data_25139 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25139 _Entry.PDB_ID 2MSX 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 25139 _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 48 48 ALA CA C 48 52.904 52.904 52.196 0.708 25139 2 1 1 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.467 -0.245 25139 3 1 1 . 1 1 49 49 ASP N N 49 119.661 119.661 119.875 -0.214 25139 4 1 1 . 1 1 49 49 ASP CA C 49 54.277 54.277 53.626 0.651 25139 5 1 1 . 1 1 49 49 ASP CB C 49 41.062 41.062 42.646 -1.584 25139 6 1 1 . 1 1 49 49 ASP H H 49 8.462 8.462 8.519 -0.057 25139 7 1 1 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.135 -0.083 25139 8 1 1 . 1 1 51 51 LEU C C 51 178.514 178.514 178.723 -0.209 25139 9 1 1 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.447 0.602 25139 10 1 1 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.243 -0.050 25139 11 1 1 . 1 1 52 52 ASN N N 52 113.819 113.819 116.615 -2.796 25139 12 1 1 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.696 0.139 25139 13 1 1 . 1 1 52 52 ASN C C 52 175.964 175.964 176.045 -0.081 25139 14 1 1 . 1 1 52 52 ASN CA C 52 54.096 54.096 54.802 -0.706 25139 15 1 1 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.624 0.259 25139 16 1 1 . 1 1 52 52 ASN H H 52 7.853 7.853 8.190 -0.337 25139 17 1 1 . 1 1 53 53 SER N N 53 114.357 114.357 115.327 -0.970 25139 18 1 1 . 1 1 53 53 SER CA C 53 59.908 59.908 59.056 0.852 25139 19 1 1 . 1 1 53 53 SER CB C 53 64.395 64.395 63.915 0.480 25139 20 1 1 . 1 1 53 53 SER H H 53 8.023 8.023 7.983 0.040 25139 21 1 1 . 1 1 54 54 PHE N N 54 121.037 121.037 119.844 1.193 25139 22 1 1 . 1 1 54 54 PHE C C 54 175.522 175.522 175.807 -0.285 25139 23 1 1 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.939 1.125 25139 24 1 1 . 1 1 54 54 PHE CB C 54 43.053 43.053 42.865 0.188 25139 25 1 1 . 1 1 54 54 PHE H H 54 7.731 7.731 7.716 0.015 25139 26 1 1 . 1 1 55 55 THR N N 55 116.535 116.535 118.564 -2.029 25139 27 1 1 . 1 1 55 55 THR HA H 55 4.654 4.654 4.706 -0.052 25139 28 1 1 . 1 1 55 55 THR C C 55 173.301 173.301 173.375 -0.074 25139 29 1 1 . 1 1 55 55 THR CA C 55 61.420 61.420 61.227 0.193 25139 30 1 1 . 1 1 55 55 THR CB C 55 71.388 71.388 71.182 0.206 25139 31 1 1 . 1 1 55 55 THR H H 55 8.929 8.929 9.315 -0.386 25139 32 1 1 . 1 1 56 56 ALA N N 56 129.359 129.359 129.002 0.357 25139 33 1 1 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.986 0.329 25139 34 1 1 . 1 1 56 56 ALA C C 56 178.305 178.305 177.312 0.993 25139 35 1 1 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.011 0.860 25139 36 1 1 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.088 0.236 25139 37 1 1 . 1 1 56 56 ALA H H 56 8.907 8.907 8.627 0.280 25139 38 1 1 . 1 1 57 57 GLY N N 57 106.331 106.331 109.438 -3.107 25139 39 1 1 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.814 0.797 25139 40 1 1 . 1 1 57 57 GLY H H 57 7.978 7.978 8.146 -0.168 25139 41 1 1 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.359 -0.035 25139 42 1 1 . 1 1 59 59 PRO C C 59 177.466 177.466 177.471 -0.005 25139 43 1 1 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.986 1.498 25139 44 1 1 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.106 -0.371 25139 45 1 1 . 1 1 60 60 GLY N N 60 109.688 109.688 107.867 1.821 25139 46 1 1 . 1 1 60 60 GLY C C 60 173.555 173.555 173.031 0.524 25139 47 1 1 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.924 0.617 25139 48 1 1 . 1 1 60 60 GLY H H 60 8.402 8.402 8.802 -0.400 25139 49 1 1 . 1 1 61 61 PHE N N 61 122.491 122.491 121.954 0.537 25139 50 1 1 . 1 1 61 61 PHE C C 61 175.146 175.146 174.613 0.533 25139 51 1 1 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.734 1.548 25139 52 1 1 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.198 -2.499 25139 53 1 1 . 1 1 61 61 PHE H H 61 7.957 7.957 7.215 0.742 25139 54 1 1 . 1 1 62 62 VAL N N 62 121.128 121.128 117.830 3.298 25139 55 1 1 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.238 -0.153 25139 56 1 1 . 1 1 62 62 VAL C C 62 174.937 174.937 174.705 0.232 25139 57 1 1 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.150 0.558 25139 58 1 1 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.506 0.926 25139 59 1 1 . 1 1 62 62 VAL H H 62 7.994 7.994 9.052 -1.058 25139 60 1 1 . 1 1 63 63 LEU N N 63 124.386 124.386 123.410 0.976 25139 61 1 1 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.750 -1.434 25139 62 1 1 . 1 1 63 63 LEU C C 63 175.278 175.278 177.116 -1.838 25139 63 1 1 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.401 0.887 25139 64 1 1 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.842 1.276 25139 65 1 1 . 1 1 63 63 LEU H H 63 7.572 7.572 8.875 -1.303 25139 66 1 1 . 1 1 64 64 ASP N N 64 126.746 126.746 124.257 2.489 25139 67 1 1 . 1 1 64 64 ASP C C 64 177.801 177.801 177.188 0.613 25139 68 1 1 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.677 -2.956 25139 69 1 1 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.923 -0.525 25139 70 1 1 . 1 1 64 64 ASP H H 64 8.552 8.552 8.414 0.138 25139 71 1 1 . 1 1 65 65 THR C C 65 175.002 175.002 175.255 -0.253 25139 72 1 1 . 1 1 65 65 THR CB C 65 67.919 67.919 66.684 1.235 25139 73 1 1 . 1 1 66 66 GLN N N 66 120.804 120.804 120.439 0.365 25139 74 1 1 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.982 -0.105 25139 75 1 1 . 1 1 66 66 GLN C C 66 178.901 178.901 177.582 1.319 25139 76 1 1 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.469 0.946 25139 77 1 1 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.180 -0.256 25139 78 1 1 . 1 1 66 66 GLN H H 66 8.447 8.447 8.266 0.181 25139 79 1 1 . 1 1 67 67 ALA N N 67 121.267 121.267 122.121 -0.854 25139 80 1 1 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.101 -0.144 25139 81 1 1 . 1 1 67 67 ALA C C 67 176.777 176.777 178.977 -2.200 25139 82 1 1 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.152 0.172 25139 83 1 1 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.029 0.591 25139 84 1 1 . 1 1 67 67 ALA H H 67 7.791 7.791 7.683 0.108 25139 85 1 1 . 1 1 68 68 SER N N 68 113.339 113.339 113.287 0.052 25139 86 1 1 . 1 1 68 68 SER HA H 68 4.061 4.061 4.158 -0.097 25139 87 1 1 . 1 1 68 68 SER C C 68 175.875 175.875 176.588 -0.713 25139 88 1 1 . 1 1 68 68 SER CA C 68 62.970 62.970 60.665 2.305 25139 89 1 1 . 1 1 68 68 SER CB C 68 61.330 61.330 63.427 -2.097 25139 90 1 1 . 1 1 68 68 SER H H 68 7.785 7.785 7.554 0.231 25139 91 1 1 . 1 1 69 69 VAL N N 69 125.140 125.140 116.442 8.698 25139 92 1 1 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.246 -0.170 25139 93 1 1 . 1 1 69 69 VAL C C 69 176.384 176.384 176.986 -0.602 25139 94 1 1 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.661 1.070 25139 95 1 1 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.505 -0.016 25139 96 1 1 . 1 1 69 69 VAL H H 69 8.572 8.572 7.969 0.603 25139 97 1 1 . 1 1 70 70 SER N N 70 116.704 116.704 114.303 2.401 25139 98 1 1 . 1 1 70 70 SER HA H 70 4.229 4.229 4.282 -0.053 25139 99 1 1 . 1 1 70 70 SER C C 70 174.101 174.101 175.213 -1.112 25139 100 1 1 . 1 1 70 70 SER CA C 70 61.627 61.627 59.528 2.099 25139 101 1 1 . 1 1 70 70 SER H H 70 7.951 7.951 7.690 0.261 25139 102 1 1 . 1 1 71 71 ASN N N 71 117.576 117.576 117.081 0.495 25139 103 1 1 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.643 0.159 25139 104 1 1 . 1 1 71 71 ASN C C 71 174.332 174.332 174.770 -0.438 25139 105 1 1 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.901 -0.462 25139 106 1 1 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.099 0.368 25139 107 1 1 . 1 1 71 71 ASN H H 71 7.131 7.131 7.487 -0.356 25139 108 1 1 . 1 1 72 72 GLY N N 72 103.925 103.925 105.578 -1.653 25139 109 1 1 . 1 1 72 72 GLY C C 72 174.710 174.710 173.535 1.175 25139 110 1 1 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.459 0.090 25139 111 1 1 . 1 1 72 72 GLY H H 72 7.338 7.338 7.370 -0.032 25139 112 1 1 . 1 1 73 73 ALA N N 73 124.942 124.942 123.342 1.600 25139 113 1 1 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.524 -0.352 25139 114 1 1 . 1 1 73 73 ALA C C 73 175.896 175.896 176.303 -0.407 25139 115 1 1 . 1 1 73 73 ALA CA C 73 52.673 52.673 52.001 0.672 25139 116 1 1 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.009 0.046 25139 117 1 1 . 1 1 73 73 ALA H H 73 8.032 8.032 7.786 0.246 25139 118 1 1 . 1 1 74 74 THR N N 74 113.423 113.423 116.807 -3.384 25139 119 1 1 . 1 1 74 74 THR HA H 74 4.678 4.678 4.577 0.101 25139 120 1 1 . 1 1 74 74 THR C C 74 173.339 173.339 173.277 0.062 25139 121 1 1 . 1 1 74 74 THR CA C 74 61.545 61.545 60.526 1.019 25139 122 1 1 . 1 1 74 74 THR CB C 74 71.319 71.319 71.466 -0.147 25139 123 1 1 . 1 1 74 74 THR H H 74 8.530 8.530 8.242 0.288 25139 124 1 1 . 1 1 75 75 PHE N N 75 128.180 128.180 129.541 -1.361 25139 125 1 1 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.840 -0.236 25139 126 1 1 . 1 1 75 75 PHE C C 75 174.623 174.623 174.919 -0.296 25139 127 1 1 . 1 1 75 75 PHE CA C 75 57.616 57.616 56.776 0.841 25139 128 1 1 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.509 0.166 25139 129 1 1 . 1 1 75 75 PHE H H 75 9.146 9.146 9.144 0.002 25139 130 1 1 . 1 1 76 76 LEU N N 76 127.849 127.849 126.199 1.650 25139 131 1 1 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.637 -0.286 25139 132 1 1 . 1 1 76 76 LEU C C 76 176.339 176.339 176.416 -0.077 25139 133 1 1 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.471 0.512 25139 134 1 1 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.594 -0.264 25139 135 1 1 . 1 1 76 76 LEU H H 76 8.635 8.635 8.405 0.230 25139 136 1 1 . 1 1 77 77 GLU N N 77 115.131 115.131 120.516 -5.385 25139 137 1 1 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.562 -0.154 25139 138 1 1 . 1 1 77 77 GLU C C 77 174.734 174.734 174.571 0.163 25139 139 1 1 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.408 0.945 25139 140 1 1 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.912 0.295 25139 141 1 1 . 1 1 77 77 GLU H H 77 7.252 7.252 7.802 -0.550 25139 142 1 1 . 1 1 78 78 SER N N 78 118.016 118.016 119.237 -1.221 25139 143 1 1 . 1 1 78 78 SER HA H 78 5.561 5.561 5.410 0.151 25139 144 1 1 . 1 1 78 78 SER C C 78 171.968 171.968 172.709 -0.741 25139 145 1 1 . 1 1 78 78 SER CA C 78 54.061 54.061 55.184 -1.123 25139 146 1 1 . 1 1 78 78 SER CB C 78 64.074 64.074 63.115 0.959 25139 147 1 1 . 1 1 78 78 SER H H 78 9.033 9.033 8.599 0.434 25139 148 1 1 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.878 -0.278 25139 149 1 1 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.912 -0.502 25139 150 1 1 . 1 1 80 80 THR N N 80 118.079 118.079 114.129 3.950 25139 151 1 1 . 1 1 80 80 THR HA H 80 4.342 4.342 4.371 -0.029 25139 152 1 1 . 1 1 80 80 THR C C 80 174.494 174.494 174.267 0.227 25139 153 1 1 . 1 1 80 80 THR CA C 80 61.453 61.453 60.157 1.296 25139 154 1 1 . 1 1 80 80 THR CB C 80 67.797 67.797 68.265 -0.468 25139 155 1 1 . 1 1 80 80 THR H H 80 8.670 8.670 8.187 0.483 25139 156 1 1 . 1 1 81 81 VAL N N 81 117.395 117.395 117.595 -0.200 25139 157 1 1 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.962 0.645 25139 158 1 1 . 1 1 81 81 VAL C C 81 175.518 175.518 175.313 0.205 25139 159 1 1 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.504 -3.390 25139 160 1 1 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.765 1.830 25139 161 1 1 . 1 1 81 81 VAL H H 81 7.448 7.448 7.375 0.073 25139 162 1 1 . 1 1 82 82 ARG N N 82 117.852 117.852 118.768 -0.916 25139 163 1 1 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.851 -0.330 25139 164 1 1 . 1 1 82 82 ARG C C 82 176.992 176.992 175.371 1.621 25139 165 1 1 . 1 1 82 82 ARG CA C 82 56.385 56.385 54.700 1.685 25139 166 1 1 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.630 0.972 25139 167 1 1 . 1 1 82 82 ARG H H 82 8.710 8.710 8.699 0.011 25139 168 1 1 . 1 1 83 83 ARG N N 83 117.035 117.035 118.603 -1.568 25139 169 1 1 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.639 0.683 25139 170 1 1 . 1 1 83 83 ARG C C 83 177.379 177.379 176.746 0.633 25139 171 1 1 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.530 -0.846 25139 172 1 1 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.028 -0.987 25139 173 1 1 . 1 1 83 83 ARG H H 83 7.292 7.292 7.711 -0.419 25139 174 1 1 . 1 1 84 84 GLY N N 84 114.911 114.911 110.675 4.236 25139 175 1 1 . 1 1 84 84 GLY C C 84 176.940 176.940 175.221 1.719 25139 176 1 1 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.811 1.861 25139 177 1 1 . 1 1 84 84 GLY H H 84 9.255 9.255 8.999 0.256 25139 178 1 1 . 1 1 85 85 TRP N N 85 121.810 121.810 121.003 0.807 25139 179 1 1 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.295 -0.128 25139 180 1 1 . 1 1 85 85 TRP C C 85 178.272 178.272 177.572 0.700 25139 181 1 1 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.366 1.679 25139 182 1 1 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.222 -0.005 25139 183 1 1 . 1 1 85 85 TRP H H 85 9.963 9.963 7.848 2.115 25139 184 1 1 . 1 1 86 86 ASP N N 86 116.400 116.400 120.424 -4.024 25139 185 1 1 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.517 -0.124 25139 186 1 1 . 1 1 86 86 ASP C C 86 178.803 178.803 177.806 0.997 25139 187 1 1 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.623 0.431 25139 188 1 1 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.321 0.413 25139 189 1 1 . 1 1 86 86 ASP H H 86 6.934 6.934 7.776 -0.842 25139 190 1 1 . 1 1 87 87 CYS N N 87 122.454 122.454 119.502 2.952 25139 191 1 1 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.268 -0.018 25139 192 1 1 . 1 1 87 87 CYS C C 87 174.956 174.956 176.456 -1.500 25139 193 1 1 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.665 -3.518 25139 194 1 1 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.289 11.196 25139 195 1 1 . 1 1 87 87 CYS H H 87 7.603 7.603 7.427 0.176 25139 196 1 1 . 1 1 88 88 VAL N N 88 119.192 119.192 120.604 -1.412 25139 197 1 1 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.144 -0.686 25139 198 1 1 . 1 1 88 88 VAL C C 88 177.413 177.413 177.904 -0.491 25139 199 1 1 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.816 1.160 25139 200 1 1 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.550 -0.308 25139 201 1 1 . 1 1 88 88 VAL H H 88 7.192 7.192 7.683 -0.491 25139 202 1 1 . 1 1 89 89 ARG N N 89 118.185 118.185 118.999 -0.814 25139 203 1 1 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.939 -0.259 25139 204 1 1 . 1 1 89 89 ARG C C 89 178.677 178.677 177.952 0.725 25139 205 1 1 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.115 0.840 25139 206 1 1 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.442 0.349 25139 207 1 1 . 1 1 89 89 ARG H H 89 7.971 7.971 7.747 0.224 25139 208 1 1 . 1 1 90 90 ALA N N 90 120.815 120.815 121.984 -1.169 25139 209 1 1 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.169 -0.094 25139 210 1 1 . 1 1 90 90 ALA C C 90 177.416 177.416 178.828 -1.412 25139 211 1 1 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.299 -0.045 25139 212 1 1 . 1 1 90 90 ALA CB C 90 17.436 17.436 17.890 -0.454 25139 213 1 1 . 1 1 90 90 ALA H H 90 7.453 7.453 7.951 -0.498 25139 214 1 1 . 1 1 91 91 CYS N N 91 120.380 120.380 116.168 4.212 25139 215 1 1 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.358 0.013 25139 216 1 1 . 1 1 91 91 CYS C C 91 176.654 176.654 176.098 0.556 25139 217 1 1 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.327 -3.632 25139 218 1 1 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.398 12.306 25139 219 1 1 . 1 1 91 91 CYS H H 91 7.944 7.944 7.585 0.359 25139 220 1 1 . 1 1 92 92 CYS N N 92 116.270 116.270 119.246 -2.976 25139 221 1 1 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.508 -0.104 25139 222 1 1 . 1 1 92 92 CYS C C 92 175.628 175.628 176.485 -0.857 25139 223 1 1 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.164 -2.458 25139 224 1 1 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.037 15.112 25139 225 1 1 . 1 1 92 92 CYS H H 92 8.315 8.315 7.687 0.628 25139 226 1 1 . 1 1 93 93 THR N N 93 107.283 107.283 109.660 -2.377 25139 227 1 1 . 1 1 93 93 THR HA H 93 4.481 4.481 4.278 0.203 25139 228 1 1 . 1 1 93 93 THR C C 93 173.606 173.606 175.467 -1.861 25139 229 1 1 . 1 1 93 93 THR CA C 93 61.402 61.402 63.370 -1.968 25139 230 1 1 . 1 1 93 93 THR CB C 93 69.046 69.046 69.281 -0.235 25139 231 1 1 . 1 1 93 93 THR H H 93 7.445 7.445 7.277 0.168 25139 232 1 1 . 1 1 94 94 THR N N 94 121.432 121.432 120.324 1.108 25139 233 1 1 . 1 1 94 94 THR HA H 94 4.398 4.398 4.452 -0.054 25139 234 1 1 . 1 1 94 94 THR C C 94 173.493 173.493 174.874 -1.381 25139 235 1 1 . 1 1 94 94 THR CA C 94 62.726 62.726 63.178 -0.452 25139 236 1 1 . 1 1 94 94 THR CB C 94 69.704 69.704 68.762 0.942 25139 237 1 1 . 1 1 94 94 THR H H 94 7.553 7.553 8.006 -0.453 25139 238 1 1 . 1 1 95 95 GLN N N 95 129.410 129.410 128.371 1.039 25139 239 1 1 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.060 -0.116 25139 240 1 1 . 1 1 95 95 GLN C C 95 176.293 176.293 176.816 -0.523 25139 241 1 1 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.711 -0.670 25139 242 1 1 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.871 -0.615 25139 243 1 1 . 1 1 95 95 GLN H H 95 8.812 8.812 9.013 -0.201 25139 244 1 1 . 1 1 96 96 ASN N N 96 115.015 115.015 115.336 -0.321 25139 245 1 1 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.757 -0.558 25139 246 1 1 . 