 1 . 1 1 31 31 PHE CA C 31 55.900 55.900 54.527 1.373 26060 142 1 . 1 1 31 31 PHE CB C 31 35.500 35.500 39.270 -3.770 26060 143 1 . 1 1 31 31 PHE H H 31 7.520 7.520 7.366 0.154 26060 144 1 . 1 1 32 32 THR N N 32 112.300 112.300 116.204 -3.904 26060 145 1 . 1 1 32 32 THR HA H 32 4.330 4.330 4.457 -0.127 26060 146 1 . 1 1 32 32 THR C C 32 175.200 175.200 174.350 0.850 26060 147 1 . 1 1 32 32 THR CA C 32 62.780 62.780 62.796 -0.016 26060 148 1 . 1 1 32 32 THR CB C 32 70.350 70.350 70.062 0.288 26060 149 1 . 1 1 32 32 THR H H 32 7.770 7.770 9.149 -1.379 26060 150 1 . 1 1 33 33 HIS N N 33 121.900 121.900 122.025 -0.126 26060 151 1 . 1 1 33 33 HIS HA H 33 5.500 5.500 5.194 0.306 26060 152 1 . 1 1 33 33 HIS C C 33 173.880 173.880 173.628 0.252 26060 153 1 . 1 1 33 33 HIS CA C 33 56.780 56.780 56.635 0.145 26060 154 1 . 1 1 33 33 HIS CB C 33 35.640 35.640 32.002 3.638 26060 155 1 . 1 1 33 33 HIS H H 33 9.110 9.110 8.822 0.288 26060 156 1 . 1 1 34 34 ASP N N 34 120.300 120.300 124.745 -4.446 26060 157 1 . 1 1 34 34 ASP HA H 34 5.400 5.400 5.445 -0.045 26060 158 1 . 1 1 34 34 ASP C C 34 175.100 175.100 175.152 -0.052 26060 159 1 . 1 1 34 34 ASP CA C 34 53.310 53.310 53.998 -0.688 26060 160 1 . 1 1 34 34 ASP CB C 34 43.100 43.100 43.449 -0.349 26060 161 1 . 1 1 34 34 ASP H H 34 8.810 8.810 8.958 -0.148 26060 162 1 . 1 1 35 35 TRP N N 35 119.800 119.800 120.497 -0.697 26060 163 1 . 1 1 35 35 TRP HA H 35 5.730 5.730 5.549 0.181 26060 164 1 . 1 1 35 35 TRP C C 35 174.900 174.900 173.359 1.541 26060 165 1 . 1 1 35 35 TRP CA C 35 54.900 54.900 54.974 -0.074 26060 166 1 . 1 1 35 35 TRP CB C 35 35.070 35.070 33.120 1.950 26060 167 1 . 1 1 35 35 TRP H H 35 9.250 9.250 8.893 0.357 26060 168 1 . 1 1 36 36 MET N N 36 120.980 120.980 121.820 -0.840 26060 169 1 . 1 1 36 36 MET HA H 36 5.750 5.750 5.915 -0.165 26060 170 1 . 1 1 36 36 MET C C 36 173.700 173.700 174.317 -0.617 26060 171 1 . 1 1 36 36 MET CA C 36 54.830 54.830 54.279 0.551 26060 172 1 . 1 1 36 36 MET CB C 36 35.220 35.220 36.689 -1.469 26060 173 1 . 1 1 36 36 MET H H 36 9.080 9.080 8.932 0.148 26060 174 1 . 1 1 37 37 VAL N N 37 126.220 126.220 121.279 4.941 26060 175 1 . 1 1 37 37 VAL HA H 37 5.310 5.310 5.164 0.146 26060 176 1 . 1 1 37 37 VAL C C 37 172.300 172.300 174.394 -2.094 26060 177 1 . 1 1 37 37 VAL CA C 37 58.540 58.540 59.866 -1.326 26060 178 1 . 1 1 37 37 VAL CB C 37 35.070 35.070 33.620 1.450 26060 179 1 . 1 1 37 37 VAL H H 37 9.080 9.080 8.805 0.275 26060 180 1 . 1 1 38 38 PHE N N 38 120.640 120.640 122.156 -1.516 26060 181 1 . 1 1 38 38 PHE HA H 38 5.970 5.970 5.400 0.570 26060 182 1 . 1 1 38 38 PHE C C 38 172.960 172.960 174.899 -1.939 26060 183 1 . 1 1 38 38 PHE CA C 38 56.130 56.130 56.628 -0.498 26060 184 1 . 1 1 38 38 PHE CB C 38 43.000 43.000 43.307 -0.307 26060 185 1 . 1 1 38 38 PHE H H 38 8.320 8.320 9.000 -0.680 26060 186 1 . 1 1 39 39 VAL N N 39 116.500 116.500 120.654 -4.154 26060 187 1 . 1 1 39 39 VAL HA H 39 5.010 5.010 5.635 -0.625 26060 188 1 . 1 1 39 39 VAL C C 39 174.700 174.700 174.507 0.193 26060 189 1 . 1 1 39 39 VAL CA C 39 61.640 61.640 60.025 1.615 26060 190 1 . 1 1 39 39 VAL CB C 39 35.400 35.400 33.862 1.538 26060 191 1 . 1 1 39 39 VAL H H 39 8.580 8.580 9.247 -0.667 26060 192 1 . 1 1 40 40 ARG N N 40 124.100 124.100 124.028 0.072 26060 193 1 . 1 1 40 40 ARG HA H 40 5.080 5.080 4.938 0.142 26060 194 1 . 1 1 40 40 ARG C C 40 173.800 173.800 174.253 -0.453 26060 195 1 . 1 1 40 40 ARG CA C 40 54.930 54.930 55.639 -0.709 26060 196 1 . 1 1 40 40 ARG CB C 40 33.580 33.580 32.722 0.858 26060 197 1 . 1 1 40 40 ARG H H 40 9.880 9.880 8.607 1.273 26060 198 1 . 1 1 41 41 GLY N N 41 107.640 107.640 106.657 0.983 26060 199 1 . 1 1 41 41 GLY CA C 41 43.970 43.970 42.622 1.348 26060 200 1 . 1 1 41 41 GLY H H 41 8.910 8.910 8.611 0.299 26060 201 1 . 1 1 42 42 PRO HA H 42 4.490 4.490 4.398 0.092 26060 202 1 . 1 1 42 42 PRO C C 42 177.300 177.300 176.796 0.504 26060 203 1 . 1 1 42 42 PRO CA C 42 62.440 62.440 62.404 0.035 26060 204 1 . 1 1 42 42 PRO CB C 42 32.110 32.110 32.501 -0.391 26060 205 1 . 1 1 43 43 GLU N N 43 121.050 121.050 121.777 -0.727 26060 206 1 . 1 1 43 43 GLU HA H 43 3.790 3.790 4.034 -0.244 26060 207 1 . 1 1 43 43 GLU C C 43 176.110 176.110 176.668 -0.558 26060 208 1 . 1 1 43 43 GLU CA C 43 57.850 57.850 58.500 -0.650 26060 209 1 . 1 1 43 43 GLU CB C 43 27.850 27.850 28.646 -0.796 26060 210 1 . 1 1 43 43 GLU H H 43 9.060 9.060 8.766 0.294 26060 211 1 . 1 1 44 44 HIS N N 44 114.100 114.100 116.572 -2.472 26060 212 1 . 1 1 44 44 HIS HA H 44 4.351 4.351 4.289 0.062 26060 213 1 . 1 1 44 44 HIS C C 44 175.170 175.170 174.565 0.605 26060 214 1 . 1 1 44 44 HIS CA C 44 57.650 57.650 57.277 0.373 26060 215 1 . 1 1 44 44 HIS CB C 44 28.370 28.370 28.757 -0.387 26060 216 1 . 