1 1 96 96 ASN C C 96 172.260 172.260 173.606 -1.346 25139 247 1 1 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.934 2.633 25139 248 1 1 . 1 1 96 96 ASN CB C 96 36.837 36.837 39.042 -2.205 25139 249 1 1 . 1 1 96 96 ASN H H 96 8.791 8.791 8.195 0.596 25139 250 1 1 . 1 1 97 97 CYS N N 97 115.830 115.830 119.742 -3.912 25139 251 1 1 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.560 -0.459 25139 252 1 1 . 1 1 97 97 CYS C C 97 175.025 175.025 174.084 0.941 25139 253 1 1 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.714 -1.566 25139 254 1 1 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.936 16.298 25139 255 1 1 . 1 1 97 97 CYS H H 97 7.651 7.651 7.765 -0.114 25139 256 1 1 . 1 1 98 98 ASN N N 98 125.148 125.148 125.585 -0.437 25139 257 1 1 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.010 0.123 25139 258 1 1 . 1 1 98 98 ASN C C 98 171.892 171.892 174.276 -2.384 25139 259 1 1 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.955 -0.761 25139 260 1 1 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.297 -1.349 25139 261 1 1 . 1 1 98 98 ASN H H 98 8.736 8.736 8.390 0.346 25139 262 1 1 . 1 1 99 99 LEU N N 99 120.898 120.898 121.065 -0.167 25139 263 1 1 . 1 1 99 99 LEU C C 99 173.084 173.084 174.234 -1.150 25139 264 1 1 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.599 2.521 25139 265 1 1 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.086 -0.758 25139 266 1 1 . 1 1 99 99 LEU H H 99 8.200 8.200 8.215 -0.015 25139 267 1 1 . 1 1 100 100 ALA N N 100 128.085 128.085 130.050 -1.965 25139 268 1 1 . 1 1 100 100 ALA C C 100 174.938 174.938 175.306 -0.368 25139 269 1 1 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.582 -0.835 25139 270 1 1 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.622 0.093 25139 271 1 1 . 1 1 100 100 ALA H H 100 9.156 9.156 9.319 -0.163 25139 272 1 1 . 1 1 101 101 LEU N N 101 128.723 128.723 128.094 0.629 25139 273 1 1 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.234 -0.092 25139 274 1 1 . 1 1 101 101 LEU C C 101 174.379 174.379 175.365 -0.986 25139 275 1 1 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.483 -0.630 25139 276 1 1 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.727 0.580 25139 277 1 1 . 1 1 101 101 LEU H H 101 9.578 9.578 8.970 0.608 25139 278 1 1 . 1 1 102 102 VAL N N 102 119.417 119.417 118.558 0.859 25139 279 1 1 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.278 0.250 25139 280 1 1 . 1 1 102 102 VAL C C 102 173.660 173.660 174.204 -0.544 25139 281 1 1 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.917 -0.297 25139 282 1 1 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.901 -1.628 25139 283 1 1 . 1 1 102 102 VAL H H 102 9.297 9.297 9.365 -0.068 25139 284 1 1 . 1 1 103 103 GLU N N 103 124.427 124.427 123.776 0.651 25139 285 1 1 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.645 -0.780 25139 286 1 1 . 1 1 103 103 GLU C C 103 176.319 176.319 175.664 0.655 25139 287 1 1 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.542 -0.441 25139 288 1 1 . 1 1 103 103 GLU CB C 103 32.201 32.201 32.088 0.113 25139 289 1 1 . 1 1 103 103 GLU H H 103 7.749 7.749 8.388 -0.639 25139 290 1 1 . 1 1 104 104 LEU N N 104 127.294 127.294 125.563 1.731 25139 291 1 1 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.539 -0.219 25139 292 1 1 . 1 1 104 104 LEU C C 104 176.593 176.593 177.552 -0.959 25139 293 1 1 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.176 2.908 25139 294 1 1 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.488 -0.097 25139 295 1 1 . 1 1 104 104 LEU H H 104 8.323 8.323 8.473 -0.150 25139 296 1 1 . 1 1 105 105 GLN N N 105 121.361 121.361 117.539 3.822 25139 297 1 1 . 1 1 105 105 GLN C C 105 172.868 172.868 174.429 -1.561 25139 298 1 1 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.577 -3.171 25139 299 1 1 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.527 2.201 25139 300 1 1 . 1 1 105 105 GLN H H 105 8.095 8.095 8.273 -0.178 25139 301 1 1 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.303 0.106 25139 302 1 1 . 1 1 106 106 PRO C C 106 177.770 177.770 176.695 1.075 25139 303 1 1 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.971 -0.486 25139 304 1 1 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.039 -0.271 25139 305 1 1 . 1 1 107 107 ASP N N 107 116.484 116.484 114.790 1.694 25139 306 1 1 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.548 -0.108 25139 307 1 1 . 1 1 107 107 ASP C C 107 176.749 176.749 176.671 0.078 25139 308 1 1 . 1 1 107 107 ASP CA C 107 55.455 55.455 54.509 0.946 25139 309 1 1 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.469 -0.581 25139 310 1 1 . 1 1 107 107 ASP H H 107 8.638 8.638 8.195 0.443 25139 311 1 1 . 1 1 108 108 ARG N N 108 117.895 117.895 121.350 -3.455 25139 312 1 1 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.509 -0.019 25139 313 1 1 . 1 1 108 108 ARG C C 108 176.111 176.111 177.369 -1.258 25139 314 1 1 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.523 -0.258 25139 315 1 1 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.076 1.000 25139 316 1 1 . 1 1 108 108 ARG H H 108 7.905 7.905 8.095 -0.190 25139 317 1 1 . 1 1 109 109 GLY N N 109 108.307 108.307 107.717 0.590 25139 318 1 1 . 1 1 109 109 GLY C C 109 173.949 173.949 174.818 -0.869 25139 319 1 1 . 1 1 109 109 GLY CA C 109 44.551 44.551 46.464 -1.913 25139 320 1 1 . 1 1 109 109 GLY H H 109 7.753 7.753 8.556 -0.803 25139 321 1 1 . 1 1 110 110 GLU N N 110 120.035 120.035 122.496 -2.461 25139 322 1 1 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.613 -0.522 25139 323 1 1 . 1 1 110 110 GLU C C 110 177.045 177.045 176.713 0.332 25139 324 1 1 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.091 2.191 25139 325 1 1 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.275 -1.602 25139 326 1 1 . 1 1 110 110 GLU H H 110 8.509 8.509 7.968 0.541 25139 327 1 1 . 1 1 111 111 ASP N N 111 121.160 121.160 121.475 -0.315 25139 328 1 1 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.540 0.030 25139 329 1 1 . 1 1 111 111 ASP C C 111 175.089 175.089 175.747 -0.658 25139 330 1 1 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.915 -1.324 25139 331 1 1 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.171 1.261 25139 332 1 1 . 1 1 111 111 ASP H H 111 8.916 8.916 8.181 0.735 25139 333 1 1 . 1 1 112 112 ALA N N 112 122.130 122.130 118.537 3.593 25139 334 1 1 . 1 1 112 112 ALA C C 112 178.120 178.120 175.278 2.842 25139 335 1 1 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.466 2.793 25139 336 1 1 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.995 -2.225 25139 337 1 1 . 1 1 112 112 ALA H H 112 7.361 7.361 7.306 0.055 25139 338 1 1 . 1 1 113 113 ILE N N 113 113.780 113.780 113.170 0.610 25139 339 1 1 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.881 0.005 25139 340 1 1 . 1 1 113 113 ILE C C 113 174.258 174.258 175.103 -0.845 25139 341 1 1 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.169 0.343 25139 342 1 1 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.684 0.164 25139 343 1 1 . 1 1 113 113 ILE H H 113 7.667 7.667 8.230 -0.563 25139 344 1 1 . 1 1 114 114 ALA N N 114 122.673 122.673 126.067 -3.394 25139 345 1 1 . 1 1 114 114 ALA C C 114 176.984 176.984 176.707 0.277 25139 346 1 1 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.076 -1.512 25139 347 1 1 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.618 0.964 25139 348 1 1 . 1 1 114 114 ALA H H 114 8.904 8.904 8.891 0.013 25139 349 1 1 . 1 1 115 115 ALA N N 115 116.486 116.486 116.427 0.059 25139 350 1 1 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.467 -0.112 25139 351 1 1 . 1 1 115 115 ALA C C 115 174.138 174.138 174.264 -0.126 25139 352 1 1 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.717 1.603 25139 353 1 1 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.419 1.564 25139 354 1 1 . 1 1 115 115 ALA H H 115 7.182 7.182 7.240 -0.058 25139 355 1 1 . 1 1 116 116 CYS N N 116 120.099 120.099 119.635 0.464 25139 356 1 1 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.193 0.138 25139 357 1 1 . 1 1 116 116 CYS C C 116 176.609 176.609 172.503 4.106 25139 358 1 1 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.275 -2.326 25139 359 1 1 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.888 11.496 25139 360 1 1 . 1 1 116 116 CYS H H 116 8.298 8.298 7.838 0.460 25139 361 1 1 . 1 1 117 117 PHE N N 117 126.406 126.406 125.590 0.816 25139 362 1 1 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.181 0.018 25139 363 1 1 . 1 1 117 117 PHE C C 117 173.385 173.385 174.108 -0.723 25139 364 1 1 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.062 0.192 25139 365 1 1 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.353 0.327 25139 366 1 1 . 1 1 117 117 PHE H H 117 9.712 9.712 9.104 0.608 25139 367 1 1 . 1 1 118 118 LEU N N 118 122.119 122.119 124.726 -2.607 25139 368 1 1 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.411 -0.245 25139 369 1 1 . 1 1 118 118 LEU C C 118 175.097 175.097 176.057 -0.960 25139 370 1 1 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.497 -0.593 25139 371 1 1 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.366 -1.068 25139 372 1 1 . 1 1 118 118 LEU H H 118 8.719 8.719 9.439 -0.720 25139 373 1 1 . 1 1 119 119 ILE N N 119 125.324 125.324 122.810 2.514 25139 374 1 1 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.942 -0.065 25139 375 1 1 . 1 1 119 119 ILE C C 119 173.825 173.825 175.630 -1.805 25139 376 1 1 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.919 -0.812 25139 377 1 1 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.065 -0.555 25139 378 1 1 . 1 1 119 119 ILE H H 119 8.986 8.986 9.038 -0.052 25139 379 1 1 . 1 1 120 120 ASN N N 120 121.534 121.534 124.599 -3.065 25139 380 1 1 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.704 0.686 25139 381 1 1 . 1 1 120 120 ASN C C 120 176.098 176.098 175.880 0.218 25139 382 1 1 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.885 -4.428 25139 383 1 1 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.061 0.857 25139 384 1 1 . 1 1 120 120 ASN H H 120 8.694 8.694 9.072 -0.378 25139 385 1 1 . 1 1 121 121 CYS N N 121 122.779 122.779 116.402 6.377 25139 386 1 1 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.080 0.403 25139 387 1 1 . 1 1 121 121 CYS C C 121 173.195 173.195 173.606 -0.411 25139 388 1 1 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.837 -4.073 25139 389 1 1 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.266 16.441 25139 390 1 1 . 1 1 121 121 CYS H H 121 10.668 10.668 8.583 2.085 25139 391 1 1 . 1 1 122 122 LEU N N 122 121.063 121.063 117.474 3.589 25139 392 1 1 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.493 -0.128 25139 393 1 1 . 1 1 122 122 LEU C C 122 176.743 176.743 175.502 1.241 25139 394 1 1 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.954 0.710 25139 395 1 1 . 1 1 122 122 LEU CB C 122 44.234 44.234 46.025 -1.791 25139 396 1 1 . 1 1 122 122 LEU H H 122 8.256 8.256 7.953 0.303 25139 397 1 1 . 1 1 123 123 TYR N N 123 123.081 123.081 122.203 0.878 25139 398 1 1 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.715 -0.672 25139 399 1 1 . 1 1 123 123 TYR C C 123 173.633 173.633 174.870 -1.237 25139 400 1 1 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.193 -0.305 25139 401 1 1 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.623 -0.542 25139 402 1 1 . 1 1 123 123 TYR H H 123 8.990 8.990 8.973 0.017 25139 403 1 1 . 1 1 124 124 GLU N N 124 128.742 128.742 127.111 1.631 25139 404 1 1 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.739 -0.189 25139 405 1 1 . 1 1 124 124 GLU C C 124 174.835 174.835 175.440 -0.605 25139 406 1 1 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.495 0.137 25139 407 1 1 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.304 -0.409 25139 408 1 1 . 1 1 124 124 GLU H H 124 9.135 9.135 8.756 0.379 25139 409 1 1 . 1 1 125 125 GLN N N 125 108.066 108.066 109.149 -1.083 25139 410 1 1 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.847 -0.126 25139 411 1 1 . 1 1 125 125 GLN C C 125 174.627 174.627 174.567 0.060 25139 412 1 1 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.730 0.310 25139 413 1 1 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.657 -0.329 25139 414 1 1 . 1 1 125 125 GLN H H 125 8.390 8.390 8.441 -0.051 25139 415 1 1 . 1 1 126 126 ASN N N 126 118.528 118.528 117.452 1.076 25139 416 1 1 . 1 1 126 126 ASN C C 126 173.713 173.713 174.522 -0.809 25139 417 1 1 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.784 -0.595 25139 418 1 1 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.828 0.973 25139 419 1 1 . 1 1 126 126 ASN H H 126 8.092 8.092 7.913 0.179 25139 420 1 1 . 1 1 127 127 PHE N N 127 124.680 124.680 122.049 2.631 25139 421 1 1 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.733 0.304 25139 422 1 1 . 1 1 127 127 PHE C C 127 177.125 177.125 176.324 0.801 25139 423 1 1 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.846 0.567 25139 424 1 1 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.354 0.890 25139 425 1 1 . 1 1 127 127 PHE H H 127 9.026 9.026 8.903 0.123 25139 426 1 1 . 1 1 128 128 VAL N N 128 119.455 119.455 118.909 0.546 25139 427 1 1 . 1 1 128 128 VAL C C 128 175.886 175.886 175.899 -0.013 25139 428 1 1 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.104 -0.185 25139 429 1 1 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.754 1.440 25139 430 1 1 . 1 1 128 128 VAL H H 128 8.364 8.364 7.600 0.764 25139 431 1 1 . 1 1 129 129 CYS N N 129 116.130 116.130 121.284 -5.154 25139 432 1 1 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.918 -0.441 25139 433 1 1 . 1 1 129 129 CYS C C 129 170.569 170.569 173.816 -3.247 25139 434 1 1 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.873 -3.724 25139 435 1 1 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.008 18.609 25139 436 1 1 . 1 1 129 129 CYS H H 129 5.390 5.390 7.028 -1.638 25139 437 1 1 . 1 1 130 130 LYS N N 130 120.071 120.071 125.236 -5.165 25139 438 1 1 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.104 0.457 25139 439 1 1 . 1 1 130 130 LYS C C 130 176.853 176.853 174.275 2.578 25139 440 1 1 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.557 -0.670 25139 441 1 1 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.313 1.329 25139 442 1 1 . 1 1 130 130 LYS H H 130 8.066 8.066 7.730 0.336 25139 443 1 1 . 1 1 131 131 PHE N N 131 118.415 118.415 119.649 -1.234 25139 444 1 1 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.428 -0.821 25139 445 1 1 . 1 1 131 131 PHE C C 131 174.013 174.013 175.241 -1.228 25139 446 1 1 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.066 1.645 25139 447 1 1 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.262 0.818 25139 448 1 1 . 1 1 131 131 PHE H H 131 8.714 8.714 8.147 0.567 25139 449 1 1 . 1 1 132 132 ALA N N 132 124.209 124.209 122.824 1.385 25139 450 1 1 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.043 -0.426 25139 451 1 1 . 1 1 132 132 ALA C C 132 174.352 174.352 174.368 -0.016 25139 452 1 1 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.515 1.926 25139 453 1 1 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.862 -0.398 25139 454 1 1 . 1 1 132 132 ALA H H 132 9.295 9.295 9.099 0.196 25139 455 1 1 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.429 -0.546 25139 456 1 1 . 1 1 133 133 PRO C C 133 173.923 173.923 176.504 -2.581 25139 457 1 1 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.650 0.421 25139 458 1 1 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.560 -0.957 25139 459 1 1 . 1 1 134 134 ARG N N 134 126.071 126.071 124.377 1.694 25139 460 1 1 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.751 -0.496 25139 461 1 1 . 1 1 134 134 ARG C C 134 177.065 177.065 175.647 1.418 25139 462 1 1 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.508 2.655 25139 463 1 1 . 1 1 134 134 ARG CB C 134 32.183 32.183 31.833 0.350 25139 464 1 1 . 1 1 134 134 ARG H H 134 8.672 8.672 8.538 0.134 25139 465 1 1 . 1 1 135 135 GLU N N 135 125.683 125.683 120.868 4.815 25139 466 1 1 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.478 -0.125 25139 467 1 1 . 1 1 135 135 GLU C C 135 178.081 178.081 177.346 0.735 25139 468 1 1 . 1 1 135 135 GLU CA C 135 57.651 57.651 56.875 0.776 25139 469 1 1 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.335 -0.339 25139 470 1 1 . 1 1 135 135 GLU H H 135 8.603 8.603 8.870 -0.267 25139 471 1 1 . 1 1 136 136 GLY N N 136 110.031 110.031 108.339 1.692 25139 472 1 1 . 1 1 136 136 GLY C C 136 173.079 173.079 172.491 0.588 25139 473 1 1 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.649 1.129 25139 474 1 1 . 1 1 136 136 GLY H H 136 9.036 9.036 8.212 0.824 25139 475 1 1 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.680 -0.005 25139 476 1 1 . 1 1 137 137 PHE C C 137 174.936 174.936 174.187 0.749 25139 477 1 1 . 1 1 137 137 PHE CA C 137 56.084 56.084 55.940 0.144 25139 478 1 1 . 1 1 137 137 PHE CB C 137 44.696 44.696 43.077 1.619 25139 479 1 1 . 1 1 138 138 ILE N N 138 117.417 117.417 113.513 3.904 25139 480 1 1 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.712 -0.205 25139 481 1 1 . 1 1 138 138 ILE C C 138 173.858 173.858 173.144 0.714 25139 482 1 1 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.683 0.937 25139 483 1 1 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.346 1.251 25139 484 1 1 . 1 1 138 138 ILE H H 138 8.777 8.777 8.966 -0.189 25139 485 1 1 . 1 1 139 139 ASN N N 139 117.201 117.201 117.493 -0.292 25139 486 1 1 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.491 0.568 25139 487 1 1 . 1 1 139 139 ASN C C 139 173.721 173.721 174.279 -0.558 25139 488 1 1 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.545 -1.315 25139 489 1 1 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.147 1.714 25139 490 1 1 . 1 1 139 139 ASN H H 139 8.872 8.872 8.476 0.396 25139 491 1 1 . 1 1 140 140 TYR N N 140 123.991 123.991 120.567 3.424 25139 492 1 1 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.680 0.498 25139 493 1 1 . 1 1 140 140 TYR C C 140 174.791 174.791 175.161 -0.370 25139 494 1 1 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.743 -1.671 25139 495 1 1 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.367 2.304 25139 496 1 1 . 1 1 140 140 TYR H H 140 9.526 9.526 9.061 0.465 25139 497 1 1 . 1 1 141 141 LEU N N 141 122.779 122.779 122.335 0.444 25139 498 1 1 . 1 1 141 141 LEU C C 141 175.404 175.404 177.587 -2.183 25139 499 1 1 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.892 2.211 25139 500 1 1 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.638 -0.477 25139 501 1 1 . 1 1 141 141 LEU H H 141 9.010 9.010 9.059 -0.049 25139 502 1 1 . 1 1 142 142 THR N N 142 113.189 113.189 112.880 0.309 25139 503 1 1 . 1 1 142 142 THR HA H 142 4.061 4.061 4.365 -0.304 25139 504 1 1 . 1 1 142 142 THR C C 142 175.940 175.940 176.395 -0.455 25139 505 1 1 . 1 1 142 142 THR CA C 142 61.389 61.389 60.832 0.557 25139 506 1 1 . 1 1 142 142 THR CB C 142 69.779 69.779 70.545 -0.766 25139 507 1 1 . 1 1 142 142 THR H H 142 7.737 7.737 8.089 -0.352 25139 508 1 1 . 1 1 143 143 ARG N N 143 120.975 120.975 120.793 0.182 25139 509 1 1 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.963 -0.025 25139 510 1 1 . 1 1 143 143 ARG C C 143 178.690 178.690 177.855 0.835 25139 511 1 1 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.257 0.492 25139 512 1 1 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.595 0.551 25139 513 1 1 . 1 1 143 143 ARG H H 143 8.149 8.149 8.229 -0.080 25139 514 1 1 . 1 1 144 144 GLU N N 144 116.997 116.997 119.092 -2.095 25139 515 1 1 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.278 -0.169 25139 516 1 1 . 1 1 144 144 GLU C C 144 178.442 178.442 177.871 0.571 25139 517 1 1 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.796 1.067 25139 518 1 1 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.322 -0.740 25139 519 1 1 . 1 1 144 144 GLU H H 144 8.622 8.622 7.747 0.875 25139 520 1 1 . 1 1 145 145 VAL N N 145 111.213 111.213 116.154 -4.941 25139 521 1 1 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.149 0.262 25139 522 1 1 . 1 1 145 145 VAL C C 145 176.965 176.965 177.301 -0.336 25139 523 1 1 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.563 -0.969 25139 524 1 1 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.433 0.649 25139 525 1 1 . 1 1 145 145 VAL H H 145 7.227 7.227 7.534 -0.307 25139 526 1 1 . 1 1 146 146 TYR N N 146 123.512 123.512 122.642 0.870 25139 527 1 1 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.086 -0.206 25139 528 1 1 . 1 1 146 146 TYR C C 146 176.377 176.377 176.436 -0.059 25139 529 1 1 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.852 -0.315 25139 530 1 1 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.847 -0.508 25139 531 1 1 . 1 1 146 146 TYR H H 146 8.492 8.492 8.764 -0.272 25139 532 1 1 . 1 1 147 147 ARG N N 147 116.680 116.680 116.262 0.418 25139 533 1 1 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.941 -0.127 25139 534 1 1 . 1 1 147 147 ARG C C 147 178.858 178.858 177.900 0.958 25139 535 1 1 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.685 1.010 25139 536 1 1 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.394 0.271 25139 537 1 1 . 1 1 147 147 ARG H H 147 8.053 8.053 8.551 -0.498 25139 538 1 1 . 1 1 148 148 SER N N 148 115.306 115.306 114.056 1.250 25139 539 1 1 . 1 1 148 148 SER HA H 148 3.998 3.998 4.178 -0.180 25139 540 1 1 . 1 1 148 148 SER C C 148 175.786 175.786 175.780 0.006 25139 541 1 1 . 1 1 148 148 SER CA C 148 62.006 62.006 59.405 2.601 25139 542 1 1 . 1 1 148 148 SER H H 148 7.139 7.139 7.490 -0.351 25139 543 1 1 . 1 1 149 149 TYR N N 149 123.207 123.207 122.598 0.609 25139 544 1 1 . 1 1 149 149 TYR C C 149 175.831 175.831 177.826 -1.995 25139 545 1 1 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.507 -0.907 25139 546 1 1 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.455 0.326 25139 547 1 1 . 1 1 149 149 TYR H H 149 7.253 7.253 7.690 -0.437 25139 548 1 1 . 1 1 150 150 ARG N N 150 118.708 118.708 117.091 1.617 25139 549 1 1 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.970 -0.624 25139 550 1 1 . 1 1 150 150 ARG C C 150 177.644 177.644 177.862 -0.218 25139 551 1 1 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.467 -0.144 25139 552 1 1 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.244 -0.390 25139 553 1 1 . 1 1 150 150 ARG H H 150 8.441 8.441 7.491 0.950 25139 554 1 1 . 1 1 151 151 GLN N N 151 116.551 116.551 116.855 -0.304 25139 555 1 1 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.155 -0.198 25139 556 1 1 . 1 1 151 151 GLN C C 151 177.987 177.987 177.413 0.574 25139 557 1 1 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.947 0.394 25139 558 1 1 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.144 0.320 25139 559 1 1 . 1 1 151 151 GLN H H 151 7.332 7.332 7.551 -0.219 25139 560 1 1 . 1 1 152 152 LEU N N 152 118.877 118.877 112.443 6.434 25139 561 1 1 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.579 -0.400 25139 562 1 1 . 1 1 152 152 LEU C C 152 179.070 179.070 177.040 2.030 25139 563 1 1 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.117 1.965 25139 564 1 1 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.271 -0.583 25139 565 1 1 . 1 1 152 152 LEU H H 152 7.106 7.106 7.226 -0.120 25139 566 1 1 . 1 1 153 153 VAL N N 153 119.076 119.076 111.200 7.876 25139 567 1 1 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.180 -1.320 25139 568 1 1 . 1 1 153 153 VAL C C 153 177.421 177.421 176.439 0.982 25139 569 1 1 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.256 2.327 25139 570 1 1 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.289 -1.771 25139 571 1 1 . 1 1 153 153 VAL H H 153 7.427 7.427 7.122 0.305 25139 572 1 1 . 1 1 154 154 ASP N N 154 119.888 119.888 120.044 -0.156 25139 573 1 1 . 1 1 154 154 ASP C C 154 177.422 177.422 175.427 1.995 25139 574 1 1 . 1 1 154 154 ASP CA C 154 56.071 56.071 55.582 0.489 25139 575 1 1 . 1 1 154 154 ASP CB C 154 40.349 40.349 40.647 -0.298 25139 576 1 1 . 1 1 154 154 ASP H H 154 7.930 7.930 7.806 0.124 25139 577 1 1 . 1 1 155 155 HIS N N 155 117.821 117.821 117.210 0.611 25139 578 1 1 . 1 1 155 155 HIS CA C 155 57.756 57.756 54.931 2.825 25139 579 1 1 . 1 1 155 155 HIS CB C 155 30.180 30.180 31.888 -1.708 25139 580 1 1 . 1 1 155 155 HIS H H 155 7.680 7.680 7.749 -0.069 25139 581 1 1 . 1 1 156 156 HIS N N 156 119.180 119.180 120.542 -1.362 25139 582 1 1 . 1 1 156 156 HIS CA C 156 57.931 57.931 55.064 2.867 25139 583 1 1 . 1 1 156 156 HIS CB C 156 30.300 30.300 31.465 -1.165 25139 584 1 1 . 1 1 156 156 HIS H H 156 7.868 7.868 8.380 -0.512 25139 585 1 2 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.747 1.157 25139 586 1 2 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.490 -0.268 25139 587 1 2 . 1 1 49 49 ASP N N 49 119.661 119.661 121.813 -2.152 25139 588 1 2 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.100 0.177 25139 589 1 2 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.746 -0.684 25139 590 1 2 . 1 1 49 49 ASP H H 49 8.462 8.462 8.375 0.087 25139 591 1 2 . 1 1 51 51 LEU HA H 51 4.052 4.052 3.936 0.116 25139 592 1 2 . 1 1 51 51 LEU C C 51 178.514 178.514 178.266 0.248 25139 593 1 2 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.628 0.421 25139 594 1 2 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.013 0.180 25139 595 1 2 . 1 1 52 52 ASN N N 52 113.819 113.819 119.497 -5.678 25139 596 1 2 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.589 0.246 25139 597 1 2 . 1 1 52 52 ASN C C 52 175.964 175.964 176.606 -0.642 25139 598 1 2 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.461 -1.365 25139 599 1 2 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.756 0.127 25139 600 1 2 . 1 1 52 52 ASN H H 52 7.853 7.853 8.464 -0.611 25139 601 1 2 . 1 1 53 53 SER N N 53 114.357 114.357 114.973 -0.616 25139 602 1 2 . 1 1 53 53 SER CA C 53 59.908 59.908 60.411 -0.503 25139 603 1 2 . 1 1 53 53 SER CB C 53 64.395 64.395 63.587 0.808 25139 604 1 2 . 1 1 53 53 SER H H 53 8.023 8.023 7.951 0.072 25139 605 1 2 . 1 1 54 54 PHE N N 54 121.037 121.037 119.121 1.916 25139 606 1 2 . 1 1 54 54 PHE C C 54 175.522 175.522 175.751 -0.229 25139 607 1 2 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.914 1.150 25139 608 1 2 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.673 -0.620 25139 609 1 2 . 1 1 54 54 PHE H H 54 7.731 7.731 7.673 0.058 25139 610 1 2 . 1 1 55 55 THR N N 55 116.535 116.535 117.865 -1.330 25139 611 1 2 . 1 1 55 55 THR HA H 55 4.654 4.654 4.719 -0.065 25139 612 1 2 . 1 1 55 55 THR C C 55 173.301 173.301 173.432 -0.131 25139 613 1 2 . 1 1 55 55 THR CA C 55 61.420 61.420 61.233 0.186 25139 614 1 2 . 1 1 55 55 THR CB C 55 71.388 71.388 71.409 -0.021 25139 615 1 2 . 1 1 55 55 THR H H 55 8.929 8.929 9.282 -0.353 25139 616 1 2 . 1 1 56 56 ALA N N 56 129.359 129.359 128.262 1.097 25139 617 1 2 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.073 0.242 25139 618 1 2 . 1 1 56 56 ALA C C 56 178.305 178.305 177.026 1.279 25139 619 1 2 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.036 0.835 25139 620 1 2 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.331 -0.007 25139 621 1 2 . 1 1 56 56 ALA H H 56 8.907 8.907 8.769 0.138 25139 622 1 2 . 1 1 57 57 GLY N N 57 106.331 106.331 108.977 -2.646 25139 623 1 2 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.551 1.060 25139 624 1 2 . 1 1 57 57 GLY H H 57 7.978 7.978 7.942 0.036 25139 625 1 2 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.338 -0.014 25139 626 1 2 . 1 1 59 59 PRO C C 59 177.466 177.466 177.706 -0.240 25139 627 1 2 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.991 1.493 25139 628 1 2 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.116 -0.381 25139 629 1 2 . 1 1 60 60 GLY N N 60 109.688 109.688 107.545 2.143 25139 630 1 2 . 1 1 60 60 GLY C C 60 173.555 173.555 173.286 0.269 25139 631 1 2 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.071 0.470 25139 632 1 2 . 1 1 60 60 GLY H H 60 8.402 8.402 8.809 -0.407 25139 633 1 2 . 1 1 61 61 PHE N N 61 122.491 122.491 121.875 0.616 25139 634 1 2 . 1 1 61 61 PHE C C 61 175.146 175.146 174.473 0.673 25139 635 1 2 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.555 1.727 25139 636 1 2 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.706 -2.007 25139 637 1 2 . 1 1 61 61 PHE H H 61 7.957 7.957 7.239 0.718 25139 638 1 2 . 1 1 62 62 VAL N N 62 121.128 121.128 118.042 3.086 25139 639 1 2 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.332 -0.247 25139 640 1 2 . 1 1 62 62 VAL C C 62 174.937 174.937 174.811 0.126 25139 641 1 2 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.272 0.436 25139 642 1 2 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.578 0.854 25139 643 1 2 . 1 1 62 62 VAL H H 62 7.994 7.994 8.993 -0.999 25139 644 1 2 . 1 1 63 63 LEU N N 63 124.386 124.386 123.361 1.025 25139 645 1 2 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.759 -1.443 25139 646 1 2 . 1 1 63 63 LEU C C 63 175.278 175.278 177.162 -1.884 25139 647 1 2 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.508 0.780 25139 648 1 2 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.955 1.163 25139 649 1 2 . 1 1 63 63 LEU H H 63 7.572 7.572 8.575 -1.003 25139 650 1 2 . 1 1 64 64 ASP N N 64 126.746 126.746 123.648 3.098 25139 651 1 2 . 1 1 64 64 ASP C C 64 177.801 177.801 177.023 0.778 25139 652 1 2 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.605 -2.884 25139 653 1 2 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.929 -0.531 25139 654 1 2 . 1 1 64 64 ASP H H 64 8.552 8.552 8.476 0.076 25139 655 1 2 . 1 1 65 65 THR C C 65 175.002 175.002 175.300 -0.298 25139 656 1 2 . 1 1 65 65 THR CB C 65 67.919 67.919 66.754 1.165 25139 657 1 2 . 1 1 66 66 GLN N N 66 120.804 120.804 120.401 0.403 25139 658 1 2 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.000 -0.123 25139 659 1 2 . 1 1 66 66 GLN C C 66 178.901 178.901 177.548 1.353 25139 660 1 2 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.392 1.024 25139 661 1 2 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.226 -0.302 25139 662 1 2 . 1 1 66 66 GLN H H 66 8.447 8.447 8.301 0.146 25139 663 1 2 . 1 1 67 67 ALA N N 67 121.267 121.267 121.966 -0.699 25139 664 1 2 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.157 -0.200 25139 665 1 2 . 1 1 67 67 ALA C C 67 176.777 176.777 179.122 -2.345 25139 666 1 2 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.024 0.300 25139 667 1 2 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.282 0.338 25139 668 1 2 . 1 1 67 67 ALA H H 67 7.791 7.791 7.714 0.077 25139 669 1 2 . 1 1 68 68 SER N N 68 113.339 113.339 114.356 -1.017 25139 670 1 2 . 1 1 68 68 SER HA H 68 4.061 4.061 4.064 -0.003 25139 671 1 2 . 1 1 68 68 SER C C 68 175.875 175.875 176.504 -0.629 25139 672 1 2 . 1 1 68 68 SER CA C 68 62.970 62.970 62.142 0.828 25139 673 1 2 . 1 1 68 68 SER CB C 68 61.330 61.330 63.356 -2.026 25139 674 1 2 . 1 1 68 68 SER H H 68 7.785 7.785 7.622 0.163 25139 675 1 2 . 1 1 69 69 VAL N N 69 125.140 125.140 115.790 9.350 25139 676 1 2 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.214 -0.138 25139 677 1 2 . 1 1 69 69 VAL C C 69 176.384 176.384 176.753 -0.369 25139 678 1 2 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.424 1.306 25139 679 1 2 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.569 -0.080 25139 680 1 2 . 1 1 69 69 VAL H H 69 8.572 8.572 7.985 0.587 25139 681 1 2 . 1 1 70 70 SER N N 70 116.704 116.704 114.407 2.297 25139 682 1 2 . 1 1 70 70 SER HA H 70 4.229 4.229 4.286 -0.057 25139 683 1 2 . 1 1 70 70 SER C C 70 174.101 174.101 175.292 -1.191 25139 684 1 2 . 1 1 70 70 SER CA C 70 61.627 61.627 59.623 2.004 25139 685 1 2 . 1 1 70 70 SER H H 70 7.951 7.951 7.694 0.257 25139 686 1 2 . 1 1 71 71 ASN N N 71 117.576 117.576 117.230 0.346 25139 687 1 2 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.675 0.127 25139 688 1 2 . 1 1 71 71 ASN C C 71 174.332 174.332 174.847 -0.515 25139 689 1 2 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.852 -0.414 25139 690 1 2 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.102 0.365 25139 691 1 2 . 1 1 71 71 ASN H H 71 7.131 7.131 7.504 -0.373 25139 692 1 2 . 1 1 72 72 GLY N N 72 103.925 103.925 105.502 -1.577 25139 693 1 2 . 1 1 72 72 GLY C C 72 174.710 174.710 173.522 1.188 25139 694 1 2 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.527 0.022 25139 695 1 2 . 1 1 72 72 GLY H H 72 7.338 7.338 7.354 -0.016 25139 696 1 2 . 1 1 73 73 ALA N N 73 124.942 124.942 123.394 1.548 25139 697 1 2 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.511 -0.339 25139 698 1 2 . 1 1 73 73 ALA C C 73 175.896 175.896 176.255 -0.359 25139 699 1 2 . 1 1 73 73 ALA CA C 73 52.673 52.673 52.054 0.619 25139 700 1 2 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.021 0.035 25139 701 1 2 . 1 1 73 73 ALA H H 73 8.032 8.032 7.676 0.356 25139 702 1 2 . 1 1 74 74 THR N N 74 113.423 113.423 116.558 -3.135 25139 703 1 2 . 1 1 74 74 THR HA H 74 4.678 4.678 4.564 0.114 25139 704 1 2 . 1 1 74 74 THR C C 74 173.339 173.339 173.249 0.090 25139 705 1 2 . 1 1 74 74 THR CA C 74 61.545 61.545 60.610 0.935 25139 706 1 2 . 1 1 74 74 THR CB C 74 71.319 71.319 71.797 -0.478 25139 707 1 2 . 1 1 74 74 THR H H 74 8.530 8.530 8.211 0.319 25139 708 1 2 . 1 1 75 75 PHE N N 75 128.180 128.180 129.214 -1.034 25139 709 1 2 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.903 -0.299 25139 710 1 2 . 1 1 75 75 PHE C C 75 174.623 174.623 174.977 -0.354 25139 711 1 2 . 1 1 75 75 PHE CA C 75 57.616 57.616 58.102 -0.486 25139 712 1 2 . 1 1 75 75 PHE CB C 75 38.675 38.675 39.198 -0.523 25139 713 1 2 . 1 1 75 75 PHE H H 75 9.146 9.146 9.112 0.034 25139 714 1 2 . 1 1 76 76 LEU N N 76 127.849 127.849 125.478 2.371 25139 715 1 2 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.547 -0.196 25139 716 1 2 . 1 1 76 76 LEU C C 76 176.339 176.339 176.125 0.214 25139 717 1 2 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.094 0.889 25139 718 1 2 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.583 -0.253 25139 719 1 2 . 1 1 76 76 LEU H H 76 8.635 8.635 8.027 0.608 25139 720 1 2 . 1 1 77 77 GLU N N 77 115.131 115.131 120.098 -4.967 25139 721 1 2 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.429 -0.021 25139 722 1 2 . 1 1 77 77 GLU C C 77 174.734 174.734 174.343 0.391 25139 723 1 2 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.095 1.258 25139 724 1 2 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.785 0.422 25139 725 1 2 . 1 1 77 77 GLU H H 77 7.252 7.252 7.402 -0.150 25139 726 1 2 . 