1 1 44 44 HIS H H 44 8.420 8.420 8.668 -0.248 26060 217 1 . 1 1 45 45 SER N N 45 115.540 115.540 117.430 -1.890 26060 218 1 . 1 1 45 45 SER HA H 45 4.560 4.560 4.576 -0.016 26060 219 1 . 1 1 45 45 SER C C 45 173.700 173.700 173.976 -0.276 26060 220 1 . 1 1 45 45 SER CA C 45 58.710 58.710 57.454 1.256 26060 221 1 . 1 1 45 45 SER CB C 45 65.040 65.040 63.582 1.458 26060 222 1 . 1 1 45 45 SER H H 45 7.870 7.870 7.823 0.047 26060 223 1 . 1 1 46 46 ASN N N 46 123.900 123.900 124.214 -0.314 26060 224 1 . 1 1 46 46 ASN HA H 46 5.120 5.120 4.911 0.209 26060 225 1 . 1 1 46 46 ASN C C 46 176.300 176.300 175.648 0.652 26060 226 1 . 1 1 46 46 ASN CA C 46 52.690 52.690 52.869 -0.180 26060 227 1 . 1 1 46 46 ASN CB C 46 38.730 38.730 40.333 -1.603 26060 228 1 . 1 1 46 46 ASN H H 46 9.480 9.480 8.517 0.963 26060 229 1 . 1 1 47 47 ILE N N 47 115.240 115.240 120.241 -5.001 26060 230 1 . 1 1 47 47 ILE HA H 47 3.940 3.940 3.243 0.697 26060 231 1 . 1 1 47 47 ILE C C 47 176.000 176.000 176.766 -0.766 26060 232 1 . 1 1 47 47 ILE CA C 47 63.200 63.200 62.827 0.373 26060 233 1 . 1 1 47 47 ILE CB C 47 36.700 36.700 38.130 -1.430 26060 234 1 . 1 1 47 47 ILE H H 47 8.170 8.170 8.520 -0.350 26060 235 1 . 1 1 48 48 GLN N N 48 123.200 123.200 120.018 3.182 26060 236 1 . 1 1 48 48 GLN HA H 48 4.280 4.280 4.130 0.150 26060 237 1 . 1 1 48 48 GLN C C 48 175.670 175.670 176.832 -1.162 26060 238 1 . 1 1 48 48 GLN CA C 48 57.900 57.900 58.074 -0.174 26060 239 1 . 1 1 48 48 GLN CB C 48 26.990 26.990 27.494 -0.505 26060 240 1 . 1 1 48 48 GLN H H 48 8.850 8.850 8.571 0.279 26060 241 1 . 1 1 49 49 HIS N N 49 115.400 115.400 116.480 -1.080 26060 242 1 . 1 1 49 49 HIS HA H 49 4.570 4.570 4.412 0.158 26060 243 1 . 1 1 49 49 HIS C C 49 176.380 176.380 176.905 -0.525 26060 244 1 . 1 1 49 49 HIS CA C 49 58.750 58.750 58.599 0.151 26060 245 1 . 1 1 49 49 HIS CB C 49 31.620 31.620 30.664 0.956 26060 246 1 . 1 1 49 49 HIS H H 49 7.400 7.400 7.600 -0.200 26060 247 1 . 1 1 50 50 PHE N N 50 109.800 109.800 112.991 -3.191 26060 248 1 . 1 1 50 50 PHE HA H 50 5.230 5.230 4.910 0.320 26060 249 1 . 1 1 50 50 PHE C C 50 173.800 173.800 174.268 -0.468 26060 250 1 . 1 1 50 50 PHE CA C 50 56.660 56.660 56.783 -0.123 26060 251 1 . 1 1 50 50 PHE CB C 50 41.000 41.000 39.676 1.324 26060 252 1 . 1 1 50 50 PHE H H 50 7.570 7.570 7.562 0.008 26060 253 1 . 1 1 51 51 VAL N N 51 127.810 127.810 120.597 7.213 26060 254 1 . 1 1 51 51 VAL HA H 51 4.370 4.370 4.856 -0.486 26060 255 1 . 1 1 51 51 VAL C C 51 174.500 174.500 174.565 -0.065 26060 256 1 . 1 1 51 51 VAL CA C 51 63.000 63.000 61.432 1.568 26060 257 1 . 1 1 51 51 VAL CB C 51 33.280 33.280 34.791 -1.511 26060 258 1 . 1 1 51 51 VAL H H 51 7.810 7.810 8.062 -0.251 26060 259 1 . 1 1 52 52 GLU N N 52 130.700 130.700 127.563 3.137 26060 260 1 . 1 1 52 52 GLU HA H 52 3.980 3.980 4.469 -0.489 26060 261 1 . 1 1 52 52 GLU C C 52 175.400 175.400 175.685 -0.285 26060 262 1 . 1 1 52 52 GLU CA C 52 58.100 58.100 57.393 0.707 26060 263 1 . 1 1 52 52 GLU CB C 52 31.580 31.580 32.075 -0.495 26060 264 1 . 1 1 52 52 GLU H H 52 9.380 9.380 8.930 0.450 26060 265 1 . 1 1 53 53 LYS N N 53 109.200 109.200 114.476 -5.276 26060 266 1 . 1 1 53 53 LYS HA H 53 4.800 4.800 5.001 -0.201 26060 267 1 . 1 1 53 53 LYS C C 53 172.300 172.300 174.445 -2.145 26060 268 1 . 1 1 53 53 LYS CA C 53 54.840 54.840 54.573 0.267 26060 269 1 . 1 1 53 53 LYS CB C 53 34.250 34.250 36.040 -1.790 26060 270 1 . 1 1 53 53 LYS H H 53 7.190 7.190 7.458 -0.268 26060 271 1 . 1 1 54 54 VAL N N 54 120.380 120.380 117.779 2.601 26060 272 1 . 1 1 54 54 VAL HA H 54 4.770 4.770 4.694 0.076 26060 273 1 . 1 1 54 54 VAL C C 54 173.600 173.600 173.922 -0.322 26060 274 1 . 1 1 54 54 VAL CA C 54 61.040 61.040 61.413 -0.373 26060 275 1 . 1 1 54 54 VAL CB C 54 34.700 34.700 36.642 -1.942 26060 276 1 . 1 1 54 54 VAL H H 54 8.450 8.450 8.358 0.092 26060 277 1 . 1 1 55 55 VAL N N 55 126.920 126.920 122.908 4.012 26060 278 1 . 1 1 55 55 VAL HA H 55 4.700 4.700 5.047 -0.347 26060 279 1 . 1 1 55 55 VAL C C 55 173.800 173.800 173.826 -0.026 26060 280 1 . 1 1 55 55 VAL CA C 55 60.870 60.870 60.790 0.080 26060 281 1 . 1 1 55 55 VAL CB C 55 34.100 34.100 36.961 -2.861 26060 282 1 . 1 1 55 55 VAL H H 55 9.260 9.260 9.026 0.234 26060 283 1 . 1 1 56 56 PHE N N 56 126.130 126.130 124.002 2.128 26060 284 1 . 1 1 56 56 PHE HA H 56 4.690 4.690 5.008 -0.318 26060 285 1 . 1 1 56 56 PHE C C 56 174.000 174.000 174.302 -0.302 26060 286 1 . 1 1 56 56 PHE CA C 56 56.580 56.580 56.725 -0.145 26060 287 1 . 1 1 56 56 PHE CB C 56 40.890 40.890 42.457 -1.567 26060 288 1 . 1 1 56 56 PHE H H 56 9.290 9.290 9.014 0.276 26060 289 1 . 1 1 57 57 HIS N N 57 124.180 124.180 124.253 -0.073 26060 290 1 . 1 1 57 57 HIS HA H 57 4.800 4.800 4.968 -0.168 26060 291 1 . 1 1 57 57 HIS C C 57 174.700 174.700 174.964 -0.264 26060 292 1 . 1 1 57 57 HIS CA C 57 55.320 55.320 55.123 0.197 26060 293 1 . 1 1 57 57 HIS CB C 57 30.100 30.100 28.798 1.302 26060 294 1 . 1 1 57 57 HIS H H 57 8.690 8.690 8.543 0.147 26060 295 1 . 1 1 58 58 LEU N N 58 122.050 122.050 123.016 -0.966 26060 296 1 . 1 1 58 58 LEU HA H 58 4.240 4.240 4.387 -0.147 26060 297 1 . 1 1 58 58 LEU C C 58 174.400 174.400 176.909 -2.509 26060 298 1 . 1 1 58 58 LEU CA C 58 55.410 55.410 54.822 0.588 26060 299 1 . 1 1 58 58 LEU CB C 58 41.160 41.160 42.450 -1.290 26060 300 1 . 1 1 58 58 LEU H H 58 9.050 9.050 8.058 0.992 26060 301 1 . 1 1 59 59 HIS N N 59 118.510 118.510 118.111 0.399 26060 302 1 . 1 1 59 59 HIS C C 59 175.300 175.300 176.692 -1.392 26060 303 1 . 1 1 59 59 HIS CA C 59 59.110 59.110 55.906 3.204 26060 304 1 . 1 1 59 59 HIS CB C 59 30.930 30.930 30.853 0.077 26060 305 1 . 1 1 59 59 HIS H H 59 5.160 5.160 7.842 -2.682 26060 306 1 . 1 1 60 60 GLU N N 60 122.190 122.190 125.086 -2.896 26060 307 1 . 1 1 60 60 GLU HA H 60 3.960 3.960 4.020 -0.060 26060 308 1 . 1 1 60 60 GLU C C 60 175.130 175.130 177.137 -2.007 26060 309 1 . 1 1 60 60 GLU CA C 60 59.010 59.010 59.302 -0.292 26060 310 1 . 1 1 60 60 GLU CB C 60 28.820 28.820 28.892 -0.072 26060 311 1 . 1 1 60 60 GLU H H 60 7.960 7.960 8.568 -0.608 26060 312 1 . 1 1 61 61 SER N N 61 116.940 116.940 113.422 3.518 26060 313 1 . 1 1 61 61 SER HA H 61 4.200 4.200 4.320 -0.120 26060 314 1 . 1 1 61 61 SER CA C 61 60.010 60.010 59.695 0.315 26060 315 1 . 1 1 61 61 SER CB C 61 63.140 63.140 63.444 -0.304 26060 316 1 . 1 1 61 61 SER H H 61 8.540 8.540 8.109 0.431 26060 317 1 . 1 1 62 62 PHE N N 62 123.700 123.700 122.175 1.525 26060 318 1 . 1 1 62 62 PHE HA H 62 4.550 4.550 4.622 -0.072 26060 319 1 . 1 1 62 62 PHE CA C 62 57.940 57.940 55.685 2.255 26060 320 1 . 1 1 62 62 PHE CB C 62 38.400 38.400 38.969 -0.569 26060 321 1 . 1 1 62 62 PHE H H 62 8.640 8.640 8.123 0.517 26060 322 1 . 1 1 63 63 PRO HA H 63 4.410 4.410 4.479 -0.069 26060 323 1 . 1 1 63 63 PRO C C 63 176.400 176.400 176.366 0.034 26060 324 1 . 1 1 63 63 PRO CA C 63 62.600 62.600 63.203 -0.602 26060 325 1 . 1 1 63 63 PRO CB C 63 31.860 31.860 32.016 -0.156 26060 326 1 . 1 1 64 64 ARG N N 64 116.840 116.840 120.601 -3.761 26060 327 1 . 1 1 64 64 ARG HA H 64 4.100 4.100 4.082 0.018 26060 328 1 . 1 1 64 64 ARG CA C 64 55.610 55.610 56.127 -0.517 26060 329 1 . 1 1 64 64 ARG CB C 64 28.830 28.830 28.697 0.133 26060 330 1 . 1 1 64 64 ARG H H 64 8.890 8.890 8.722 0.168 26060 331 1 . 1 1 65 65 PRO HA H 65 3.990 3.990 4.382 -0.392 26060 332 1 . 1 1 65 65 PRO C C 65 175.800 175.800 177.156 -1.356 26060 333 1 . 1 1 65 65 PRO CA C 65 65.810 65.810 63.985 1.825 26060 334 1 . 1 1 65 65 PRO CB C 65 31.880 31.880 31.974 -0.094 26060 335 1 . 1 1 66 66 LYS N N 66 119.035 119.035 120.183 -1.148 26060 336 1 . 1 1 66 66 LYS HA H 66 4.610 4.610 5.042 -0.432 26060 337 1 . 1 1 66 66 LYS C C 66 175.400 175.400 175.846 -0.446 26060 338 1 . 1 1 66 66 LYS CA C 66 55.453 55.453 55.426 0.026 26060 339 1 . 1 1 66 66 LYS CB C 66 31.730 31.730 32.063 -0.334 26060 340 1 . 1 1 66 66 LYS H H 66 7.630 7.630 7.868 -0.238 26060 341 1 . 1 1 67 67 ARG N N 67 127.394 127.394 127.651 -0.257 26060 342 1 . 1 1 67 67 ARG HA H 67 4.740 4.740 4.624 0.116 26060 343 1 . 1 1 67 67 ARG C C 67 174.500 174.500 174.903 -0.403 26060 344 1 . 1 1 67 67 ARG CA C 67 52.800 52.800 52.646 0.153 26060 345 1 . 1 1 67 67 ARG CB C 67 29.714 29.714 31.013 -1.299 26060 346 1 . 1 1 67 67 ARG H H 67 8.855 8.855 8.704 0.151 26060 347 1 . 1 1 68 68 VAL N N 68 124.388 124.388 119.995 4.393 26060 348 1 . 1 1 68 68 VAL HA H 68 4.580 4.580 5.035 -0.455 26060 349 1 . 1 1 68 68 VAL C C 68 176.850 176.850 175.440 1.410 26060 350 1 . 1 1 68 68 VAL CA C 68 62.073 62.073 59.910 2.163 26060 351 1 . 1 1 68 68 VAL CB C 68 33.604 33.604 33.592 0.012 26060 352 1 . 1 1 68 68 VAL H H 68 8.681 8.681 8.408 0.273 26060 353 1 . 1 1 69 69 CYS N N 69 127.080 127.080 126.045 1.035 26060 354 1 . 1 1 69 69 CYS HA H 69 5.070 5.070 4.761 0.309 26060 355 1 . 1 1 69 69 CYS CA C 69 58.346 58.346 57.857 0.489 26060 356 1 . 1 1 69 69 CYS CB C 69 30.770 30.770 29.990 0.780 26060 357 1 . 1 1 69 69 CYS H H 69 9.455 9.455 9.049 0.406 26060 358 1 . 1 1 70 70 LYS N N 70 125.480 125.480 123.630 1.850 26060 359 1 . 1 1 70 70 LYS HA H 70 4.490 4.490 4.533 -0.043 26060 360 1 . 1 1 70 70 LYS C C 70 174.300 174.300 175.553 -1.253 26060 361 1 . 1 1 70 70 LYS CA C 70 57.760 57.760 56.265 1.495 26060 362 1 . 1 1 70 70 LYS CB C 70 33.170 33.170 33.254 -0.084 26060 363 1 . 1 1 70 70 LYS H H 70 9.050 9.050 8.650 0.400 26060 364 1 . 1 1 71 71 ASP N N 71 116.940 116.940 119.792 -2.852 26060 365 1 . 1 1 71 71 ASP HA H 71 5.100 5.100 4.826 0.274 26060 366 1 . 