1 1 78 78 SER N N 78 118.016 118.016 118.620 -0.604 25139 727 1 2 . 1 1 78 78 SER HA H 78 5.561 5.561 5.363 0.198 25139 728 1 2 . 1 1 78 78 SER C C 78 171.968 171.968 172.779 -0.811 25139 729 1 2 . 1 1 78 78 SER CA C 78 54.061 54.061 55.316 -1.255 25139 730 1 2 . 1 1 78 78 SER CB C 78 64.074 64.074 63.640 0.434 25139 731 1 2 . 1 1 78 78 SER H H 78 9.033 9.033 8.567 0.466 25139 732 1 2 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.797 -0.198 25139 733 1 2 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.711 -0.301 25139 734 1 2 . 1 1 80 80 THR N N 80 118.079 118.079 114.696 3.383 25139 735 1 2 . 1 1 80 80 THR HA H 80 4.342 4.342 4.354 -0.012 25139 736 1 2 . 1 1 80 80 THR C C 80 174.494 174.494 174.564 -0.070 25139 737 1 2 . 1 1 80 80 THR CA C 80 61.453 61.453 60.240 1.213 25139 738 1 2 . 1 1 80 80 THR CB C 80 67.797 67.797 68.807 -1.010 25139 739 1 2 . 1 1 80 80 THR H H 80 8.670 8.670 8.251 0.419 25139 740 1 2 . 1 1 81 81 VAL N N 81 117.395 117.395 118.383 -0.988 25139 741 1 2 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.982 0.625 25139 742 1 2 . 1 1 81 81 VAL C C 81 175.518 175.518 176.246 -0.728 25139 743 1 2 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.654 -2.540 25139 744 1 2 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.249 2.346 25139 745 1 2 . 1 1 81 81 VAL H H 81 7.448 7.448 7.423 0.025 25139 746 1 2 . 1 1 82 82 ARG N N 82 117.852 117.852 121.044 -3.192 25139 747 1 2 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.543 -0.022 25139 748 1 2 . 1 1 82 82 ARG C C 82 176.992 176.992 175.652 1.340 25139 749 1 2 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.622 0.763 25139 750 1 2 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.435 1.167 25139 751 1 2 . 1 1 82 82 ARG H H 82 8.710 8.710 8.648 0.062 25139 752 1 2 . 1 1 83 83 ARG N N 83 117.035 117.035 118.318 -1.283 25139 753 1 2 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.822 0.500 25139 754 1 2 . 1 1 83 83 ARG C C 83 177.379 177.379 176.725 0.654 25139 755 1 2 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.544 -0.860 25139 756 1 2 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.803 -0.762 25139 757 1 2 . 1 1 83 83 ARG H H 83 7.292 7.292 7.300 -0.008 25139 758 1 2 . 1 1 84 84 GLY N N 84 114.911 114.911 110.205 4.706 25139 759 1 2 . 1 1 84 84 GLY C C 84 176.940 176.940 175.175 1.765 25139 760 1 2 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.833 1.839 25139 761 1 2 . 1 1 84 84 GLY H H 84 9.255 9.255 8.334 0.921 25139 762 1 2 . 1 1 85 85 TRP N N 85 121.810 121.810 119.853 1.957 25139 763 1 2 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.145 0.022 25139 764 1 2 . 1 1 85 85 TRP C C 85 178.272 178.272 177.629 0.643 25139 765 1 2 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.052 0.993 25139 766 1 2 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.161 0.056 25139 767 1 2 . 1 1 85 85 TRP H H 85 9.963 9.963 8.089 1.874 25139 768 1 2 . 1 1 86 86 ASP N N 86 116.400 116.400 120.039 -3.639 25139 769 1 2 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.445 -0.052 25139 770 1 2 . 1 1 86 86 ASP C C 86 178.803 178.803 178.125 0.678 25139 771 1 2 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.943 0.111 25139 772 1 2 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.246 0.487 25139 773 1 2 . 1 1 86 86 ASP H H 86 6.934 6.934 7.596 -0.662 25139 774 1 2 . 1 1 87 87 CYS N N 87 122.454 122.454 119.326 3.128 25139 775 1 2 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.226 0.024 25139 776 1 2 . 1 1 87 87 CYS C C 87 174.956 174.956 176.657 -1.701 25139 777 1 2 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.485 -4.338 25139 778 1 2 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.215 11.270 25139 779 1 2 . 1 1 87 87 CYS H H 87 7.603 7.603 7.507 0.096 25139 780 1 2 . 1 1 88 88 VAL N N 88 119.192 119.192 120.657 -1.465 25139 781 1 2 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.459 -1.001 25139 782 1 2 . 1 1 88 88 VAL C C 88 177.413 177.413 176.526 0.887 25139 783 1 2 . 1 1 88 88 VAL CA C 88 66.976 66.976 64.928 2.048 25139 784 1 2 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.525 -1.283 25139 785 1 2 . 1 1 88 88 VAL H H 88 7.192 7.192 7.319 -0.127 25139 786 1 2 . 1 1 89 89 ARG N N 89 118.185 118.185 119.110 -0.925 25139 787 1 2 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.868 -0.188 25139 788 1 2 . 1 1 89 89 ARG C C 89 178.677 178.677 177.982 0.695 25139 789 1 2 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.001 0.954 25139 790 1 2 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.267 0.524 25139 791 1 2 . 1 1 89 89 ARG H H 89 7.971 7.971 7.829 0.142 25139 792 1 2 . 1 1 90 90 ALA N N 90 120.815 120.815 122.636 -1.821 25139 793 1 2 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.120 -0.045 25139 794 1 2 . 1 1 90 90 ALA C C 90 177.416 177.416 179.394 -1.978 25139 795 1 2 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.601 -0.347 25139 796 1 2 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.105 -0.669 25139 797 1 2 . 1 1 90 90 ALA H H 90 7.453 7.453 7.408 0.045 25139 798 1 2 . 1 1 91 91 CYS N N 91 120.380 120.380 116.211 4.169 25139 799 1 2 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.212 0.159 25139 800 1 2 . 1 1 91 91 CYS C C 91 176.654 176.654 175.928 0.726 25139 801 1 2 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.707 -4.012 25139 802 1 2 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.055 12.649 25139 803 1 2 . 1 1 91 91 CYS H H 91 7.944 7.944 7.562 0.382 25139 804 1 2 . 1 1 92 92 CYS N N 92 116.270 116.270 119.005 -2.735 25139 805 1 2 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.499 -0.095 25139 806 1 2 . 1 1 92 92 CYS C C 92 175.628 175.628 176.726 -1.098 25139 807 1 2 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.803 -3.097 25139 808 1 2 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.088 15.061 25139 809 1 2 . 1 1 92 92 CYS H H 92 8.315 8.315 7.695 0.620 25139 810 1 2 . 1 1 93 93 THR N N 93 107.283 107.283 112.557 -5.274 25139 811 1 2 . 1 1 93 93 THR HA H 93 4.481 4.481 4.184 0.297 25139 812 1 2 . 1 1 93 93 THR C C 93 173.606 173.606 175.358 -1.752 25139 813 1 2 . 1 1 93 93 THR CA C 93 61.402 61.402 64.375 -2.973 25139 814 1 2 . 1 1 93 93 THR CB C 93 69.046 69.046 68.702 0.344 25139 815 1 2 . 1 1 93 93 THR H H 93 7.445 7.445 7.465 -0.020 25139 816 1 2 . 1 1 94 94 THR N N 94 121.432 121.432 121.552 -0.120 25139 817 1 2 . 1 1 94 94 THR HA H 94 4.398 4.398 4.414 -0.016 25139 818 1 2 . 1 1 94 94 THR C C 94 173.493 173.493 174.778 -1.285 25139 819 1 2 . 1 1 94 94 THR CA C 94 62.726 62.726 62.599 0.127 25139 820 1 2 . 1 1 94 94 THR CB C 94 69.704 69.704 68.767 0.937 25139 821 1 2 . 1 1 94 94 THR H H 94 7.553 7.553 7.971 -0.418 25139 822 1 2 . 1 1 95 95 GLN N N 95 129.410 129.410 128.357 1.053 25139 823 1 2 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.012 -0.068 25139 824 1 2 . 1 1 95 95 GLN C C 95 176.293 176.293 176.624 -0.331 25139 825 1 2 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.724 -0.684 25139 826 1 2 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.880 -0.624 25139 827 1 2 . 1 1 95 95 GLN H H 95 8.812 8.812 8.964 -0.152 25139 828 1 2 . 1 1 96 96 ASN N N 96 115.015 115.015 114.934 0.081 25139 829 1 2 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.728 -0.529 25139 830 1 2 . 1 1 96 96 ASN C C 96 172.260 172.260 173.755 -1.495 25139 831 1 2 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.367 2.200 25139 832 1 2 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.787 -1.950 25139 833 1 2 . 1 1 96 96 ASN H H 96 8.791 8.791 8.115 0.676 25139 834 1 2 . 1 1 97 97 CYS N N 97 115.830 115.830 119.754 -3.924 25139 835 1 2 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.486 -0.385 25139 836 1 2 . 1 1 97 97 CYS C C 97 175.025 175.025 174.149 0.876 25139 837 1 2 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.944 -1.796 25139 838 1 2 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.873 16.360 25139 839 1 2 . 1 1 97 97 CYS H H 97 7.651 7.651 7.627 0.024 25139 840 1 2 . 1 1 98 98 ASN N N 98 125.148 125.148 125.304 -0.156 25139 841 1 2 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.011 0.122 25139 842 1 2 . 1 1 98 98 ASN C C 98 171.892 171.892 174.124 -2.232 25139 843 1 2 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.318 -0.124 25139 844 1 2 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.418 -1.470 25139 845 1 2 . 1 1 98 98 ASN H H 98 8.736 8.736 8.476 0.260 25139 846 1 2 . 1 1 99 99 LEU N N 99 120.898 120.898 121.039 -0.141 25139 847 1 2 . 1 1 99 99 LEU C C 99 173.084 173.084 174.226 -1.142 25139 848 1 2 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.809 2.311 25139 849 1 2 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.520 -1.192 25139 850 1 2 . 1 1 99 99 LEU H H 99 8.200 8.200 8.110 0.090 25139 851 1 2 . 1 1 100 100 ALA N N 100 128.085 128.085 130.272 -2.187 25139 852 1 2 . 1 1 100 100 ALA C C 100 174.938 174.938 175.682 -0.744 25139 853 1 2 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.584 -0.837 25139 854 1 2 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.085 0.629 25139 855 1 2 . 1 1 100 100 ALA H H 100 9.156 9.156 9.192 -0.036 25139 856 1 2 . 1 1 101 101 LEU N N 101 128.723 128.723 126.963 1.760 25139 857 1 2 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.138 0.004 25139 858 1 2 . 1 1 101 101 LEU C C 101 174.379 174.379 175.441 -1.062 25139 859 1 2 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.828 -0.974 25139 860 1 2 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.346 0.960 25139 861 1 2 . 1 1 101 101 LEU H H 101 9.578 9.578 8.831 0.747 25139 862 1 2 . 1 1 102 102 VAL N N 102 119.417 119.417 119.628 -0.211 25139 863 1 2 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.124 0.404 25139 864 1 2 . 1 1 102 102 VAL C C 102 173.660 173.660 173.706 -0.046 25139 865 1 2 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.998 -0.378 25139 866 1 2 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.012 -1.739 25139 867 1 2 . 1 1 102 102 VAL H H 102 9.297 9.297 9.382 -0.085 25139 868 1 2 . 1 1 103 103 GLU N N 103 124.427 124.427 123.626 0.801 25139 869 1 2 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.226 -0.361 25139 870 1 2 . 1 1 103 103 GLU C C 103 176.319 176.319 175.385 0.934 25139 871 1 2 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.088 0.013 25139 872 1 2 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.921 0.280 25139 873 1 2 . 1 1 103 103 GLU H H 103 7.749 7.749 8.149 -0.400 25139 874 1 2 . 1 1 104 104 LEU N N 104 127.294 127.294 125.770 1.524 25139 875 1 2 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.481 -0.161 25139 876 1 2 . 1 1 104 104 LEU C C 104 176.593 176.593 177.822 -1.229 25139 877 1 2 . 1 1 104 104 LEU CA C 104 56.084 56.084 52.895 3.189 25139 878 1 2 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.749 -0.358 25139 879 1 2 . 1 1 104 104 LEU H H 104 8.323 8.323 8.460 -0.137 25139 880 1 2 . 1 1 105 105 GLN N N 105 121.361 121.361 117.141 4.220 25139 881 1 2 . 1 1 105 105 GLN C C 105 172.868 172.868 174.678 -1.810 25139 882 1 2 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.458 -3.052 25139 883 1 2 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.904 1.825 25139 884 1 2 . 1 1 105 105 GLN H H 105 8.095 8.095 8.311 -0.216 25139 885 1 2 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.507 -0.098 25139 886 1 2 . 1 1 106 106 PRO C C 106 177.770 177.770 176.866 0.904 25139 887 1 2 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.555 -0.070 25139 888 1 2 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.117 -0.349 25139 889 1 2 . 1 1 107 107 ASP N N 107 116.484 116.484 116.085 0.399 25139 890 1 2 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.563 -0.123 25139 891 1 2 . 1 1 107 107 ASP C C 107 176.749 176.749 176.057 0.692 25139 892 1 2 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.373 0.082 25139 893 1 2 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.022 -1.133 25139 894 1 2 . 1 1 107 107 ASP H H 107 8.638 8.638 8.481 0.157 25139 895 1 2 . 1 1 108 108 ARG N N 108 117.895 117.895 120.663 -2.768 25139 896 1 2 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.718 -0.228 25139 897 1 2 . 1 1 108 108 ARG C C 108 176.111 176.111 176.926 -0.815 25139 898 1 2 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.281 -0.016 25139 899 1 2 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.054 0.022 25139 900 1 2 . 1 1 108 108 ARG H H 108 7.905 7.905 8.393 -0.488 25139 901 1 2 . 1 1 109 109 GLY N N 109 108.307 108.307 108.984 -0.677 25139 902 1 2 . 1 1 109 109 GLY C C 109 173.949 173.949 174.417 -0.468 25139 903 1 2 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.445 -0.894 25139 904 1 2 . 1 1 109 109 GLY H H 109 7.753 7.753 8.222 -0.469 25139 905 1 2 . 1 1 110 110 GLU N N 110 120.035 120.035 122.681 -2.646 25139 906 1 2 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.458 -0.367 25139 907 1 2 . 1 1 110 110 GLU C C 110 177.045 177.045 176.260 0.785 25139 908 1 2 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.406 1.876 25139 909 1 2 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.441 -1.768 25139 910 1 2 . 1 1 110 110 GLU H H 110 8.509 8.509 8.374 0.135 25139 911 1 2 . 1 1 111 111 ASP N N 111 121.160 121.160 119.905 1.255 25139 912 1 2 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.485 0.085 25139 913 1 2 . 1 1 111 111 ASP C C 111 175.089 175.089 175.529 -0.440 25139 914 1 2 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.053 -1.462 25139 915 1 2 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.175 1.257 25139 916 1 2 . 1 1 111 111 ASP H H 111 8.916 8.916 8.627 0.289 25139 917 1 2 . 1 1 112 112 ALA N N 112 122.130 122.130 118.812 3.318 25139 918 1 2 . 1 1 112 112 ALA C C 112 178.120 178.120 176.242 1.878 25139 919 1 2 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.447 2.812 25139 920 1 2 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.235 -1.465 25139 921 1 2 . 1 1 112 112 ALA H H 112 7.361 7.361 7.456 -0.095 25139 922 1 2 . 1 1 113 113 ILE N N 113 113.780 113.780 114.571 -0.791 25139 923 1 2 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.722 0.164 25139 924 1 2 . 1 1 113 113 ILE C C 113 174.258 174.258 174.777 -0.519 25139 925 1 2 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.278 0.234 25139 926 1 2 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.726 0.122 25139 927 1 2 . 1 1 113 113 ILE H H 113 7.667 7.667 8.312 -0.645 25139 928 1 2 . 1 1 114 114 ALA N N 114 122.673 122.673 125.280 -2.607 25139 929 1 2 . 1 1 114 114 ALA C C 114 176.984 176.984 176.742 0.242 25139 930 1 2 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.026 -1.462 25139 931 1 2 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.611 0.971 25139 932 1 2 . 1 1 114 114 ALA H H 114 8.904 8.904 8.774 0.130 25139 933 1 2 . 1 1 115 115 ALA N N 115 116.486 116.486 116.761 -0.275 25139 934 1 2 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.430 -0.075 25139 935 1 2 . 1 1 115 115 ALA C C 115 174.138 174.138 174.097 0.041 25139 936 1 2 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.817 1.503 25139 937 1 2 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.424 1.559 25139 938 1 2 . 1 1 115 115 ALA H H 115 7.182 7.182 7.194 -0.012 25139 939 1 2 . 1 1 116 116 CYS N N 116 120.099 120.099 119.493 0.606 25139 940 1 2 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.160 0.171 25139 941 1 2 . 1 1 116 116 CYS C C 116 176.609 176.609 172.474 4.135 25139 942 1 2 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.300 -2.351 25139 943 1 2 . 1 1 116 116 CYS CB C 116 40.384 40.384 29.019 11.365 25139 944 1 2 . 1 1 116 116 CYS H H 116 8.298 8.298 7.798 0.500 25139 945 1 2 . 1 1 117 117 PHE N N 117 126.406 126.406 125.529 0.877 25139 946 1 2 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.206 -0.007 25139 947 1 2 . 1 1 117 117 PHE C C 117 173.385 173.385 174.238 -0.853 25139 948 1 2 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.176 0.078 25139 949 1 2 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.323 0.358 25139 950 1 2 . 1 1 117 117 PHE H H 117 9.712 9.712 9.084 0.628 25139 951 1 2 . 1 1 118 118 LEU N N 118 122.119 122.119 124.597 -2.478 25139 952 1 2 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.386 -0.220 25139 953 1 2 . 1 1 118 118 LEU C C 118 175.097 175.097 176.083 -0.986 25139 954 1 2 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.465 -0.561 25139 955 1 2 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.418 -1.120 25139 956 1 2 . 1 1 118 118 LEU H H 118 8.719 8.719 8.972 -0.253 25139 957 1 2 . 1 1 119 119 ILE N N 119 125.324 125.324 122.910 2.414 25139 958 1 2 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.977 -0.100 25139 959 1 2 . 1 1 119 119 ILE C C 119 173.825 173.825 175.449 -1.624 25139 960 1 2 . 1 1 119 119 ILE CA C 119 59.107 59.107 60.002 -0.895 25139 961 1 2 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.345 -0.835 25139 962 1 2 . 1 1 119 119 ILE H H 119 8.986 8.986 8.835 0.151 25139 963 1 2 . 1 1 120 120 ASN N N 120 121.534 121.534 124.540 -3.006 25139 964 1 2 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.730 0.660 25139 965 1 2 . 