1 1 71 71 ASP CA C 71 51.080 51.080 51.919 -0.839 26060 367 1 . 1 1 71 71 ASP CB C 71 43.380 43.380 41.181 2.199 26060 368 1 . 1 1 71 71 ASP H H 71 7.620 7.620 7.533 0.087 26060 369 1 . 1 1 72 72 PRO HA H 72 3.260 3.260 4.128 -0.868 26060 370 1 . 1 1 72 72 PRO CA C 72 60.650 60.650 62.881 -2.231 26060 371 1 . 1 1 72 72 PRO CB C 72 30.040 30.040 31.041 -1.001 26060 372 1 . 1 1 73 73 PRO HA H 73 4.100 4.100 4.137 -0.037 26060 373 1 . 1 1 73 73 PRO C C 73 174.700 174.700 176.015 -1.315 26060 374 1 . 1 1 73 73 PRO CA C 73 61.690 61.690 64.313 -2.623 26060 375 1 . 1 1 73 73 PRO CB C 73 34.040 34.040 31.236 2.804 26060 376 1 . 1 1 74 74 TYR N N 74 125.400 125.400 124.916 0.484 26060 377 1 . 1 1 74 74 TYR HA H 74 4.850 4.850 4.521 0.329 26060 378 1 . 1 1 74 74 TYR C C 74 172.900 172.900 175.340 -2.440 26060 379 1 . 1 1 74 74 TYR CA C 74 55.670 55.670 58.035 -2.365 26060 380 1 . 1 1 74 74 TYR CB C 74 35.400 35.400 38.976 -3.576 26060 381 1 . 1 1 74 74 TYR H H 74 8.960 8.960 8.340 0.620 26060 382 1 . 1 1 75 75 LYS N N 75 121.400 121.400 119.812 1.588 26060 383 1 . 1 1 75 75 LYS HA H 75 5.590 5.590 5.087 0.503 26060 384 1 . 1 1 75 75 LYS C C 75 173.800 173.800 174.388 -0.588 26060 385 1 . 1 1 75 75 LYS CA C 75 54.650 54.650 54.652 -0.002 26060 386 1 . 1 1 75 75 LYS CB C 75 35.890 35.890 36.668 -0.778 26060 387 1 . 1 1 75 75 LYS H H 75 7.670 7.670 8.003 -0.333 26060 388 1 . 1 1 76 76 VAL N N 76 119.800 119.800 121.018 -1.218 26060 389 1 . 1 1 76 76 VAL HA H 76 3.890 3.890 4.157 -0.267 26060 390 1 . 1 1 76 76 VAL C C 76 173.900 173.900 174.337 -0.437 26060 391 1 . 1 1 76 76 VAL CA C 76 61.730 61.730 60.399 1.331 26060 392 1 . 1 1 76 76 VAL CB C 76 35.540 35.540 35.142 0.398 26060 393 1 . 1 1 76 76 VAL H H 76 8.180 8.180 7.836 0.344 26060 394 1 . 1 1 77 77 GLU N N 77 126.190 126.190 127.523 -1.333 26060 395 1 . 1 1 77 77 GLU HA H 77 4.950 4.950 4.950 0.000 26060 396 1 . 1 1 77 77 GLU C C 77 174.700 174.700 175.251 -0.551 26060 397 1 . 1 1 77 77 GLU CA C 77 54.940 54.940 55.159 -0.219 26060 398 1 . 1 1 77 77 GLU CB C 77 31.550 31.550 31.225 0.325 26060 399 1 . 1 1 77 77 GLU H H 77 8.270 8.270 8.632 -0.362 26060 400 1 . 1 1 78 78 GLU N N 78 126.180 126.180 123.519 2.661 26060 401 1 . 1 1 78 78 GLU HA H 78 4.450 4.450 4.589 -0.139 26060 402 1 . 1 1 78 78 GLU C C 78 175.400 175.400 173.951 1.449 26060 403 1 . 1 1 78 78 GLU CA C 78 54.042 54.042 54.082 -0.040 26060 404 1 . 1 1 78 78 GLU CB C 78 37.100 37.100 33.869 3.231 26060 405 1 . 1 1 78 78 GLU H H 78 7.870 7.870 8.459 -0.589 26060 406 1 . 1 1 79 79 SER N N 79 112.109 112.109 113.435 -1.326 26060 407 1 . 1 1 79 79 SER HA H 79 5.560 5.560 5.349 0.211 26060 408 1 . 1 1 79 79 SER C C 79 172.490 172.490 173.179 -0.689 26060 409 1 . 1 1 79 79 SER CA C 79 57.754 57.754 56.602 1.152 26060 410 1 . 1 1 79 79 SER CB C 79 65.861 65.861 65.337 0.524 26060 411 1 . 1 1 79 79 SER H H 79 7.714 7.714 8.329 -0.615 26060 412 1 . 1 1 80 80 GLY N N 80 106.048 106.048 110.533 -4.485 26060 413 1 . 1 1 80 80 GLY C C 80 172.630 172.630 171.912 0.718 26060 414 1 . 1 1 80 80 GLY CA C 80 46.570 46.570 45.540 1.030 26060 415 1 . 1 1 80 80 GLY H H 80 8.828 8.828 8.942 -0.115 26060 416 1 . 1 1 81 81 TYR N N 81 115.280 115.280 114.847 0.433 26060 417 1 . 1 1 81 81 TYR HA H 81 5.680 5.680 5.326 0.354 26060 418 1 . 1 1 81 81 TYR C C 81 174.100 174.100 174.085 0.015 26060 419 1 . 1 1 81 81 TYR CA C 81 55.500 55.500 56.807 -1.307 26060 420 1 . 1 1 81 81 TYR CB C 81 41.340 41.340 39.205 2.135 26060 421 1 . 1 1 81 81 TYR H H 81 8.770 8.770 8.110 0.660 26060 422 1 . 1 1 82 82 ALA N N 82 122.350 122.350 122.623 -0.273 26060 423 1 . 1 1 82 82 ALA HA H 82 4.400 4.400 4.540 -0.140 26060 424 1 . 1 1 82 82 ALA CA C 82 52.040 52.040 51.713 0.327 26060 425 1 . 1 1 82 82 ALA CB C 82 22.400 22.400 21.099 1.301 26060 426 1 . 1 1 82 82 ALA H H 82 7.160 7.160 7.407 -0.247 26060 427 1 . 1 1 83 83 GLY N N 83 107.100 107.100 106.625 0.475 26060 428 1 . 1 1 83 83 GLY C C 83 172.500 172.500 173.600 -1.100 26060 429 1 . 1 1 83 83 GLY CA C 83 44.610 44.610 44.097 0.513 26060 430 1 . 1 1 83 83 GLY H H 83 8.220 8.220 8.259 -0.039 26060 431 1 . 1 1 84 84 PHE N N 84 111.660 111.660 115.389 -3.729 26060 432 1 . 1 1 84 84 PHE HA H 84 4.690 4.690 4.576 0.114 26060 433 1 . 1 1 84 84 PHE C C 84 172.460 172.460 173.347 -0.887 26060 434 1 . 1 1 84 84 PHE CA C 84 56.500 56.500 56.518 -0.018 26060 435 1 . 1 1 84 84 PHE CB C 84 38.580 38.580 39.625 -1.045 26060 436 1 . 1 1 84 84 PHE H H 84 7.700 7.700 8.095 -0.395 26060 437 1 . 1 1 85 85 ILE N N 85 117.810 117.810 121.599 -3.789 26060 438 1 . 1 1 85 85 ILE HA H 85 4.310 4.310 4.086 0.224 26060 439 1 . 1 1 85 85 ILE CA C 85 59.340 59.340 60.971 -1.631 26060 440 1 . 1 1 85 85 ILE CB C 85 35.260 35.260 37.094 -1.834 26060 441 1 . 