1 1 120 120 ASN C C 120 176.098 176.098 176.065 0.033 25139 966 1 2 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.484 -4.027 25139 967 1 2 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.929 0.988 25139 968 1 2 . 1 1 120 120 ASN H H 120 8.694 8.694 9.069 -0.375 25139 969 1 2 . 1 1 121 121 CYS N N 121 122.779 122.779 116.504 6.275 25139 970 1 2 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.098 0.385 25139 971 1 2 . 1 1 121 121 CYS C C 121 173.195 173.195 173.431 -0.236 25139 972 1 2 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.799 -4.035 25139 973 1 2 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.841 15.866 25139 974 1 2 . 1 1 121 121 CYS H H 121 10.668 10.668 8.618 2.050 25139 975 1 2 . 1 1 122 122 LEU N N 122 121.063 121.063 117.807 3.256 25139 976 1 2 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.585 -0.220 25139 977 1 2 . 1 1 122 122 LEU C C 122 176.743 176.743 175.841 0.902 25139 978 1 2 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.170 0.494 25139 979 1 2 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.426 -1.192 25139 980 1 2 . 1 1 122 122 LEU H H 122 8.256 8.256 7.839 0.417 25139 981 1 2 . 1 1 123 123 TYR N N 123 123.081 123.081 123.720 -0.639 25139 982 1 2 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.753 -0.710 25139 983 1 2 . 1 1 123 123 TYR C C 123 173.633 173.633 175.047 -1.414 25139 984 1 2 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.011 -0.123 25139 985 1 2 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.847 -0.766 25139 986 1 2 . 1 1 123 123 TYR H H 123 8.990 8.990 8.997 -0.007 25139 987 1 2 . 1 1 124 124 GLU N N 124 128.742 128.742 127.023 1.719 25139 988 1 2 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.720 -0.170 25139 989 1 2 . 1 1 124 124 GLU C C 124 174.835 174.835 175.425 -0.590 25139 990 1 2 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.442 0.190 25139 991 1 2 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.226 -0.331 25139 992 1 2 . 1 1 124 124 GLU H H 124 9.135 9.135 8.753 0.382 25139 993 1 2 . 1 1 125 125 GLN N N 125 108.066 108.066 109.019 -0.953 25139 994 1 2 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.852 -0.131 25139 995 1 2 . 1 1 125 125 GLN C C 125 174.627 174.627 174.599 0.028 25139 996 1 2 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.763 0.276 25139 997 1 2 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.700 -0.372 25139 998 1 2 . 1 1 125 125 GLN H H 125 8.390 8.390 8.446 -0.056 25139 999 1 2 . 1 1 126 126 ASN N N 126 118.528 118.528 117.405 1.123 25139 1000 1 2 . 1 1 126 126 ASN C C 126 173.713 173.713 174.706 -0.993 25139 1001 1 2 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.717 -0.528 25139 1002 1 2 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.729 1.072 25139 1003 1 2 . 1 1 126 126 ASN H H 126 8.092 8.092 7.913 0.179 25139 1004 1 2 . 1 1 127 127 PHE N N 127 124.680 124.680 122.427 2.253 25139 1005 1 2 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.794 0.243 25139 1006 1 2 . 1 1 127 127 PHE C C 127 177.125 177.125 176.476 0.649 25139 1007 1 2 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.984 1.429 25139 1008 1 2 . 1 1 127 127 PHE CB C 127 39.244 39.244 37.984 1.260 25139 1009 1 2 . 1 1 127 127 PHE H H 127 9.026 9.026 8.876 0.150 25139 1010 1 2 . 1 1 128 128 VAL N N 128 119.455 119.455 119.446 0.009 25139 1011 1 2 . 1 1 128 128 VAL C C 128 175.886 175.886 175.500 0.386 25139 1012 1 2 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.937 -1.018 25139 1013 1 2 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.829 2.365 25139 1014 1 2 . 1 1 128 128 VAL H H 128 8.364 8.364 7.630 0.734 25139 1015 1 2 . 1 1 129 129 CYS N N 129 116.130 116.130 119.904 -3.774 25139 1016 1 2 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.796 -0.319 25139 1017 1 2 . 1 1 129 129 CYS C C 129 170.569 170.569 174.318 -3.749 25139 1018 1 2 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.662 -3.512 25139 1019 1 2 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.482 19.135 25139 1020 1 2 . 1 1 129 129 CYS H H 129 5.390 5.390 7.208 -1.818 25139 1021 1 2 . 1 1 130 130 LYS N N 130 120.071 120.071 126.739 -6.668 25139 1022 1 2 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.235 0.326 25139 1023 1 2 . 1 1 130 130 LYS C C 130 176.853 176.853 174.600 2.253 25139 1024 1 2 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.884 0.003 25139 1025 1 2 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.494 1.148 25139 1026 1 2 . 1 1 130 130 LYS H H 130 8.066 8.066 8.544 -0.478 25139 1027 1 2 . 1 1 131 131 PHE N N 131 118.415 118.415 119.956 -1.541 25139 1028 1 2 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.423 -0.816 25139 1029 1 2 . 1 1 131 131 PHE C C 131 174.013 174.013 175.263 -1.250 25139 1030 1 2 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.139 1.573 25139 1031 1 2 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.311 0.769 25139 1032 1 2 . 1 1 131 131 PHE H H 131 8.714 8.714 8.238 0.476 25139 1033 1 2 . 1 1 132 132 ALA N N 132 124.209 124.209 122.720 1.489 25139 1034 1 2 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.035 -0.418 25139 1035 1 2 . 1 1 132 132 ALA C C 132 174.352 174.352 174.349 0.003 25139 1036 1 2 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.493 1.948 25139 1037 1 2 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.811 -0.346 25139 1038 1 2 . 1 1 132 132 ALA H H 132 9.295 9.295 9.133 0.162 25139 1039 1 2 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.312 -0.429 25139 1040 1 2 . 1 1 133 133 PRO C C 133 173.923 173.923 176.490 -2.567 25139 1041 1 2 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.631 0.440 25139 1042 1 2 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.350 -0.747 25139 1043 1 2 . 1 1 134 134 ARG N N 134 126.071 126.071 122.493 3.578 25139 1044 1 2 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.624 -0.369 25139 1045 1 2 . 1 1 134 134 ARG C C 134 177.065 177.065 176.159 0.906 25139 1046 1 2 . 1 1 134 134 ARG CA C 134 57.164 57.164 56.260 0.904 25139 1047 1 2 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.471 -1.288 25139 1048 1 2 . 1 1 134 134 ARG H H 134 8.672 8.672 8.652 0.020 25139 1049 1 2 . 1 1 135 135 GLU N N 135 125.683 125.683 122.144 3.539 25139 1050 1 2 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.508 -0.155 25139 1051 1 2 . 1 1 135 135 GLU C C 135 178.081 178.081 177.333 0.748 25139 1052 1 2 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.339 0.312 25139 1053 1 2 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.139 -0.143 25139 1054 1 2 . 1 1 135 135 GLU H H 135 8.603 8.603 8.878 -0.275 25139 1055 1 2 . 1 1 136 136 GLY N N 136 110.031 110.031 107.518 2.513 25139 1056 1 2 . 1 1 136 136 GLY C C 136 173.079 173.079 172.777 0.302 25139 1057 1 2 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.796 0.982 25139 1058 1 2 . 1 1 136 136 GLY H H 136 9.036 9.036 8.270 0.766 25139 1059 1 2 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.627 0.048 25139 1060 1 2 . 1 1 137 137 PHE C C 137 174.936 174.936 174.114 0.822 25139 1061 1 2 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.264 -0.180 25139 1062 1 2 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.977 1.719 25139 1063 1 2 . 1 1 138 138 ILE N N 138 117.417 117.417 115.039 2.378 25139 1064 1 2 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.682 -0.175 25139 1065 1 2 . 1 1 138 138 ILE C C 138 173.858 173.858 173.311 0.547 25139 1066 1 2 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.580 1.040 25139 1067 1 2 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.257 1.340 25139 1068 1 2 . 1 1 138 138 ILE H H 138 8.777 8.777 8.694 0.083 25139 1069 1 2 . 1 1 139 139 ASN N N 139 117.201 117.201 116.858 0.343 25139 1070 1 2 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.423 0.636 25139 1071 1 2 . 1 1 139 139 ASN C C 139 173.721 173.721 174.129 -0.408 25139 1072 1 2 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.904 -1.673 25139 1073 1 2 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.402 1.459 25139 1074 1 2 . 1 1 139 139 ASN H H 139 8.872 8.872 8.286 0.586 25139 1075 1 2 . 1 1 140 140 TYR N N 140 123.991 123.991 119.913 4.078 25139 1076 1 2 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.590 0.588 25139 1077 1 2 . 1 1 140 140 TYR C C 140 174.791 174.791 175.191 -0.400 25139 1078 1 2 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.810 -1.738 25139 1079 1 2 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.584 2.086 25139 1080 1 2 . 1 1 140 140 TYR H H 140 9.526 9.526 8.574 0.952 25139 1081 1 2 . 1 1 141 141 LEU N N 141 122.779 122.779 120.483 2.296 25139 1082 1 2 . 1 1 141 141 LEU C C 141 175.404 175.404 177.479 -2.075 25139 1083 1 2 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.934 2.169 25139 1084 1 2 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.989 -0.828 25139 1085 1 2 . 1 1 141 141 LEU H H 141 9.010 9.010 8.945 0.065 25139 1086 1 2 . 1 1 142 142 THR N N 142 113.189 113.189 112.877 0.312 25139 1087 1 2 . 1 1 142 142 THR HA H 142 4.061 4.061 4.394 -0.333 25139 1088 1 2 . 1 1 142 142 THR C C 142 175.940 175.940 176.261 -0.321 25139 1089 1 2 . 1 1 142 142 THR CA C 142 61.389 61.389 60.162 1.227 25139 1090 1 2 . 1 1 142 142 THR CB C 142 69.779 69.779 70.405 -0.626 25139 1091 1 2 . 1 1 142 142 THR H H 142 7.737 7.737 8.138 -0.401 25139 1092 1 2 . 1 1 143 143 ARG N N 143 120.975 120.975 119.726 1.249 25139 1093 1 2 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.954 -0.016 25139 1094 1 2 . 1 1 143 143 ARG C C 143 178.690 178.690 178.042 0.648 25139 1095 1 2 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.726 1.022 25139 1096 1 2 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.368 0.777 25139 1097 1 2 . 1 1 143 143 ARG H H 143 8.149 8.149 8.449 -0.300 25139 1098 1 2 . 1 1 144 144 GLU N N 144 116.997 116.997 117.433 -0.436 25139 1099 1 2 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.198 -0.089 25139 1100 1 2 . 1 1 144 144 GLU C C 144 178.442 178.442 177.816 0.626 25139 1101 1 2 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.697 1.166 25139 1102 1 2 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.781 -0.199 25139 1103 1 2 . 1 1 144 144 GLU H H 144 8.622 8.622 7.703 0.919 25139 1104 1 2 . 1 1 145 145 VAL N N 145 111.213 111.213 115.683 -4.470 25139 1105 1 2 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.994 0.417 25139 1106 1 2 . 1 1 145 145 VAL C C 145 176.965 176.965 177.093 -0.128 25139 1107 1 2 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.379 -0.785 25139 1108 1 2 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.750 0.332 25139 1109 1 2 . 1 1 145 145 VAL H H 145 7.227 7.227 7.332 -0.105 25139 1110 1 2 . 1 1 146 146 TYR N N 146 123.512 123.512 122.477 1.035 25139 1111 1 2 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.017 -0.137 25139 1112 1 2 . 1 1 146 146 TYR C C 146 176.377 176.377 176.608 -0.231 25139 1113 1 2 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.579 -0.042 25139 1114 1 2 . 1 1 146 146 TYR CB C 146 38.339 38.339 39.009 -0.670 25139 1115 1 2 . 1 1 146 146 TYR H H 146 8.492 8.492 8.679 -0.187 25139 1116 1 2 . 1 1 147 147 ARG N N 147 116.680 116.680 116.416 0.264 25139 1117 1 2 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.949 -0.135 25139 1118 1 2 . 1 1 147 147 ARG C C 147 178.858 178.858 177.724 1.134 25139 1119 1 2 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.653 1.043 25139 1120 1 2 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.393 0.272 25139 1121 1 2 . 1 1 147 147 ARG H H 147 8.053 8.053 8.532 -0.479 25139 1122 1 2 . 1 1 148 148 SER N N 148 115.306 115.306 113.896 1.410 25139 1123 1 2 . 1 1 148 148 SER HA H 148 3.998 3.998 4.248 -0.250 25139 1124 1 2 . 1 1 148 148 SER C C 148 175.786 175.786 175.798 -0.012 25139 1125 1 2 . 1 1 148 148 SER CA C 148 62.006 62.006 59.405 2.601 25139 1126 1 2 . 1 1 148 148 SER H H 148 7.139 7.139 7.426 -0.287 25139 1127 1 2 . 1 1 149 149 TYR N N 149 123.207 123.207 122.766 0.441 25139 1128 1 2 . 1 1 149 149 TYR C C 149 175.831 175.831 176.927 -1.096 25139 1129 1 2 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.570 -0.970 25139 1130 1 2 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.521 0.260 25139 1131 1 2 . 1 1 149 149 TYR H H 149 7.253 7.253 7.640 -0.387 25139 1132 1 2 . 1 1 150 150 ARG N N 150 118.708 118.708 116.348 2.360 25139 1133 1 2 . 1 1 150 150 ARG HA H 150 3.346 3.346 4.023 -0.677 25139 1134 1 2 . 1 1 150 150 ARG C C 150 177.644 177.644 178.346 -0.702 25139 1135 1 2 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.810 -0.487 25139 1136 1 2 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.578 -0.724 25139 1137 1 2 . 1 1 150 150 ARG H H 150 8.441 8.441 7.426 1.015 25139 1138 1 2 . 1 1 151 151 GLN N N 151 116.551 116.551 115.846 0.705 25139 1139 1 2 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.113 -0.156 25139 1140 1 2 . 1 1 151 151 GLN C C 151 177.987 177.987 177.312 0.675 25139 1141 1 2 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.438 0.902 25139 1142 1 2 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.317 0.147 25139 1143 1 2 . 1 1 151 151 GLN H H 151 7.332 7.332 7.478 -0.146 25139 1144 1 2 . 1 1 152 152 LEU N N 152 118.877 118.877 113.529 5.348 25139 1145 1 2 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.617 -0.438 25139 1146 1 2 . 1 1 152 152 LEU C C 152 179.070 179.070 177.490 1.580 25139 1147 1 2 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.559 1.522 25139 1148 1 2 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.150 -0.462 25139 1149 1 2 . 1 1 152 152 LEU H H 152 7.106 7.106 7.388 -0.282 25139 1150 1 2 . 1 1 153 153 VAL N N 153 119.076 119.076 114.385 4.691 25139 1151 1 2 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.149 -1.289 25139 1152 1 2 . 1 1 153 153 VAL C C 153 177.421 177.421 176.150 1.271 25139 1153 1 2 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.018 2.565 25139 1154 1 2 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.233 -1.715 25139 1155 1 2 . 1 1 153 153 VAL H H 153 7.427 7.427 7.256 0.171 25139 1156 1 2 . 1 1 154 154 ASP N N 154 119.888 119.888 122.990 -3.102 25139 1157 1 2 . 1 1 154 154 ASP C C 154 177.422 177.422 175.494 1.928 25139 1158 1 2 . 1 1 154 154 ASP CA C 154 56.071 56.071 55.498 0.573 25139 1159 1 2 . 1 1 154 154 ASP CB C 154 40.349 40.349 41.334 -0.985 25139 1160 1 2 . 1 1 154 154 ASP H H 154 7.930 7.930 7.628 0.302 25139 1161 1 2 . 1 1 155 155 HIS N N 155 117.821 117.821 117.846 -0.025 25139 1162 1 2 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.040 2.716 25139 1163 1 2 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.368 -0.188 25139 1164 1 2 . 1 1 155 155 HIS H H 155 7.680 7.680 7.766 -0.086 25139 1165 1 2 . 1 1 156 156 HIS N N 156 119.180 119.180 118.580 0.600 25139 1166 1 2 . 1 1 156 156 HIS CA C 156 57.931 57.931 56.495 1.436 25139 1167 1 2 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.769 -0.469 25139 1168 1 2 . 1 1 156 156 HIS H H 156 7.868 7.868 8.788 -0.920 25139 1169 1 3 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.414 1.490 25139 1170 1 3 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.900 -0.678 25139 1171 1 3 . 1 1 49 49 ASP N N 49 119.661 119.661 122.380 -2.719 25139 1172 1 3 . 1 1 49 49 ASP CA C 49 54.277 54.277 55.971 -1.694 25139 1173 1 3 . 1 1 49 49 ASP CB C 49 41.062 41.062 40.458 0.604 25139 1174 1 3 . 1 1 49 49 ASP H H 49 8.462 8.462 8.719 -0.257 25139 1175 1 3 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.338 -0.286 25139 1176 1 3 . 1 1 51 51 LEU C C 51 178.514 178.514 177.978 0.536 25139 1177 1 3 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.952 1.097 25139 1178 1 3 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.819 -0.626 25139 1179 1 3 . 1 1 52 52 ASN N N 52 113.819 113.819 115.316 -1.497 25139 1180 1 3 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.794 0.041 25139 1181 1 3 . 1 1 52 52 ASN C C 52 175.964 175.964 175.690 0.274 25139 1182 1 3 . 1 1 52 52 ASN CA C 52 54.096 54.096 54.424 -0.328 25139 1183 1 3 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.022 -0.139 25139 1184 1 3 . 1 1 52 52 ASN H H 52 7.853 7.853 7.786 0.067 25139 1185 1 3 . 1 1 53 53 SER N N 53 114.357 114.357 115.240 -0.883 25139 1186 1 3 . 1 1 53 53 SER CA C 53 59.908 59.908 57.968 1.940 25139 1187 1 3 . 1 1 53 53 SER CB C 53 64.395 64.395 63.590 0.805 25139 1188 1 3 . 1 1 53 53 SER H H 53 8.023 8.023 7.668 0.355 25139 1189 1 3 . 1 1 54 54 PHE N N 54 121.037 121.037 118.361 2.676 25139 1190 1 3 . 1 1 54 54 PHE C C 54 175.522 175.522 175.021 0.501 25139 1191 1 3 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.948 1.116 25139 1192 1 3 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.285 -0.232 25139 1193 1 3 . 1 1 54 54 PHE H H 54 7.731 7.731 7.563 0.168 25139 1194 1 3 . 1 1 55 55 THR N N 55 116.535 116.535 117.687 -1.152 25139 1195 1 3 . 1 1 55 55 THR HA H 55 4.654 4.654 4.712 -0.058 25139 1196 1 3 . 1 1 55 55 THR C C 55 173.301 173.301 173.228 0.073 25139 1197 1 3 . 1 1 55 55 THR CA C 55 61.420 61.420 60.855 0.565 25139 1198 1 3 . 1 1 55 55 THR CB C 55 71.388 71.388 71.441 -0.053 25139 1199 1 3 . 1 1 55 55 THR H H 55 8.929 8.929 9.106 -0.177 25139 1200 1 3 . 1 1 56 56 ALA N N 56 129.359 129.359 129.088 0.271 25139 1201 1 3 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.087 0.228 25139 1202 1 3 . 1 1 56 56 ALA C C 56 178.305 178.305 177.158 1.147 25139 1203 1 3 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.973 0.898 25139 1204 1 3 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.390 -0.066 25139 1205 1 3 . 1 1 56 56 ALA H H 56 8.907 8.907 8.747 0.160 25139 1206 1 3 . 1 1 57 57 GLY N N 57 106.331 106.331 109.158 -2.827 25139 1207 1 3 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.782 0.829 25139 1208 1 3 . 1 1 57 57 GLY H H 57 7.978 7.978 8.061 -0.083 25139 1209 1 3 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.364 -0.040 25139 1210 1 3 . 1 1 59 59 PRO C C 59 177.466 177.466 177.482 -0.016 25139 1211 1 3 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.965 1.519 25139 1212 1 3 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.160 -0.425 25139 1213 1 3 . 1 1 60 60 GLY N N 60 109.688 109.688 107.814 1.874 25139 1214 1 3 . 1 1 60 60 GLY C C 60 173.555 173.555 173.086 0.469 25139 1215 1 3 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.920 0.621 25139 1216 1 3 . 1 1 60 60 GLY H H 60 8.402 8.402 8.805 -0.403 25139 1217 1 3 . 1 1 61 61 PHE N N 61 122.491 122.491 122.014 0.477 25139 1218 1 3 . 1 1 61 61 PHE C C 61 175.146 175.146 174.619 0.527 25139 1219 1 3 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.715 1.567 25139 1220 1 3 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.766 -2.067 25139 1221 1 3 . 1 1 61 61 PHE H H 61 7.957 7.957 7.187 0.770 25139 1222 1 3 . 1 1 62 62 VAL N N 62 121.128 121.128 117.804 3.324 25139 1223 1 3 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.403 -0.318 25139 1224 1 3 . 1 1 62 62 VAL C C 62 174.937 174.937 174.914 0.023 25139 1225 1 3 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.990 0.717 25139 1226 1 3 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.456 0.976 25139 1227 1 3 . 1 1 62 62 VAL H H 62 7.994 7.994 8.976 -0.982 25139 1228 1 3 . 1 1 63 63 LEU N N 63 124.386 124.386 123.529 0.857 25139 1229 1 3 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.606 -1.290 25139 1230 1 3 . 1 1 63 63 LEU C C 63 175.278 175.278 177.094 -1.816 25139 1231 1 3 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.462 0.826 25139 1232 1 3 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.800 1.318 25139 1233 1 3 . 1 1 63 63 LEU H H 63 7.572 7.572 8.443 -0.871 25139 1234 1 3 . 1 1 64 64 ASP N N 64 126.746 126.746 123.899 2.847 25139 1235 1 3 . 1 1 64 64 ASP C C 64 177.801 177.801 177.049 0.752 25139 1236 1 3 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.522 -2.801 25139 1237 1 3 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.868 -0.470 25139 1238 1 3 . 1 1 64 64 ASP H H 64 8.552 8.552 8.413 0.139 25139 1239 1 3 . 1 1 65 65 THR C C 65 175.002 175.002 175.215 -0.213 25139 1240 1 3 . 1 1 65 65 THR CB C 65 67.919 67.919 66.783 1.136 25139 1241 1 3 . 1 1 66 66 GLN N N 66 120.804 120.804 120.390 0.414 25139 1242 1 3 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.932 -0.055 25139 1243 1 3 . 1 1 66 66 GLN C C 66 178.901 178.901 177.536 1.365 25139 1244 1 3 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.457 0.959 25139 1245 1 3 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.259 -0.334 25139 1246 1 3 . 1 1 66 66 GLN H H 66 8.447 8.447 8.211 0.236 25139 1247 1 3 . 1 1 67 67 ALA N N 67 121.267 121.267 122.152 -0.885 25139 1248 1 3 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.098 -0.141 25139 1249 1 3 . 1 1 67 67 ALA C C 67 176.777 176.777 179.133 -2.356 25139 1250 1 3 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.197 0.127 25139 1251 1 3 . 1 1 67 67 ALA CB C 67 18.620 18.620 17.994 0.626 25139 1252 1 3 . 1 1 67 67 ALA H H 67 7.791 7.791 7.692 0.099 25139 1253 1 3 . 1 1 68 68 SER N N 68 113.339 113.339 113.530 -0.191 25139 1254 1 3 . 1 1 68 68 SER HA H 68 4.061 4.061 4.163 -0.102 25139 1255 1 3 . 1 1 68 68 SER C C 68 175.875 175.875 176.602 -0.727 25139 1256 1 3 . 1 1 68 68 SER CA C 68 62.970 62.970 60.691 2.279 25139 1257 1 3 . 1 1 68 68 SER CB C 68 61.330 61.330 63.306 -1.976 25139 1258 1 3 . 1 1 68 68 SER H H 68 7.785 7.785 7.563 0.222 25139 1259 1 3 . 1 1 69 69 VAL N N 69 125.140 125.140 116.789 8.351 25139 1260 1 3 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.117 -0.041 25139 1261 1 3 . 1 1 69 69 VAL C C 69 176.384 176.384 177.045 -0.661 25139 1262 1 3 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.722 1.009 25139 1263 1 3 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.377 0.112 25139 1264 1 3 . 1 1 69 69 VAL H H 69 8.572 8.572 7.946 0.626 25139 1265 1 3 . 1 1 70 70 SER N N 70 116.704 116.704 114.262 2.442 25139 1266 1 3 . 1 1 70 70 SER HA H 70 4.229 4.229 4.223 0.006 25139 1267 1 3 . 1 1 70 70 SER C C 70 174.101 174.101 175.527 -1.426 25139 1268 1 3 . 1 1 70 70 SER CA C 70 61.627 61.627 59.300 2.327 25139 1269 1 3 . 1 1 70 70 SER H H 70 7.951 7.951 7.760 0.191 25139 1270 1 3 . 1 1 71 71 ASN N N 71 117.576 117.576 116.994 0.582 25139 1271 1 3 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.677 0.125 25139 1272 1 3 . 1 1 71 71 ASN C C 71 174.332 174.332 174.839 -0.507 25139 1273 1 3 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.903 -0.464 25139 1274 1 3 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.794 0.673 25139 1275 1 3 . 1 1 71 71 ASN H H 71 7.131 7.131 7.504 -0.373 25139 1276 1 3 . 1 1 72 72 GLY N N 72 103.925 103.925 105.443 -1.518 25139 1277 1 3 . 1 1 72 72 GLY C C 72 174.710 174.710 173.463 1.247 25139 1278 1 3 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.413 0.136 25139 1279 1 3 . 1 1 72 72 GLY H H 72 7.338 7.338 7.380 -0.042 25139 1280 1 3 . 1 1 73 73 ALA N N 73 124.942 124.942 122.993 1.949 25139 1281 1 3 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.510 -0.338 25139 1282 1 3 . 1 1 73 73 ALA C C 73 175.896 175.896 176.217 -0.321 25139 1283 1 3 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.879 0.794 25139 1284 1 3 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.070 -0.014 25139 1285 1 3 . 1 1 73 73 ALA H H 73 8.032 8.032 7.820 0.212 25139 1286 1 3 . 1 1 74 74 THR N N 74 113.423 113.423 116.058 -2.635 25139 1287 1 3 . 1 1 74 74 THR HA H 74 4.678 4.678 4.532 0.146 25139 1288 1 3 . 1 1 74 74 THR C C 74 173.339 173.339 173.197 0.142 25139 1289 1 3 . 1 1 74 74 THR CA C 74 61.545 61.545 61.575 -0.030 25139 1290 1 3 . 1 1 74 74 THR CB C 74 71.319 71.319 71.398 -0.079 25139 1291 1 3 . 1 1 74 74 THR H H 74 8.530 8.530 8.243 0.287 25139 1292 1 3 . 1 1 75 75 PHE N N 75 128.180 128.180 130.583 -2.403 25139 1293 1 3 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.907 -0.303 25139 1294 1 3 . 1 1 75 75 PHE C C 75 174.623 174.623 175.337 -0.714 25139 1295 1 3 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.419 2.197 25139 1296 1 3 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.724 0.951 25139 1297 1 3 . 1 1 75 75 PHE H H 75 9.146 9.146 9.102 0.044 25139 1298 1 3 . 1 1 76 76 LEU N N 76 127.849 127.849 124.125 3.724 25139 1299 1 3 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.375 -0.024 25139 1300 1 3 . 1 1 76 76 LEU C C 76 176.339 176.339 176.772 -0.433 25139 1301 1 3 . 1 1 76 76 LEU CA C 76 55.983 55.983 56.041 -0.058 25139 1302 1 3 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.123 0.207 25139 1303 1 3 . 1 1 76 76 LEU H H 76 8.635 8.635 7.939 0.696 25139 1304 1 3 . 1 1 77 77 GLU N N 77 115.131 115.131 119.407 -4.276 25139 1305 1 3 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.492 -0.084 25139 1306 1 3 . 1 1 77 77 GLU C C 77 174.734 174.734 174.397 0.337 25139 1307 1 3 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.377 0.976 25139 1308 1 3 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.089 0.118 25139 1309 1 3 . 1 1 77 77 GLU H H 77 7.252 7.252 7.598 -0.346 25139 1310 1 3 . 1 1 78 78 SER N N 78 118.016 118.016 119.662 -1.646 25139 1311 1 3 . 1 1 78 78 SER HA H 78 5.561 5.561 5.182 0.379 25139 1312 1 3 . 1 1 78 78 SER C C 78 171.968 171.968 173.319 -1.351 25139 1313 1 3 . 1 1 78 78 SER CA C 78 54.061 54.061 55.225 -1.164 25139 1314 1 3 . 1 1 78 78 SER CB C 78 64.074 64.074 63.053 1.021 25139 1315 1 3 . 1 1 78 78 SER H H 78 9.033 9.033 8.719 0.314 25139 1316 1 3 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.543 -0.943 25139 1317 1 3 . 1 1 79 79 PRO CB C 79 32.410 32.410 31.677 0.734 25139 1318 1 3 . 1 1 80 80 THR N N 80 118.079 118.079 114.318 3.761 25139 1319 1 3 . 1 1 80 80 THR HA H 80 4.342 4.342 3.795 0.547 25139 1320 1 3 . 1 1 80 80 THR C C 80 174.494 174.494 174.022 0.472 25139 1321 1 3 . 1 1 80 80 THR CA C 80 61.453 61.453 63.203 -1.750 25139 1322 1 3 . 1 1 80 80 THR CB C 80 67.797 67.797 68.228 -0.431 25139 1323 1 3 . 1 1 80 80 THR H H 80 8.670 8.670 7.665 1.005 25139 1324 1 3 . 1 1 81 81 VAL N N 81 117.395 117.395 112.728 4.667 25139 1325 1 3 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.952 0.655 25139 1326 1 3 . 1 1 81 81 VAL C C 81 175.518 175.518 176.549 -1.031 25139 1327 1 3 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.213 -3.099 25139 1328 1 3 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.439 2.156 25139 1329 1 3 . 1 1 81 81 VAL H H 81 7.448 7.448 7.511 -0.063 25139 1330 1 3 . 1 1 82 82 ARG N N 82 117.852 117.852 118.778 -0.926 25139 1331 1 3 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.573 -0.052 25139 1332 1 3 . 1 1 82 82 ARG C C 82 176.992 176.992 175.679 1.313 25139 1333 1 3 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.713 0.672 25139 1334 1 3 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.495 1.107 25139 1335 1 3 . 1 1 82 82 ARG H H 82 8.710 8.710 8.676 0.034 25139 1336 1 3 . 1 1 83 83 ARG N N 83 117.035 117.035 118.297 -1.262 25139 1337 1 3 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.805 0.517 25139 1338 1 3 . 1 1 83 83 ARG C C 83 177.379 177.379 176.460 0.919 25139 1339 1 3 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.755 -1.071 25139 1340 1 3 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.077 -1.036 25139 1341 1 3 . 1 1 83 83 ARG H H 83 7.292 7.292 7.692 -0.400 25139 1342 1 3 . 1 1 84 84 GLY N N 84 114.911 114.911 110.350 4.561 25139 1343 1 3 . 1 1 84 84 GLY C C 84 176.940 176.940 175.058 1.882 25139 1344 1 3 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.708 1.964 25139 1345 1 3 . 1 1 84 84 GLY H H 84 9.255 9.255 8.412 0.843 25139 1346 1 3 . 1 1 85 85 TRP N N 85 121.810 121.810 119.770 2.040 25139 1347 1 3 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.304 -0.137 25139 1348 1 3 . 1 1 85 85 TRP C C 85 178.272 178.272 177.853 0.419 25139 1349 1 3 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.530 1.515 25139 1350 1 3 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.246 -0.029 25139 1351 1 3 . 1 1 85 85 TRP H H 85 9.963 9.963 8.076 1.887 25139 1352 1 3 . 1 1 86 86 ASP N N 86 116.400 116.400 120.786 -4.386 25139 1353 1 3 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.518 -0.125 25139 1354 1 3 . 1 1 86 86 ASP C C 86 178.803 178.803 177.748 1.055 25139 1355 1 3 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.802 0.252 25139 1356 1 3 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.275 0.458 25139 1357 1 3 . 1 1 86 86 ASP H H 86 6.934 6.934 7.653 -0.719 25139 1358 1 3 . 1 1 87 87 CYS N N 87 122.454 122.454 119.557 2.897 25139 1359 1 3 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.260 -0.010 25139 1360 1 3 . 1 1 87 87 CYS C C 87 174.956 174.956 176.503 -1.547 25139 1361 1 3 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.820 -3.673 25139 1362 1 3 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.229 11.256 25139 1363 1 3 . 1 1 87 87 CYS H H 87 7.603 7.603 7.464 0.139 25139 1364 1 3 . 1 1 88 88 VAL N N 88 119.192 119.192 120.157 -0.965 25139 1365 1 3 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.149 -0.691 25139 1366 1 3 . 1 1 88 88 VAL C C 88 177.413 177.413 177.961 -0.548 25139 1367 1 3 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.868 1.108 25139 1368 1 3 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.589 -0.347 25139 1369 1 3 . 1 1 88 88 VAL H H 88 7.192 7.192 7.540 -0.348 25139 1370 1 3 . 1 1 89 89 ARG N N 89 118.185 118.185 118.512 -0.327 25139 1371 1 3 . 1 1 89 89 ARG HA H 89 3.680 3.680 4.026 -0.346 25139 1372 1 3 . 1 1 89 89 ARG C C 89 178.677 178.677 178.027 0.650 25139 1373 1 3 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.105 0.850 25139 1374 1 3 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.349 0.442 25139 1375 1 3 . 1 1 89 89 ARG H H 89 7.971 7.971 7.705 0.266 25139 1376 1 3 . 1 1 90 90 ALA N N 90 120.815 120.815 123.111 -2.296 25139 1377 1 3 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.177 -0.102 25139 1378 1 3 . 1 1 90 90 ALA C C 90 177.416 177.416 178.854 -1.438 25139 1379 1 3 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.705 -0.451 25139 1380 1 3 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.210 -0.774 25139 1381 1 3 . 1 1 90 90 ALA H H 90 7.453 7.453 7.457 -0.004 25139 1382 1 3 . 1 1 91 91 CYS N N 91 120.380 120.380 115.887 4.493 25139 1383 1 3 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.309 0.062 25139 1384 1 3 . 1 1 91 91 CYS C C 91 176.654 176.654 175.959 0.695 25139 1385 1 3 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.818 -4.123 25139 1386 1 3 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.256 12.447 25139 1387 1 3 . 1 1 91 91 CYS H H 91 7.944 7.944 7.536 0.408 25139 1388 1 3 . 1 1 92 92 CYS N N 92 116.270 116.270 118.774 -2.504 25139 1389 1 3 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.507 -0.103 25139 1390 1 3 . 1 1 92 92 CYS C C 92 175.628 175.628 176.665 -1.037 25139 1391 1 3 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.387 -2.681 25139 1392 1 3 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.279 14.870 25139 1393 1 3 . 1 1 92 92 CYS H H 92 8.315 8.315 7.660 0.655 25139 1394 1 3 . 1 1 93 93 THR N N 93 107.283 107.283 112.236 -4.953 25139 1395 1 3 . 1 1 93 93 THR HA H 93 4.481 4.481 4.244 0.237 25139 1396 1 3 . 1 1 93 93 THR C C 93 173.606 173.606 175.490 -1.884 25139 1397 1 3 . 1 1 93 93 THR CA C 93 61.402 61.402 64.148 -2.746 25139 1398 1 3 . 1 1 93 93 THR CB C 93 69.046 69.046 68.923 0.123 25139 1399 1 3 . 1 1 93 93 THR H H 93 7.445 7.445 7.711 -0.266 25139 1400 1 3 . 1 1 94 94 THR N N 94 121.432 121.432 120.979 0.453 25139 1401 1 3 . 1 1 94 94 THR HA H 94 4.398 4.398 4.408 -0.010 25139 1402 1 3 . 1 1 94 94 THR C C 94 173.493 173.493 174.831 -1.338 25139 1403 1 3 . 1 1 94 94 THR CA C 94 62.726 62.726 63.170 -0.444 25139 1404 1 3 . 1 1 94 94 THR CB C 94 69.704 69.704 68.496 1.208 25139 1405 1 3 . 1 1 94 94 THR H H 94 7.553 7.553 8.009 -0.456 25139 1406 1 3 . 1 1 95 95 GLN N N 95 129.410 129.410 127.877 1.533 25139 1407 1 3 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.969 -0.025 25139 1408 1 3 . 1 1 95 95 GLN C C 95 176.293 176.293 176.099 0.194 25139 1409 1 3 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.846 -0.806 25139 1410 1 3 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.719 -0.463 25139 1411 1 3 . 1 1 95 95 GLN H H 95 8.812 8.812 8.550 0.262 25139 1412 1 3 . 1 1 96 96 ASN N N 96 115.015 115.015 114.385 0.630 25139 1413 1 3 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.794 -0.595 25139 1414 1 3 . 1 1 96 96 ASN C C 96 172.260 172.260 173.941 -1.681 25139 1415 1 3 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.992 2.575 25139 1416 1 3 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.616 -1.779 25139 1417 1 3 . 1 1 96 96 ASN H H 96 8.791 8.791 8.126 0.665 25139 1418 1 3 . 1 1 97 97 CYS N N 97 115.830 115.830 120.722 -4.892 25139 1419 1 3 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.452 -0.351 25139 1420 1 3 . 1 1 97 97 CYS C C 97 175.025 175.025 173.587 1.438 25139 1421 1 3 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.739 -1.591 25139 1422 1 3 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.182 16.052 25139 1423 1 3 . 1 1 97 97 CYS H H 97 7.651 7.651 7.911 -0.260 25139 1424 1 3 . 1 1 98 98 ASN N N 98 125.148 125.148 125.027 0.121 25139 1425 1 3 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.897 0.236 25139 1426 1 3 . 1 1 98 98 ASN C C 98 171.892 171.892 174.332 -2.440 25139 1427 1 3 . 1 1 98 98 ASN CA C 98 53.194 53.194 52.962 0.233 25139 1428 1 3 . 1 1 98 98 ASN CB C 98 39.948 39.948 40.410 -0.462 25139 1429 1 3 . 1 1 98 98 ASN H H 98 8.736 8.736 8.313 0.423 25139 1430 1 3 . 1 1 99 99 LEU N N 99 120.898 120.898 121.768 -0.870 25139 1431 1 3 . 1 1 99 99 LEU C C 99 173.084 173.084 174.000 -0.916 25139 1432 1 3 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.519 2.601 25139 1433 1 3 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.584 -1.256 25139 1434 1 3 . 1 1 99 99 LEU H H 99 8.200 8.200 7.815 0.385 25139 1435 1 3 . 1 1 100 100 ALA N N 100 128.085 128.085 129.348 -1.263 25139 1436 1 3 . 1 1 100 100 ALA C C 100 174.938 174.938 175.300 -0.362 25139 1437 1 3 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.333 -0.586 25139 1438 1 3 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.642 0.073 25139 1439 1 3 . 1 1 100 100 ALA H H 100 9.156 9.156 9.351 -0.195 25139 1440 1 3 . 1 1 101 101 LEU N N 101 128.723 128.723 128.493 0.230 25139 1441 1 3 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.338 -0.196 25139 1442 1 3 . 1 1 101 101 LEU C C 101 174.379 174.379 175.361 -0.982 25139 1443 1 3 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.389 -0.536 25139 1444 1 3 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.860 0.447 25139 1445 1 3 . 