1 1 85 85 ILE H H 85 8.340 8.340 8.482 -0.142 26060 442 1 . 1 1 86 86 LEU N N 86 108.130 108.130 129.374 -21.244 26060 443 1 . 1 1 86 86 LEU HA H 86 4.980 4.980 5.034 -0.054 26060 444 1 . 1 1 86 86 LEU CA C 86 53.200 53.200 51.024 2.176 26060 445 1 . 1 1 86 86 LEU CB C 86 45.300 45.300 45.446 -0.146 26060 446 1 . 1 1 86 86 LEU H H 86 9.900 9.900 8.777 1.123 26060 447 1 . 1 1 87 87 PRO HA H 87 5.100 5.100 4.530 0.570 26060 448 1 . 1 1 87 87 PRO C C 87 175.340 175.340 175.889 -0.549 26060 449 1 . 1 1 87 87 PRO CA C 87 63.110 63.110 62.837 0.273 26060 450 1 . 1 1 87 87 PRO CB C 87 31.560 31.560 30.567 0.993 26060 451 1 . 1 1 88 88 ILE N N 88 126.000 126.000 126.009 -0.009 26060 452 1 . 1 1 88 88 ILE HA H 88 4.790 4.790 4.279 0.511 26060 453 1 . 1 1 88 88 ILE C C 88 176.100 176.100 175.115 0.985 26060 454 1 . 1 1 88 88 ILE CA C 88 60.560 60.560 60.473 0.087 26060 455 1 . 1 1 88 88 ILE CB C 88 42.000 42.000 40.003 1.997 26060 456 1 . 1 1 88 88 ILE H H 88 9.380 9.380 8.707 0.673 26060 457 1 . 1 1 89 89 GLU N N 89 123.900 123.900 124.958 -1.058 26060 458 1 . 1 1 89 89 GLU HA H 89 5.200 5.200 5.258 -0.058 26060 459 1 . 1 1 89 89 GLU C C 89 173.800 173.800 175.512 -1.712 26060 460 1 . 1 1 89 89 GLU CA C 89 53.970 53.970 54.422 -0.452 26060 461 1 . 1 1 89 89 GLU CB C 89 34.380 34.380 33.375 1.005 26060 462 1 . 1 1 89 89 GLU H H 89 9.320 9.320 8.916 0.404 26060 463 1 . 1 1 90 90 VAL N N 90 123.980 123.980 123.381 0.599 26060 464 1 . 1 1 90 90 VAL HA H 90 4.160 4.160 4.162 -0.002 26060 465 1 . 1 1 90 90 VAL C C 90 174.800 174.800 174.587 0.213 26060 466 1 . 1 1 90 90 VAL CA C 90 61.990 61.990 61.174 0.816 26060 467 1 . 1 1 90 90 VAL CB C 90 32.490 32.490 32.610 -0.120 26060 468 1 . 1 1 90 90 VAL H H 90 8.630 8.630 8.458 0.172 26060 469 1 . 1 1 91 91 TYR N N 91 124.230 124.230 126.892 -2.662 26060 470 1 . 1 1 91 91 TYR HA H 91 4.660 4.660 4.462 0.198 26060 471 1 . 1 1 91 91 TYR C C 91 176.800 176.800 175.572 1.228 26060 472 1 . 1 1 91 91 TYR CA C 91 56.700 56.700 57.715 -1.015 26060 473 1 . 1 1 91 91 TYR CB C 91 40.240 40.240 38.858 1.382 26060 474 1 . 1 1 91 91 TYR H H 91 8.640 8.640 9.035 -0.395 26060 475 1 . 1 1 92 92 PHE N N 92 121.200 121.200 122.485 -1.285 26060 476 1 . 1 1 92 92 PHE HA H 92 5.660 5.660 5.226 0.434 26060 477 1 . 1 1 92 92 PHE CA C 92 56.510 56.510 55.074 1.437 26060 478 1 . 1 1 92 92 PHE CB C 92 42.700 42.700 41.871 0.829 26060 479 1 . 1 1 92 92 PHE H H 92 8.750 8.750 8.951 -0.201 26060 480 1 . 1 1 93 93 LYS N N 93 123.450 123.450 122.607 0.843 26060 481 1 . 1 1 93 93 LYS HA H 93 4.600 4.600 4.598 0.002 26060 482 1 . 1 1 93 93 LYS C C 93 174.200 174.200 175.083 -0.883 26060 483 1 . 1 1 93 93 LYS CA C 93 55.180 55.180 55.910 -0.730 26060 484 1 . 1 1 93 93 LYS CB C 93 31.680 31.680 32.227 -0.547 26060 485 1 . 1 1 93 93 LYS H H 93 8.560 8.560 8.939 -0.379 26060 486 1 . 1 1 94 94 ASN N N 94 118.800 118.800 121.170 -2.370 26060 487 1 . 1 1 94 94 ASN HA H 94 4.440 4.440 4.757 -0.317 26060 488 1 . 1 1 94 94 ASN CA C 94 51.210 51.210 52.282 -1.072 26060 489 1 . 1 1 94 94 ASN CB C 94 39.800 39.800 40.671 -0.871 26060 490 1 . 1 1 94 94 ASN H H 94 7.820 7.820 8.068 -0.248 26060 491 1 . 1 1 95 95 LYS HA H 95 4.330 4.330 4.385 -0.055 26060 492 1 . 1 1 95 95 LYS C C 95 175.800 175.800 175.785 0.015 26060 493 1 . 1 1 95 95 LYS CA C 95 56.210 56.210 56.526 -0.316 26060 494 1 . 1 1 95 95 LYS CB C 95 33.010 33.010 33.189 -0.179 26060 495 1 . 1 1 96 96 GLU N N 96 118.330 118.330 119.916 -1.586 26060 496 1 . 1 1 96 96 GLU HA H 96 4.510 4.510 4.332 0.178 26060 497 1 . 1 1 96 96 GLU C C 96 173.200 173.200 175.839 -2.639 26060 498 1 . 1 1 96 96 GLU CA C 96 54.100 54.100 55.115 -1.015 26060 499 1 . 1 1 96 96 GLU CB C 96 31.470 31.470 29.508 1.962 26060 500 1 . 1 1 96 96 GLU H H 96 7.120 7.120 7.690 -0.570 26060 501 1 . 1 1 97 97 GLU N N 97 115.630 115.630 119.700 -4.070 26060 502 1 . 1 1 97 97 GLU HA H 97 4.430 4.430 4.179 0.251 26060 503 1 . 1 1 97 97 GLU CA C 97 54.860 54.860 56.046 -1.186 26060 504 1 . 1 1 97 97 GLU CB C 97 29.270 29.270 28.784 0.486 26060 505 1 . 1 1 97 97 GLU H H 97 8.060 8.060 8.347 -0.287 26060 506 1 . 1 1 98 98 PRO HA H 98 5.000 5.000 4.228 0.772 26060 507 1 . 1 1 98 98 PRO C C 98 175.900 175.900 176.363 -0.463 26060 508 1 . 1 1 98 98 PRO CA C 98 62.160 62.160 64.104 -1.944 26060 509 1 . 1 1 98 98 PRO CB C 98 34.000 34.000 31.992 2.008 26060 510 1 . 1 1 99 99 ARG N N 99 122.800 122.800 119.667 3.133 26060 511 1 . 1 1 99 99 ARG HA H 99 4.630 4.630 4.439 0.191 26060 512 1 . 1 1 99 99 ARG C C 99 175.800 175.800 175.635 0.165 26060 513 1 . 1 1 99 99 ARG CA C 99 56.490 56.490 56.401 0.090 26060 514 1 . 1 1 99 99 ARG CB C 99 30.410 30.410 30.701 -0.291 26060 515 1 . 1 1 99 99 ARG H H 99 8.602 8.602 8.616 -0.014 26060 516 1 . 