1 1 101 101 LEU H H 101 9.578 9.578 9.010 0.568 25139 1446 1 3 . 1 1 102 102 VAL N N 102 119.417 119.417 119.812 -0.395 25139 1447 1 3 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.385 0.143 25139 1448 1 3 . 1 1 102 102 VAL C C 102 173.660 173.660 174.373 -0.713 25139 1449 1 3 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.859 -0.239 25139 1450 1 3 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.015 -1.742 25139 1451 1 3 . 1 1 102 102 VAL H H 102 9.297 9.297 9.478 -0.181 25139 1452 1 3 . 1 1 103 103 GLU N N 103 124.427 124.427 123.288 1.139 25139 1453 1 3 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.186 -0.321 25139 1454 1 3 . 1 1 103 103 GLU C C 103 176.319 176.319 174.687 1.632 25139 1455 1 3 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.041 0.060 25139 1456 1 3 . 1 1 103 103 GLU CB C 103 32.201 32.201 30.942 1.259 25139 1457 1 3 . 1 1 103 103 GLU H H 103 7.749 7.749 8.349 -0.600 25139 1458 1 3 . 1 1 104 104 LEU N N 104 127.294 127.294 125.340 1.954 25139 1459 1 3 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.513 -0.193 25139 1460 1 3 . 1 1 104 104 LEU C C 104 176.593 176.593 176.968 -0.375 25139 1461 1 3 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.630 2.454 25139 1462 1 3 . 1 1 104 104 LEU CB C 104 42.391 42.391 43.785 -1.394 25139 1463 1 3 . 1 1 104 104 LEU H H 104 8.323 8.323 8.283 0.040 25139 1464 1 3 . 1 1 105 105 GLN N N 105 121.361 121.361 118.453 2.908 25139 1465 1 3 . 1 1 105 105 GLN C C 105 172.868 172.868 174.621 -1.753 25139 1466 1 3 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.129 -2.723 25139 1467 1 3 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.917 1.812 25139 1468 1 3 . 1 1 105 105 GLN H H 105 8.095 8.095 8.354 -0.259 25139 1469 1 3 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.460 -0.051 25139 1470 1 3 . 1 1 106 106 PRO C C 106 177.770 177.770 176.597 1.173 25139 1471 1 3 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.486 -0.001 25139 1472 1 3 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.122 -0.354 25139 1473 1 3 . 1 1 107 107 ASP N N 107 116.484 116.484 115.292 1.192 25139 1474 1 3 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.649 -0.209 25139 1475 1 3 . 1 1 107 107 ASP C C 107 176.749 176.749 176.626 0.123 25139 1476 1 3 . 1 1 107 107 ASP CA C 107 55.455 55.455 54.564 0.891 25139 1477 1 3 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.530 -1.642 25139 1478 1 3 . 1 1 107 107 ASP H H 107 8.638 8.638 8.336 0.302 25139 1479 1 3 . 1 1 108 108 ARG N N 108 117.895 117.895 119.420 -1.525 25139 1480 1 3 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.583 -0.093 25139 1481 1 3 . 1 1 108 108 ARG C C 108 176.111 176.111 176.895 -0.784 25139 1482 1 3 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.726 -0.461 25139 1483 1 3 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.457 -0.381 25139 1484 1 3 . 1 1 108 108 ARG H H 108 7.905 7.905 8.305 -0.400 25139 1485 1 3 . 1 1 109 109 GLY N N 109 108.307 108.307 107.388 0.919 25139 1486 1 3 . 1 1 109 109 GLY C C 109 173.949 173.949 173.824 0.125 25139 1487 1 3 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.151 -0.600 25139 1488 1 3 . 1 1 109 109 GLY H H 109 7.753 7.753 8.317 -0.564 25139 1489 1 3 . 1 1 110 110 GLU N N 110 120.035 120.035 122.063 -2.028 25139 1490 1 3 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.491 -0.400 25139 1491 1 3 . 1 1 110 110 GLU C C 110 177.045 177.045 177.140 -0.095 25139 1492 1 3 . 1 1 110 110 GLU CA C 110 58.282 58.282 57.136 1.146 25139 1493 1 3 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.638 -0.965 25139 1494 1 3 . 1 1 110 110 GLU H H 110 8.509 8.509 8.648 -0.139 25139 1495 1 3 . 1 1 111 111 ASP N N 111 121.160 121.160 120.393 0.767 25139 1496 1 3 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.488 0.082 25139 1497 1 3 . 1 1 111 111 ASP C C 111 175.089 175.089 175.915 -0.826 25139 1498 1 3 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.535 -1.944 25139 1499 1 3 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.930 1.502 25139 1500 1 3 . 1 1 111 111 ASP H H 111 8.916 8.916 8.707 0.209 25139 1501 1 3 . 1 1 112 112 ALA N N 112 122.130 122.130 119.706 2.424 25139 1502 1 3 . 1 1 112 112 ALA C C 112 178.120 178.120 175.804 2.316 25139 1503 1 3 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.465 2.794 25139 1504 1 3 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.347 -1.577 25139 1505 1 3 . 1 1 112 112 ALA H H 112 7.361 7.361 7.457 -0.096 25139 1506 1 3 . 1 1 113 113 ILE N N 113 113.780 113.780 115.080 -1.300 25139 1507 1 3 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.867 0.019 25139 1508 1 3 . 1 1 113 113 ILE C C 113 174.258 174.258 174.825 -0.567 25139 1509 1 3 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.235 0.277 25139 1510 1 3 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.894 -0.046 25139 1511 1 3 . 1 1 113 113 ILE H H 113 7.667 7.667 8.308 -0.641 25139 1512 1 3 . 1 1 114 114 ALA N N 114 122.673 122.673 124.774 -2.101 25139 1513 1 3 . 1 1 114 114 ALA C C 114 176.984 176.984 176.527 0.457 25139 1514 1 3 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.064 -1.500 25139 1515 1 3 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.619 0.963 25139 1516 1 3 . 1 1 114 114 ALA H H 114 8.904 8.904 8.714 0.190 25139 1517 1 3 . 1 1 115 115 ALA N N 115 116.486 116.486 116.110 0.376 25139 1518 1 3 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.432 -0.077 25139 1519 1 3 . 1 1 115 115 ALA C C 115 174.138 174.138 173.968 0.170 25139 1520 1 3 . 1 1 115 115 ALA CA C 115 52.320 52.320 51.031 1.289 25139 1521 1 3 . 1 1 115 115 ALA CB C 115 22.983 22.983 20.792 2.191 25139 1522 1 3 . 1 1 115 115 ALA H H 115 7.182 7.182 7.264 -0.082 25139 1523 1 3 . 1 1 116 116 CYS N N 116 120.099 120.099 120.384 -0.285 25139 1524 1 3 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.372 -0.041 25139 1525 1 3 . 1 1 116 116 CYS C C 116 176.609 176.609 172.515 4.094 25139 1526 1 3 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.736 -2.787 25139 1527 1 3 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.133 12.251 25139 1528 1 3 . 1 1 116 116 CYS H H 116 8.298 8.298 7.921 0.377 25139 1529 1 3 . 1 1 117 117 PHE N N 117 126.406 126.406 126.324 0.082 25139 1530 1 3 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.254 -0.055 25139 1531 1 3 . 1 1 117 117 PHE C C 117 173.385 173.385 174.431 -1.046 25139 1532 1 3 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.031 0.223 25139 1533 1 3 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.761 -0.080 25139 1534 1 3 . 1 1 117 117 PHE H H 117 9.712 9.712 9.134 0.578 25139 1535 1 3 . 1 1 118 118 LEU N N 118 122.119 122.119 123.455 -1.336 25139 1536 1 3 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.425 -0.259 25139 1537 1 3 . 1 1 118 118 LEU C C 118 175.097 175.097 176.401 -1.304 25139 1538 1 3 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.177 -0.273 25139 1539 1 3 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.561 -1.263 25139 1540 1 3 . 1 1 118 118 LEU H H 118 8.719 8.719 9.248 -0.529 25139 1541 1 3 . 1 1 119 119 ILE N N 119 125.324 125.324 122.816 2.508 25139 1542 1 3 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.951 -0.074 25139 1543 1 3 . 1 1 119 119 ILE C C 119 173.825 173.825 175.207 -1.382 25139 1544 1 3 . 1 1 119 119 ILE CA C 119 59.107 59.107 60.020 -0.913 25139 1545 1 3 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.327 -0.817 25139 1546 1 3 . 1 1 119 119 ILE H H 119 8.986 8.986 9.077 -0.091 25139 1547 1 3 . 1 1 120 120 ASN N N 120 121.534 121.534 124.578 -3.044 25139 1548 1 3 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.772 0.618 25139 1549 1 3 . 1 1 120 120 ASN C C 120 176.098 176.098 176.087 0.011 25139 1550 1 3 . 1 1 120 120 ASN CA C 120 51.457 51.457 54.363 -2.906 25139 1551 1 3 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.874 1.044 25139 1552 1 3 . 1 1 120 120 ASN H H 120 8.694 8.694 8.945 -0.251 25139 1553 1 3 . 1 1 121 121 CYS N N 121 122.779 122.779 114.659 8.120 25139 1554 1 3 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.075 0.408 25139 1555 1 3 . 1 1 121 121 CYS C C 121 173.195 173.195 173.339 -0.144 25139 1556 1 3 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.662 -3.898 25139 1557 1 3 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.502 16.205 25139 1558 1 3 . 1 1 121 121 CYS H H 121 10.668 10.668 8.474 2.194 25139 1559 1 3 . 1 1 122 122 LEU N N 122 121.063 121.063 115.644 5.419 25139 1560 1 3 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.606 -0.241 25139 1561 1 3 . 1 1 122 122 LEU C C 122 176.743 176.743 175.674 1.069 25139 1562 1 3 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.961 0.703 25139 1563 1 3 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.680 -1.446 25139 1564 1 3 . 1 1 122 122 LEU H H 122 8.256 8.256 7.539 0.717 25139 1565 1 3 . 1 1 123 123 TYR N N 123 123.081 123.081 122.957 0.124 25139 1566 1 3 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.746 -0.703 25139 1567 1 3 . 1 1 123 123 TYR C C 123 173.633 173.633 174.675 -1.042 25139 1568 1 3 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.046 -0.158 25139 1569 1 3 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.649 -0.568 25139 1570 1 3 . 1 1 123 123 TYR H H 123 8.990 8.990 9.015 -0.025 25139 1571 1 3 . 1 1 124 124 GLU N N 124 128.742 128.742 126.400 2.342 25139 1572 1 3 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.703 -0.153 25139 1573 1 3 . 1 1 124 124 GLU C C 124 174.835 174.835 175.489 -0.654 25139 1574 1 3 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.407 0.225 25139 1575 1 3 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.143 -0.248 25139 1576 1 3 . 1 1 124 124 GLU H H 124 9.135 9.135 8.853 0.282 25139 1577 1 3 . 1 1 125 125 GLN N N 125 108.066 108.066 109.939 -1.873 25139 1578 1 3 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.921 -0.200 25139 1579 1 3 . 1 1 125 125 GLN C C 125 174.627 174.627 174.846 -0.219 25139 1580 1 3 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.271 0.768 25139 1581 1 3 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.680 -0.352 25139 1582 1 3 . 1 1 125 125 GLN H H 125 8.390 8.390 8.559 -0.169 25139 1583 1 3 . 1 1 126 126 ASN N N 126 118.528 118.528 117.628 0.900 25139 1584 1 3 . 1 1 126 126 ASN C C 126 173.713 173.713 174.552 -0.839 25139 1585 1 3 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.211 -0.022 25139 1586 1 3 . 1 1 126 126 ASN CB C 126 40.801 40.801 40.342 0.459 25139 1587 1 3 . 1 1 126 126 ASN H H 126 8.092 8.092 7.987 0.105 25139 1588 1 3 . 1 1 127 127 PHE N N 127 124.680 124.680 122.575 2.105 25139 1589 1 3 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.717 0.320 25139 1590 1 3 . 1 1 127 127 PHE C C 127 177.125 177.125 176.203 0.922 25139 1591 1 3 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.961 0.452 25139 1592 1 3 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.479 0.765 25139 1593 1 3 . 1 1 127 127 PHE H H 127 9.026 9.026 8.895 0.131 25139 1594 1 3 . 1 1 128 128 VAL N N 128 119.455 119.455 120.314 -0.859 25139 1595 1 3 . 1 1 128 128 VAL C C 128 175.886 175.886 175.653 0.233 25139 1596 1 3 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.250 -0.331 25139 1597 1 3 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.319 1.875 25139 1598 1 3 . 1 1 128 128 VAL H H 128 8.364 8.364 7.608 0.756 25139 1599 1 3 . 1 1 129 129 CYS N N 129 116.130 116.130 121.262 -5.132 25139 1600 1 3 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.958 -0.481 25139 1601 1 3 . 1 1 129 129 CYS C C 129 170.569 170.569 173.823 -3.254 25139 1602 1 3 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.920 -3.771 25139 1603 1 3 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.002 18.615 25139 1604 1 3 . 1 1 129 129 CYS H H 129 5.390 5.390 7.108 -1.718 25139 1605 1 3 . 1 1 130 130 LYS N N 130 120.071 120.071 125.148 -5.077 25139 1606 1 3 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.222 0.339 25139 1607 1 3 . 1 1 130 130 LYS C C 130 176.853 176.853 174.472 2.381 25139 1608 1 3 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.712 -0.825 25139 1609 1 3 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.303 1.339 25139 1610 1 3 . 1 1 130 130 LYS H H 130 8.066 8.066 7.734 0.332 25139 1611 1 3 . 1 1 131 131 PHE N N 131 118.415 118.415 119.934 -1.519 25139 1612 1 3 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.349 -0.742 25139 1613 1 3 . 1 1 131 131 PHE C C 131 174.013 174.013 175.151 -1.138 25139 1614 1 3 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.313 1.398 25139 1615 1 3 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.465 0.616 25139 1616 1 3 . 1 1 131 131 PHE H H 131 8.714 8.714 8.261 0.453 25139 1617 1 3 . 1 1 132 132 ALA N N 132 124.209 124.209 122.711 1.498 25139 1618 1 3 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.046 -0.429 25139 1619 1 3 . 1 1 132 132 ALA C C 132 174.352 174.352 174.352 0.000 25139 1620 1 3 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.504 1.937 25139 1621 1 3 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.848 -0.384 25139 1622 1 3 . 1 1 132 132 ALA H H 132 9.295 9.295 9.066 0.229 25139 1623 1 3 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.456 -0.573 25139 1624 1 3 . 1 1 133 133 PRO C C 133 173.923 173.923 176.469 -2.546 25139 1625 1 3 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.643 0.428 25139 1626 1 3 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.607 -1.004 25139 1627 1 3 . 1 1 134 134 ARG N N 134 126.071 126.071 124.694 1.377 25139 1628 1 3 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.768 -0.513 25139 1629 1 3 . 1 1 134 134 ARG C C 134 177.065 177.065 176.420 0.645 25139 1630 1 3 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.449 2.715 25139 1631 1 3 . 1 1 134 134 ARG CB C 134 32.183 32.183 31.952 0.231 25139 1632 1 3 . 1 1 134 134 ARG H H 134 8.672 8.672 8.571 0.101 25139 1633 1 3 . 1 1 135 135 GLU N N 135 125.683 125.683 120.332 5.351 25139 1634 1 3 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.388 -0.035 25139 1635 1 3 . 1 1 135 135 GLU C C 135 178.081 178.081 176.653 1.428 25139 1636 1 3 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.542 0.109 25139 1637 1 3 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.876 0.120 25139 1638 1 3 . 1 1 135 135 GLU H H 135 8.603 8.603 8.987 -0.384 25139 1639 1 3 . 1 1 136 136 GLY N N 136 110.031 110.031 106.967 3.064 25139 1640 1 3 . 1 1 136 136 GLY C C 136 173.079 173.079 174.032 -0.953 25139 1641 1 3 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.727 1.051 25139 1642 1 3 . 1 1 136 136 GLY H H 136 9.036 9.036 8.201 0.835 25139 1643 1 3 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.573 1.102 25139 1644 1 3 . 1 1 137 137 PHE C C 137 174.936 174.936 175.448 -0.512 25139 1645 1 3 . 1 1 137 137 PHE CA C 137 56.084 56.084 59.788 -3.704 25139 1646 1 3 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.672 5.024 25139 1647 1 3 . 1 1 138 138 ILE N N 138 117.417 117.417 113.651 3.766 25139 1648 1 3 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.697 -0.190 25139 1649 1 3 . 1 1 138 138 ILE C C 138 173.858 173.858 173.524 0.334 25139 1650 1 3 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.508 1.112 25139 1651 1 3 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.249 1.348 25139 1652 1 3 . 1 1 138 138 ILE H H 138 8.777 8.777 8.546 0.231 25139 1653 1 3 . 1 1 139 139 ASN N N 139 117.201 117.201 117.237 -0.036 25139 1654 1 3 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.575 0.484 25139 1655 1 3 . 1 1 139 139 ASN C C 139 173.721 173.721 174.202 -0.481 25139 1656 1 3 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.666 -1.436 25139 1657 1 3 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.359 1.502 25139 1658 1 3 . 1 1 139 139 ASN H H 139 8.872 8.872 8.313 0.559 25139 1659 1 3 . 1 1 140 140 TYR N N 140 123.991 123.991 120.108 3.883 25139 1660 1 3 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.800 0.378 25139 1661 1 3 . 1 1 140 140 TYR C C 140 174.791 174.791 175.065 -0.274 25139 1662 1 3 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.282 -1.210 25139 1663 1 3 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.920 1.750 25139 1664 1 3 . 1 1 140 140 TYR H H 140 9.526 9.526 9.028 0.498 25139 1665 1 3 . 1 1 141 141 LEU N N 141 122.779 122.779 120.596 2.183 25139 1666 1 3 . 1 1 141 141 LEU C C 141 175.404 175.404 177.472 -2.068 25139 1667 1 3 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.792 2.311 25139 1668 1 3 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.347 -1.186 25139 1669 1 3 . 1 1 141 141 LEU H H 141 9.010 9.010 9.019 -0.009 25139 1670 1 3 . 1 1 142 142 THR N N 142 113.189 113.189 111.628 1.561 25139 1671 1 3 . 1 1 142 142 THR HA H 142 4.061 4.061 4.389 -0.328 25139 1672 1 3 . 1 1 142 142 THR C C 142 175.940 175.940 176.501 -0.561 25139 1673 1 3 . 1 1 142 142 THR CA C 142 61.389 61.389 60.900 0.489 25139 1674 1 3 . 1 1 142 142 THR CB C 142 69.779 69.779 70.281 -0.502 25139 1675 1 3 . 1 1 142 142 THR H H 142 7.737 7.737 8.295 -0.558 25139 1676 1 3 . 1 1 143 143 ARG N N 143 120.975 120.975 120.234 0.741 25139 1677 1 3 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.977 -0.039 25139 1678 1 3 . 