1 1 100 100 LYS N N 100 113.220 113.220 116.740 -3.520 26060 517 1 . 1 1 100 100 LYS HA H 100 4.940 4.940 4.520 0.420 26060 518 1 . 1 1 100 100 LYS C C 100 174.100 174.100 174.353 -0.253 26060 519 1 . 1 1 100 100 LYS CA C 100 53.910 53.910 54.249 -0.339 26060 520 1 . 1 1 100 100 LYS CB C 100 34.720 34.720 35.701 -0.981 26060 521 1 . 1 1 100 100 LYS H H 100 7.650 7.650 7.348 0.302 26060 522 1 . 1 1 101 101 VAL N N 101 116.230 116.230 121.019 -4.789 26060 523 1 . 1 1 101 101 VAL HA H 101 4.270 4.270 4.158 0.112 26060 524 1 . 1 1 101 101 VAL C C 101 171.600 171.600 173.583 -1.983 26060 525 1 . 1 1 101 101 VAL CA C 101 60.260 60.260 59.332 0.928 26060 526 1 . 1 1 101 101 VAL CB C 101 35.180 35.180 35.179 0.001 26060 527 1 . 1 1 101 101 VAL H H 101 8.120 8.120 8.032 0.088 26060 528 1 . 1 1 102 102 ARG N N 102 124.980 124.980 127.750 -2.770 26060 529 1 . 1 1 102 102 ARG HA H 102 5.160 5.160 4.845 0.315 26060 530 1 . 1 1 102 102 ARG C C 102 174.340 174.340 175.180 -0.840 26060 531 1 . 1 1 102 102 ARG CA C 102 53.750 53.750 54.645 -0.895 26060 532 1 . 1 1 102 102 ARG CB C 102 33.350 33.350 31.488 1.862 26060 533 1 . 1 1 102 102 ARG H H 102 7.930 7.930 8.292 -0.362 26060 534 1 . 1 1 103 103 PHE N N 103 124.590 124.590 126.815 -2.224 26060 535 1 . 1 1 103 103 PHE HA H 103 4.792 4.792 4.750 0.042 26060 536 1 . 1 1 103 103 PHE C C 103 174.280 174.280 174.959 -0.679 26060 537 1 . 1 1 103 103 PHE CA C 103 55.980 55.980 54.709 1.271 26060 538 1 . 1 1 103 103 PHE CB C 103 42.250 42.250 39.962 2.288 26060 539 1 . 1 1 103 103 PHE H H 103 9.390 9.390 9.125 0.265 26060 540 1 . 1 1 104 104 ASP N N 104 124.700 124.700 126.090 -1.390 26060 541 1 . 1 1 104 104 ASP HA H 104 4.799 4.799 4.651 0.148 26060 542 1 . 1 1 104 104 ASP C C 104 174.500 174.500 175.038 -0.538 26060 543 1 . 1 1 104 104 ASP CA C 104 54.390 54.390 54.399 -0.009 26060 544 1 . 1 1 104 104 ASP CB C 104 40.230 40.230 39.688 0.542 26060 545 1 . 1 1 104 104 ASP H H 104 9.010 9.010 8.925 0.085 26060 546 1 . 1 1 105 105 TYR N N 105 129.840 129.840 124.634 5.206 26060 547 1 . 1 1 105 105 TYR HA H 105 4.100 4.100 4.487 -0.387 26060 548 1 . 1 1 105 105 TYR C C 105 173.100 173.100 173.843 -0.743 26060 549 1 . 1 1 105 105 TYR CA C 105 58.680 58.680 57.672 1.008 26060 550 1 . 1 1 105 105 TYR CB C 105 41.850 41.850 40.763 1.087 26060 551 1 . 1 1 105 105 TYR H H 105 8.140 8.140 8.265 -0.125 26060 552 1 . 1 1 106 106 ASP N N 106 126.800 126.800 127.945 -1.145 26060 553 1 . 1 1 106 106 ASP HA H 106 4.220 4.220 4.354 -0.134 26060 554 1 . 1 1 106 106 ASP C C 106 172.900 172.900 174.490 -1.590 26060 555 1 . 1 1 106 106 ASP CA C 106 53.510 53.510 53.678 -0.168 26060 556 1 . 1 1 106 106 ASP CB C 106 39.500 39.500 41.258 -1.757 26060 557 1 . 1 1 106 106 ASP H H 106 7.730 7.730 8.300 -0.570 26060 558 1 . 1 1 107 107 LEU N N 107 132.150 132.150 128.179 3.971 26060 559 1 . 1 1 107 107 LEU HA H 107 2.840 2.840 3.441 -0.601 26060 560 1 . 1 1 107 107 LEU C C 107 172.100 172.100 174.849 -2.749 26060 561 1 . 1 1 107 107 LEU CA C 107 53.700 53.700 53.769 -0.069 26060 562 1 . 1 1 107 107 LEU CB C 107 39.240 39.240 40.954 -1.714 26060 563 1 . 1 1 107 107 LEU H H 107 7.770 7.770 7.726 0.044 26060 564 1 . 1 1 108 108 PHE N N 108 118.960 118.960 121.802 -2.842 26060 565 1 . 1 1 108 108 PHE HA H 108 4.690 4.690 4.887 -0.197 26060 566 1 . 1 1 108 108 PHE C C 108 174.300 174.300 173.632 0.668 26060 567 1 . 1 1 108 108 PHE CA C 108 54.690 54.690 55.328 -0.638 26060 568 1 . 1 1 108 108 PHE CB C 108 40.290 40.290 40.800 -0.510 26060 569 1 . 1 1 108 108 PHE H H 108 6.060 6.060 7.169 -1.109 26060 570 1 . 1 1 109 109 LEU N N 109 118.900 118.900 122.760 -3.860 26060 571 1 . 1 1 109 109 LEU HA H 109 4.400 4.400 4.720 -0.320 26060 572 1 . 1 1 109 109 LEU CA C 109 52.160 52.160 53.254 -1.094 26060 573 1 . 1 1 109 109 LEU CB C 109 43.080 43.080 44.715 -1.635 26060 574 1 . 1 1 109 109 LEU H H 109 8.388 8.388 8.340 0.048 26060 575 1 . 1 1 111 111 LEU HA H 111 4.440 4.440 4.394 0.046 26060 576 1 . 1 1 111 111 LEU C C 111 177.300 177.300 177.127 0.173 26060 577 1 . 1 1 111 111 LEU CA C 111 54.220 54.220 55.066 -0.846 26060 578 1 . 1 1 111 111 LEU CB C 111 43.870 43.870 42.704 1.166 26060 579 1 . 1 1 112 112 GLU N N 112 120.660 120.660 123.186 -2.526 26060 580 1 . 1 1 112 112 GLU HA H 112 4.170 4.170 4.081 0.089 26060 581 1 . 1 1 112 112 GLU CA C 112 58.460 58.460 58.355 0.105 26060 582 1 . 1 1 112 112 GLU CB C 112 29.690 29.690 29.903 -0.213 26060 583 1 . 1 1 112 112 GLU H H 112 8.780 8.780 8.789 -0.009 26060 584 1 . 1 1 113 113 GLY C C 113 173.900 173.900 173.785 0.115 26060 585 1 . 1 1 113 113 GLY CA C 113 44.950 44.950 44.994 -0.044 26060 586 1 . 1 1 114 114 HIS N N 114 120.890 120.890 119.947 0.943 26060 587 1 . 1 1 114 114 HIS HA H 114 4.906 4.906 5.044 -0.138 26060 588 1 . 1 1 114 114 HIS CA C 114 54.770 54.770 53.811 0.959 26060 589 1 . 1 1 114 114 HIS CB C 114 30.590 30.590 31.425 -0.835 26060 590 1 . 1 1 114 114 HIS H H 114 7.934 7.934 7.842 0.091 26060 591 1 . 1 1 115 115 PRO HA H 115 4.800 4.800 4.905 -0.105 26060 592 1 . 1 1 115 115 PRO CA C 115 62.090 62.090 61.323 0.767 26060 593 1 . 1 1 115 115 PRO CB C 115 30.680 30.680 31.826 -1.146 26060 594 1 . 1 1 116 116 PRO C C 116 176.600 176.600 175.813 0.787 26060 595 1 . 1 1 116 116 PRO CB C 116 32.300 32.300 32.233 0.067 26060 596 1 . 1 1 117 117 VAL N N 117 127.480 127.480 125.481 1.999 26060 597 1 . 1 1 117 117 VAL HA H 117 3.790 3.790 4.296 -0.506 26060 598 1 . 1 1 117 117 VAL CA C 117 62.700 62.700 61.917 0.783 26060 599 1 . 1 1 117 117 VAL CB C 117 33.200 33.200 33.424 -0.224 26060 600 1 . 1 1 117 117 VAL H H 117 8.890 8.890 7.999 0.891 26060 601 1 . 1 1 118 118 ASN HA H 118 4.990 4.990 4.987 0.003 26060 602 1 . 1 1 118 118 ASN C C 118 172.700 172.700 173.613 -0.913 26060 603 1 . 1 1 118 118 ASN CA C 118 53.360 53.360 53.379 -0.019 26060 604 1 . 1 1 118 118 ASN CB C 118 39.200 39.200 40.090 -0.890 26060 605 1 . 1 1 119 119 HIS N N 119 124.930 124.930 126.014 -1.084 26060 606 1 . 1 1 119 119 HIS HA H 119 4.820 4.820 5.073 -0.253 26060 607 1 . 1 1 119 119 HIS C C 119 173.500 173.500 172.820 0.680 26060 608 1 . 1 1 119 119 HIS CA C 119 56.970 56.970 55.094 1.876 26060 609 1 . 1 1 119 119 HIS CB C 119 34.670 34.670 34.057 0.613 26060 610 1 . 1 1 119 119 HIS H H 119 8.790 8.790 8.968 -0.178 26060 611 1 . 1 1 120 120 LEU N N 120 128.280 128.280 124.230 4.050 26060 612 1 . 1 1 120 120 LEU HA H 120 4.950 4.950 5.160 -0.210 26060 613 1 . 1 1 120 120 LEU C C 120 174.030 174.030 175.043 -1.013 26060 614 1 . 1 1 120 120 LEU CA C 120 54.440 54.440 53.555 0.885 26060 615 1 . 1 1 120 120 LEU CB C 120 46.600 46.600 46.241 0.358 26060 616 1 . 1 1 120 120 LEU H H 120 7.460 7.460 8.306 -0.846 26060 617 1 . 1 1 121 121 ARG N N 121 128.060 128.060 122.004 6.056 26060 618 1 . 1 1 121 121 ARG HA H 121 4.640 4.640 4.641 -0.001 26060 619 1 . 1 1 121 121 ARG C C 121 173.400 173.400 173.594 -0.194 26060 620 1 . 1 1 121 121 ARG CA C 121 54.360 54.360 54.492 -0.132 26060 621 1 . 1 1 121 121 ARG CB C 121 34.260 34.260 32.726 1.534 26060 622 1 . 1 1 121 121 ARG H H 121 9.860 9.860 9.054 0.806 26060 623 1 . 1 1 122 122 CYS N N 122 125.290 125.290 121.556 3.734 26060 624 1 . 1 1 122 122 CYS HA H 122 5.020 5.020 5.137 -0.117 26060 625 1 . 1 1 122 122 CYS C C 122 174.600 174.600 174.689 -0.088 26060 626 1 . 1 1 122 122 CYS CA C 122 58.290 58.290 56.757 1.533 26060 627 1 . 1 1 122 122 CYS CB C 122 28.030 28.030 29.341 -1.311 26060 628 1 . 1 1 122 122 CYS H H 122 8.835 8.835 8.676 0.159 26060 629 1 . 1 1 123 123 GLU N N 123 125.920 125.920 124.413 1.507 26060 630 1 . 1 1 123 123 GLU HA H 123 4.680 4.680 4.494 0.186 26060 631 1 . 1 1 123 123 GLU C C 123 174.500 174.500 174.744 -0.244 26060 632 1 . 1 1 123 123 GLU CA C 123 54.420 54.420 54.814 -0.394 26060 633 1 . 1 1 123 123 GLU CB C 123 32.583 32.583 31.988 0.595 26060 634 1 . 1 1 123 123 GLU H H 123 8.970 8.970 9.062 -0.092 26060 635 1 . 1 1 124 124 LYS N N 124 121.837 121.837 122.371 -0.534 26060 636 1 . 1 1 124 124 LYS HA H 124 4.960 4.960 4.938 0.022 26060 637 1 . 1 1 124 124 LYS C C 124 175.700 175.700 175.677 0.023 26060 638 1 . 1 1 124 124 LYS CA C 124 55.357 55.357 55.033 0.324 26060 639 1 . 1 1 124 124 LYS CB C 124 34.189 34.189 34.623 -0.434 26060 640 1 . 1 1 124 124 LYS H H 124 8.652 8.652 8.379 0.273 26060 641 1 . 1 1 125 125 LEU N N 125 127.000 127.000 129.451 -2.451 26060 642 1 . 1 1 125 125 LEU HA H 125 4.650 4.650 4.609 0.041 26060 643 1 . 1 1 125 125 LEU C C 125 175.110 175.110 175.447 -0.337 26060 644 1 . 1 1 125 125 LEU CA C 125 53.854 53.854 53.801 0.053 26060 645 1 . 1 1 125 125 LEU CB C 125 44.267 44.267 43.410 0.857 26060 646 1 . 1 1 125 125 LEU H H 125 9.175 9.175 9.142 0.033 26060 647 1 . 1 1 126 126 THR N N 126 117.779 117.779 119.792 -2.013 26060 648 1 . 1 1 126 126 THR HA H 126 4.650 4.650 4.536 0.114 26060 649 1 . 1 1 126 126 THR C C 126 173.200 173.200 173.553 -0.353 26060 650 1 . 1 1 126 126 THR CA C 126 62.036 62.036 61.578 0.458 26060 651 1 . 1 1 126 126 THR CB C 126 70.284 70.284 69.208 1.076 26060 652 1 . 1 1 126 126 THR H H 126 8.331 8.331 8.398 -0.067 26060 653 1 . 1 1 127 127 PHE N N 127 126.576 126.576 126.530 0.046 26060 654 1 . 1 1 127 127 PHE HA H 127 4.590 4.590 4.656 -0.066 26060 655 1 . 1 1 127 127 PHE C C 127 174.860 174.860 174.603 0.257 26060 656 1 . 1 1 127 127 PHE CA C 127 56.864 56.864 56.635 0.229 26060 657 1 . 1 1 127 127 PHE CB C 127 39.000 39.000 39.945 -0.945 26060 658 1 . 1 1 127 127 PHE H H 127 9.051 9.051 8.809 0.242 26060 659 1 . 1 1 128 128 ASN N N 128 123.040 123.040 123.730 -0.690 26060 660 1 . 1 1 128 128 ASN HA H 128 4.620 4.620 4.675 -0.055 26060 661 1 . 1 1 128 128 ASN CA C 128 54.480 54.480 53.841 0.639 26060 662 1 . 1 1 128 128 ASN CB C 128 39.460 39.460 38.812 0.648 26060 663 1 . 1 1 128 128 ASN H H 128 8.880 8.880 8.795 0.085 26060 664 1 . 1 1 129 129 ASN HA H 129 4.760 4.760 4.542 0.218 26060 665 1 . 1 1 129 129 ASN CA C 129 52.900 52.900 53.498 -0.598 26060 666 1 . 1 1 129 129 ASN CB C 129 38.730 38.730 37.536 1.194 26060 667 1 . 1 1 130 130 PRO HA H 130 4.790 4.790 4.712 0.078 26060 668 1 . 1 1 130 130 PRO C C 130 177.470 177.470 176.509 0.961 26060 669 1 . 1 1 130 130 PRO CA C 130 62.574 62.574 62.417 0.157 26060 670 1 . 1 1 130 130 PRO CB C 130 32.310 32.310 33.134 -0.824 26060 671 1 . 1 1 131 131 THR N N 131 113.400 113.400 115.065 -1.665 26060 672 1 . 1 1 131 131 THR HA H 131 4.300 4.300 4.196 0.104 26060 673 1 . 1 1 131 131 THR C C 131 175.200 175.200 176.096 -0.896 26060 674 1 . 1 1 131 131 THR CA C 131 62.200 62.200 61.895 0.305 26060 675 1 . 1 1 131 131 THR CB C 131 70.600 70.600 70.600 0.000 26060 676 1 . 1 1 131 131 THR H H 131 8.950 8.950 8.552 0.398 26060 677 1 . 1 1 132 132 GLU N N 132 122.199 122.199 125.570 -3.371 26060 678 1 . 1 1 132 132 GLU HA H 132 4.010 4.010 3.996 0.014 26060 679 1 . 1 1 132 132 GLU C C 132 178.700 178.700 178.305 0.395 26060 680 1 . 1 1 132 132 GLU CA C 132 60.294 60.294 60.291 0.003 26060 681 1 . 1 1 132 132 GLU CB C 132 29.161 29.161 29.675 -0.514 26060 682 1 . 1 1 132 132 GLU H H 132 8.932 8.932 9.018 -0.086 26060 683 1 . 1 1 133 133 ASP N N 133 116.324 116.324 119.632 -3.308 26060 684 1 . 1 1 133 133 ASP HA H 133 4.330 4.330 4.364 -0.034 26060 685 1 . 1 1 133 133 ASP C C 133 177.800 177.800 178.785 -0.985 26060 686 1 . 1 1 133 133 ASP CA C 133 57.546 57.546 57.740 -0.194 26060 687 1 . 1 1 133 133 ASP CB C 133 41.823 41.823 40.546 1.277 26060 688 1 . 1 1 133 133 ASP H H 133 8.490 8.490 8.101 0.389 26060 689 1 . 1 1 134 134 PHE N N 134 119.914 119.914 121.187 -1.273 26060 690 1 . 1 1 134 134 PHE HA H 134 4.610 4.610 4.271 0.339 26060 691 1 . 1 1 134 134 PHE C C 134 177.300 177.300 177.145 0.155 26060 692 1 . 1 1 134 134 PHE CA C 134 59.538 59.538 59.591 -0.053 26060 693 1 . 1 1 134 134 PHE CB C 134 39.200 39.200 38.923 0.277 26060 694 1 . 1 1 134 134 PHE H H 134 7.787 7.787 7.535 0.252 26060 695 1 . 1 1 135 135 ARG N N 135 119.794 119.794 120.306 -0.512 26060 696 1 . 1 1 135 135 ARG HA H 135 3.350 3.350 3.575 -0.225 26060 697 1 . 1 1 135 135 ARG C C 135 177.370 177.370 178.285 -0.915 26060 698 1 . 1 1 135 135 ARG CA C 135 60.376 60.376 59.994 0.382 26060 699 1 . 1 1 135 135 ARG CB C 135 30.396 30.396 29.999 0.397 26060 700 1 . 1 1 135 135 ARG H H 135 9.087 9.087 8.645 0.442 26060 701 1 . 1 1 136 136 ARG N N 136 114.554 114.554 118.658 -4.104 26060 702 1 . 1 1 136 136 ARG HA H 136 3.820 3.820 3.906 -0.086 26060 703 1 . 1 1 136 136 ARG C C 136 178.950 178.950 178.721 0.229 26060 704 1 . 1 1 136 136 ARG CA C 136 59.800 59.800 59.807 -0.007 26060 705 1 . 1 1 136 136 ARG CB C 136 30.217 30.217 30.094 0.123 26060 706 1 . 1 1 136 136 ARG H H 136 7.747 7.747 8.519 -0.772 26060 707 1 . 1 1 137 137 LYS N N 137 118.298 118.298 119.185 -0.887 26060 708 1 . 1 1 137 137 LYS HA H 137 3.900 3.900 4.001 -0.101 26060 709 1 . 1 1 137 137 LYS C C 137 177.980 177.980 179.012 -1.032 26060 710 1 . 1 1 137 137 LYS CA C 137 60.395 60.395 59.539 0.856 26060 711 1 . 1 1 137 137 LYS CB C 137 32.447 32.447 32.439 0.008 26060 712 1 . 1 1 137 137 LYS H H 137 7.154 7.154 7.467 -0.313 26060 713 1 . 1 1 138 138 LEU N N 138 117.159 117.159 118.938 -1.779 26060 714 1 . 1 1 138 138 LEU HA H 138 3.420 3.420 3.721 -0.301 26060 715 1 . 1 1 138 138 LEU C C 138 179.100 179.100 178.570 0.530 26060 716 1 . 1 1 138 138 LEU CA C 138 57.231 57.231 57.219 0.012 26060 717 1 . 1 1 138 138 LEU CB C 138 42.328 42.328 41.397 0.931 26060 718 1 . 1 1 138 138 LEU H H 138 7.709 7.709 7.820 -0.111 26060 719 1 . 1 1 139 139 LEU N N 139 115.158 115.158 116.939 -1.781 26060 720 1 . 1 1 139 139 LEU HA H 139 4.150 4.150 4.082 0.068 26060 721 1 . 1 1 139 139 LEU C C 139 177.600 177.600 178.659 -1.059 26060 722 1 . 1 1 139 139 LEU CA C 139 55.529 55.529 56.653 -1.124 26060 723 1 . 1 1 139 139 LEU CB C 139 41.744 41.744 41.866 -0.122 26060 724 1 . 1 1 139 139 LEU H H 139 7.507 7.507 7.981 -0.474 26060 725 1 . 1 1 140 140 LYS N N 140 120.256 120.256 118.248 2.008 26060 726 1 . 1 1 140 140 LYS HA H 140 4.110 4.110 4.015 0.095 26060 727 1 . 1 1 140 140 LYS C C 140 175.800 175.800 177.058 -1.258 26060 728 1 . 1 1 140 140 LYS CA C 140 57.052 57.052 57.417 -0.365 26060 729 1 . 1 1 140 140 LYS CB C 140 32.646 32.646 32.398 0.248 26060 730 1 . 1 1 140 140 LYS H H 140 7.304 7.304 7.572 -0.268 26060 stop_ save_