1 1 143 143 ARG C C 143 178.690 178.690 177.647 1.043 25139 1679 1 3 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.357 0.391 25139 1680 1 3 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.665 0.480 25139 1681 1 3 . 1 1 143 143 ARG H H 143 8.149 8.149 8.657 -0.508 25139 1682 1 3 . 1 1 144 144 GLU N N 144 116.997 116.997 119.070 -2.073 25139 1683 1 3 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.328 -0.219 25139 1684 1 3 . 1 1 144 144 GLU C C 144 178.442 178.442 177.459 0.983 25139 1685 1 3 . 1 1 144 144 GLU CA C 144 59.863 59.863 57.840 2.023 25139 1686 1 3 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.502 -0.920 25139 1687 1 3 . 1 1 144 144 GLU H H 144 8.622 8.622 7.529 1.093 25139 1688 1 3 . 1 1 145 145 VAL N N 145 111.213 111.213 119.020 -7.807 25139 1689 1 3 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.097 0.314 25139 1690 1 3 . 1 1 145 145 VAL C C 145 176.965 176.965 176.400 0.565 25139 1691 1 3 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.807 -0.213 25139 1692 1 3 . 1 1 145 145 VAL CB C 145 32.082 32.082 33.025 -0.943 25139 1693 1 3 . 1 1 145 145 VAL H H 145 7.227 7.227 7.708 -0.481 25139 1694 1 3 . 1 1 146 146 TYR N N 146 123.512 123.512 121.357 2.155 25139 1695 1 3 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.076 -0.196 25139 1696 1 3 . 1 1 146 146 TYR C C 146 176.377 176.377 176.729 -0.352 25139 1697 1 3 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.117 0.420 25139 1698 1 3 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.507 -0.168 25139 1699 1 3 . 1 1 146 146 TYR H H 146 8.492 8.492 8.812 -0.320 25139 1700 1 3 . 1 1 147 147 ARG N N 147 116.680 116.680 117.867 -1.187 25139 1701 1 3 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.871 -0.057 25139 1702 1 3 . 1 1 147 147 ARG C C 147 178.858 178.858 178.230 0.628 25139 1703 1 3 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.242 0.454 25139 1704 1 3 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.245 0.420 25139 1705 1 3 . 1 1 147 147 ARG H H 147 8.053 8.053 8.669 -0.616 25139 1706 1 3 . 1 1 148 148 SER N N 148 115.306 115.306 115.657 -0.351 25139 1707 1 3 . 1 1 148 148 SER HA H 148 3.998 3.998 4.415 -0.417 25139 1708 1 3 . 1 1 148 148 SER C C 148 175.786 175.786 175.569 0.217 25139 1709 1 3 . 1 1 148 148 SER CA C 148 62.006 62.006 60.716 1.290 25139 1710 1 3 . 1 1 148 148 SER H H 148 7.139 7.139 7.590 -0.451 25139 1711 1 3 . 1 1 149 149 TYR N N 149 123.207 123.207 122.971 0.236 25139 1712 1 3 . 1 1 149 149 TYR C C 149 175.831 175.831 177.011 -1.180 25139 1713 1 3 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.395 -0.795 25139 1714 1 3 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.509 0.272 25139 1715 1 3 . 1 1 149 149 TYR H H 149 7.253 7.253 7.277 -0.024 25139 1716 1 3 . 1 1 150 150 ARG N N 150 118.708 118.708 116.887 1.821 25139 1717 1 3 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.789 -0.443 25139 1718 1 3 . 1 1 150 150 ARG C C 150 177.644 177.644 178.059 -0.415 25139 1719 1 3 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.446 -0.123 25139 1720 1 3 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.582 -0.728 25139 1721 1 3 . 1 1 150 150 ARG H H 150 8.441 8.441 7.885 0.556 25139 1722 1 3 . 1 1 151 151 GLN N N 151 116.551 116.551 117.005 -0.454 25139 1723 1 3 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.249 -0.292 25139 1724 1 3 . 1 1 151 151 GLN C C 151 177.987 177.987 176.639 1.348 25139 1725 1 3 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.155 0.186 25139 1726 1 3 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.348 0.116 25139 1727 1 3 . 1 1 151 151 GLN H H 151 7.332 7.332 7.561 -0.229 25139 1728 1 3 . 1 1 152 152 LEU N N 152 118.877 118.877 112.848 6.029 25139 1729 1 3 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.423 -0.244 25139 1730 1 3 . 1 1 152 152 LEU C C 152 179.070 179.070 177.212 1.858 25139 1731 1 3 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.887 1.195 25139 1732 1 3 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.033 -0.345 25139 1733 1 3 . 1 1 152 152 LEU H H 152 7.106 7.106 7.189 -0.083 25139 1734 1 3 . 1 1 153 153 VAL N N 153 119.076 119.076 113.134 5.942 25139 1735 1 3 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.736 -0.876 25139 1736 1 3 . 1 1 153 153 VAL C C 153 177.421 177.421 176.469 0.952 25139 1737 1 3 . 1 1 153 153 VAL CA C 153 64.583 64.583 63.092 1.491 25139 1738 1 3 . 1 1 153 153 VAL CB C 153 31.518 31.518 32.401 -0.883 25139 1739 1 3 . 1 1 153 153 VAL H H 153 7.427 7.427 7.069 0.358 25139 1740 1 3 . 1 1 154 154 ASP N N 154 119.888 119.888 120.302 -0.414 25139 1741 1 3 . 1 1 154 154 ASP C C 154 177.422 177.422 175.813 1.609 25139 1742 1 3 . 1 1 154 154 ASP CA C 154 56.071 56.071 54.154 1.917 25139 1743 1 3 . 1 1 154 154 ASP CB C 154 40.349 40.349 39.872 0.477 25139 1744 1 3 . 1 1 154 154 ASP H H 154 7.930 7.930 7.532 0.398 25139 1745 1 3 . 1 1 155 155 HIS N N 155 117.821 117.821 112.555 5.266 25139 1746 1 3 . 1 1 155 155 HIS CA C 155 57.756 57.756 57.628 0.128 25139 1747 1 3 . 1 1 155 155 HIS CB C 155 30.180 30.180 27.031 3.149 25139 1748 1 3 . 1 1 155 155 HIS H H 155 7.680 7.680 7.901 -0.221 25139 1749 1 3 . 1 1 156 156 HIS N N 156 119.180 119.180 117.511 1.669 25139 1750 1 3 . 1 1 156 156 HIS CA C 156 57.931 57.931 56.770 1.161 25139 1751 1 3 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.676 -0.376 25139 1752 1 3 . 1 1 156 156 HIS H H 156 7.868 7.868 7.591 0.277 25139 1753 1 4 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.904 1.000 25139 1754 1 4 . 1 1 48 48 ALA CB C 48 19.222 19.222 17.746 1.476 25139 1755 1 4 . 1 1 49 49 ASP N N 49 119.661 119.661 120.309 -0.648 25139 1756 1 4 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.225 0.052 25139 1757 1 4 . 1 1 49 49 ASP CB C 49 41.062 41.062 42.532 -1.470 25139 1758 1 4 . 1 1 49 49 ASP H H 49 8.462 8.462 7.827 0.635 25139 1759 1 4 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.960 -0.908 25139 1760 1 4 . 1 1 51 51 LEU C C 51 178.514 178.514 175.985 2.529 25139 1761 1 4 . 1 1 51 51 LEU CA C 51 58.049 58.049 54.459 3.590 25139 1762 1 4 . 1 1 51 51 LEU CB C 51 41.193 41.193 45.630 -4.436 25139 1763 1 4 . 1 1 52 52 ASN N N 52 113.819 113.819 122.876 -9.057 25139 1764 1 4 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.724 0.111 25139 1765 1 4 . 1 1 52 52 ASN C C 52 175.964 175.964 174.933 1.031 25139 1766 1 4 . 1 1 52 52 ASN CA C 52 54.096 54.096 53.139 0.957 25139 1767 1 4 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.112 0.771 25139 1768 1 4 . 1 1 52 52 ASN H H 52 7.853 7.853 9.214 -1.361 25139 1769 1 4 . 1 1 53 53 SER N N 53 114.357 114.357 112.856 1.501 25139 1770 1 4 . 1 1 53 53 SER CA C 53 59.908 59.908 58.677 1.231 25139 1771 1 4 . 1 1 53 53 SER CB C 53 64.395 64.395 62.345 2.050 25139 1772 1 4 . 1 1 53 53 SER H H 53 8.023 8.023 8.249 -0.226 25139 1773 1 4 . 1 1 54 54 PHE N N 54 121.037 121.037 117.787 3.250 25139 1774 1 4 . 1 1 54 54 PHE C C 54 175.522 175.522 177.060 -1.538 25139 1775 1 4 . 1 1 54 54 PHE CA C 54 58.064 58.064 59.304 -1.240 25139 1776 1 4 . 1 1 54 54 PHE CB C 54 43.053 43.053 39.998 3.055 25139 1777 1 4 . 1 1 54 54 PHE H H 54 7.731 7.731 8.160 -0.429 25139 1778 1 4 . 1 1 55 55 THR N N 55 116.535 116.535 119.737 -3.202 25139 1779 1 4 . 1 1 55 55 THR HA H 55 4.654 4.654 4.705 -0.051 25139 1780 1 4 . 1 1 55 55 THR C C 55 173.301 173.301 173.139 0.162 25139 1781 1 4 . 1 1 55 55 THR CA C 55 61.420 61.420 61.429 -0.009 25139 1782 1 4 . 1 1 55 55 THR CB C 55 71.388 71.388 71.076 0.312 25139 1783 1 4 . 1 1 55 55 THR H H 55 8.929 8.929 8.992 -0.063 25139 1784 1 4 . 1 1 56 56 ALA N N 56 129.359 129.359 129.310 0.049 25139 1785 1 4 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.960 0.355 25139 1786 1 4 . 1 1 56 56 ALA C C 56 178.305 178.305 177.148 1.157 25139 1787 1 4 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.891 0.980 25139 1788 1 4 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.268 0.056 25139 1789 1 4 . 1 1 56 56 ALA H H 56 8.907 8.907 8.709 0.198 25139 1790 1 4 . 1 1 57 57 GLY N N 57 106.331 106.331 109.117 -2.786 25139 1791 1 4 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.568 1.043 25139 1792 1 4 . 1 1 57 57 GLY H H 57 7.978 7.978 8.147 -0.169 25139 1793 1 4 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.346 -0.022 25139 1794 1 4 . 1 1 59 59 PRO C C 59 177.466 177.466 177.764 -0.298 25139 1795 1 4 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.896 1.588 25139 1796 1 4 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.249 -0.514 25139 1797 1 4 . 1 1 60 60 GLY N N 60 109.688 109.688 108.009 1.679 25139 1798 1 4 . 1 1 60 60 GLY C C 60 173.555 173.555 173.300 0.255 25139 1799 1 4 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.142 0.399 25139 1800 1 4 . 1 1 60 60 GLY H H 60 8.402 8.402 8.704 -0.302 25139 1801 1 4 . 1 1 61 61 PHE N N 61 122.491 122.491 121.659 0.832 25139 1802 1 4 . 1 1 61 61 PHE C C 61 175.146 175.146 174.534 0.612 25139 1803 1 4 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.647 1.635 25139 1804 1 4 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.219 -1.520 25139 1805 1 4 . 1 1 61 61 PHE H H 61 7.957 7.957 7.202 0.755 25139 1806 1 4 . 1 1 62 62 VAL N N 62 121.128 121.128 116.719 4.409 25139 1807 1 4 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.309 -0.224 25139 1808 1 4 . 1 1 62 62 VAL C C 62 174.937 174.937 174.721 0.216 25139 1809 1 4 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.648 1.060 25139 1810 1 4 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.854 0.578 25139 1811 1 4 . 1 1 62 62 VAL H H 62 7.994 7.994 8.720 -0.726 25139 1812 1 4 . 1 1 63 63 LEU N N 63 124.386 124.386 121.373 3.013 25139 1813 1 4 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.608 -1.292 25139 1814 1 4 . 1 1 63 63 LEU C C 63 175.278 175.278 177.038 -1.760 25139 1815 1 4 . 1 1 63 63 LEU CA C 63 56.288 56.288 56.042 0.246 25139 1816 1 4 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.684 1.434 25139 1817 1 4 . 1 1 63 63 LEU H H 63 7.572 7.572 8.656 -1.085 25139 1818 1 4 . 1 1 64 64 ASP N N 64 126.746 126.746 126.183 0.563 25139 1819 1 4 . 1 1 64 64 ASP C C 64 177.801 177.801 177.110 0.691 25139 1820 1 4 . 1 1 64 64 ASP CA C 64 51.721 51.721 55.553 -3.832 25139 1821 1 4 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.006 -0.608 25139 1822 1 4 . 1 1 64 64 ASP H H 64 8.552 8.552 8.549 0.003 25139 1823 1 4 . 1 1 65 65 THR C C 65 175.002 175.002 175.326 -0.324 25139 1824 1 4 . 1 1 65 65 THR CB C 65 67.919 67.919 67.123 0.796 25139 1825 1 4 . 1 1 66 66 GLN N N 66 120.804 120.804 120.417 0.387 25139 1826 1 4 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.968 -0.091 25139 1827 1 4 . 1 1 66 66 GLN C C 66 178.901 178.901 177.560 1.341 25139 1828 1 4 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.346 1.070 25139 1829 1 4 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.218 -0.294 25139 1830 1 4 . 1 1 66 66 GLN H H 66 8.447 8.447 8.119 0.328 25139 1831 1 4 . 1 1 67 67 ALA N N 67 121.267 121.267 121.766 -0.499 25139 1832 1 4 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.084 -0.127 25139 1833 1 4 . 1 1 67 67 ALA C C 67 176.777 176.777 178.394 -1.617 25139 1834 1 4 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.337 -0.013 25139 1835 1 4 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.169 0.451 25139 1836 1 4 . 1 1 67 67 ALA H H 67 7.791 7.791 7.511 0.280 25139 1837 1 4 . 1 1 68 68 SER N N 68 113.339 113.339 113.063 0.276 25139 1838 1 4 . 1 1 68 68 SER HA H 68 4.061 4.061 4.193 -0.132 25139 1839 1 4 . 1 1 68 68 SER C C 68 175.875 175.875 176.504 -0.629 25139 1840 1 4 . 1 1 68 68 SER CA C 68 62.970 62.970 60.482 2.488 25139 1841 1 4 . 1 1 68 68 SER CB C 68 61.330 61.330 63.643 -2.313 25139 1842 1 4 . 1 1 68 68 SER H H 68 7.785 7.785 7.301 0.484 25139 1843 1 4 . 1 1 69 69 VAL N N 69 125.140 125.140 118.078 7.062 25139 1844 1 4 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.217 -0.141 25139 1845 1 4 . 1 1 69 69 VAL C C 69 176.384 176.384 176.575 -0.191 25139 1846 1 4 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.544 1.187 25139 1847 1 4 . 1 1 69 69 VAL CB C 69 31.489 31.489 30.941 0.548 25139 1848 1 4 . 1 1 69 69 VAL H H 69 8.572 8.572 8.090 0.482 25139 1849 1 4 . 1 1 70 70 SER N N 70 116.704 116.704 114.416 2.288 25139 1850 1 4 . 1 1 70 70 SER HA H 70 4.229 4.229 4.300 -0.070 25139 1851 1 4 . 1 1 70 70 SER C C 70 174.101 174.101 175.308 -1.207 25139 1852 1 4 . 1 1 70 70 SER CA C 70 61.627 61.627 59.497 2.130 25139 1853 1 4 . 1 1 70 70 SER H H 70 7.951 7.951 7.754 0.197 25139 1854 1 4 . 1 1 71 71 ASN N N 71 117.576 117.576 117.068 0.508 25139 1855 1 4 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.669 0.133 25139 1856 1 4 . 1 1 71 71 ASN C C 71 174.332 174.332 174.758 -0.426 25139 1857 1 4 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.883 -0.444 25139 1858 1 4 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.180 0.287 25139 1859 1 4 . 1 1 71 71 ASN H H 71 7.131 7.131 7.487 -0.356 25139 1860 1 4 . 1 1 72 72 GLY N N 72 103.925 103.925 105.650 -1.725 25139 1861 1 4 . 1 1 72 72 GLY C C 72 174.710 174.710 173.554 1.156 25139 1862 1 4 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.599 -0.050 25139 1863 1 4 . 1 1 72 72 GLY H H 72 7.338 7.338 7.397 -0.059 25139 1864 1 4 . 1 1 73 73 ALA N N 73 124.942 124.942 123.221 1.721 25139 1865 1 4 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.550 -0.378 25139 1866 1 4 . 1 1 73 73 ALA C C 73 175.896 175.896 176.203 -0.307 25139 1867 1 4 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.855 0.818 25139 1868 1 4 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.118 -0.062 25139 1869 1 4 . 1 1 73 73 ALA H H 73 8.032 8.032 7.860 0.172 25139 1870 1 4 . 1 1 74 74 THR N N 74 113.423 113.423 116.237 -2.814 25139 1871 1 4 . 1 1 74 74 THR HA H 74 4.678 4.678 4.563 0.115 25139 1872 1 4 . 1 1 74 74 THR C C 74 173.339 173.339 173.184 0.155 25139 1873 1 4 . 1 1 74 74 THR CA C 74 61.545 61.545 61.625 -0.080 25139 1874 1 4 . 1 1 74 74 THR CB C 74 71.319 71.319 71.313 0.006 25139 1875 1 4 . 1 1 74 74 THR H H 74 8.530 8.530 8.296 0.234 25139 1876 1 4 . 1 1 75 75 PHE N N 75 128.180 128.180 130.611 -2.431 25139 1877 1 4 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.912 -0.308 25139 1878 1 4 . 1 1 75 75 PHE C C 75 174.623 174.623 175.315 -0.692 25139 1879 1 4 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.301 2.315 25139 1880 1 4 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.623 1.052 25139 1881 1 4 . 1 1 75 75 PHE H H 75 9.146 9.146 9.109 0.037 25139 1882 1 4 . 1 1 76 76 LEU N N 76 127.849 127.849 124.861 2.988 25139 1883 1 4 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.432 -0.081 25139 1884 1 4 . 1 1 76 76 LEU C C 76 176.339 176.339 176.902 -0.563 25139 1885 1 4 . 1 1 76 76 LEU CA C 76 55.983 55.983 56.033 -0.050 25139 1886 1 4 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.204 0.126 25139 1887 1 4 . 1 1 76 76 LEU H H 76 8.635 8.635 8.091 0.544 25139 1888 1 4 . 1 1 77 77 GLU N N 77 115.131 115.131 119.086 -3.955 25139 1889 1 4 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.490 -0.082 25139 1890 1 4 . 1 1 77 77 GLU C C 77 174.734 174.734 174.790 -0.056 25139 1891 1 4 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.550 0.803 25139 1892 1 4 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.273 -0.066 25139 1893 1 4 . 1 1 77 77 GLU H H 77 7.252 7.252 7.672 -0.420 25139 1894 1 4 . 1 1 78 78 SER N N 78 118.016 118.016 118.028 -0.012 25139 1895 1 4 . 1 1 78 78 SER HA H 78 5.561 5.561 5.163 0.398 25139 1896 1 4 . 1 1 78 78 SER C C 78 171.968 171.968 172.655 -0.687 25139 1897 1 4 . 1 1 78 78 SER CA C 78 54.061 54.061 54.563 -0.502 25139 1898 1 4 . 1 1 78 78 SER CB C 78 64.074 64.074 63.623 0.451 25139 1899 1 4 . 1 1 78 78 SER H H 78 9.033 9.033 8.671 0.362 25139 1900 1 4 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.877 -0.277 25139 1901 1 4 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.309 0.101 25139 1902 1 4 . 1 1 80 80 THR N N 80 118.079 118.079 115.795 2.284 25139 1903 1 4 . 1 1 80 80 THR HA H 80 4.342 4.342 4.331 0.011 25139 1904 1 4 . 1 1 80 80 THR C C 80 174.494 174.494 174.133 0.361 25139 1905 1 4 . 1 1 80 80 THR CA C 80 61.453 61.453 60.370 1.083 25139 1906 1 4 . 1 1 80 80 THR CB C 80 67.797 67.797 68.240 -0.443 25139 1907 1 4 . 1 1 80 80 THR H H 80 8.670 8.670 8.382 0.288 25139 1908 1 4 . 1 1 81 81 VAL N N 81 117.395 117.395 116.616 0.779 25139 1909 1 4 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.936 0.671 25139 1910 1 4 . 1 1 81 81 VAL C C 81 175.518 175.518 176.364 -0.846 25139 1911 1 4 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.645 -2.531 25139 1912 1 4 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.376 2.219 25139 1913 1 4 . 1 1 81 81 VAL H H 81 7.448 7.448 7.257 0.191 25139 1914 1 4 . 1 1 82 82 ARG N N 82 117.852 117.852 120.499 -2.647 25139 1915 1 4 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.482 0.039 25139 1916 1 4 . 1 1 82 82 ARG C C 82 176.992 176.992 175.720 1.272 25139 1917 1 4 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.884 0.501 25139 1918 1 4 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.360 1.242 25139 1919 1 4 . 1 1 82 82 ARG H H 82 8.710 8.710 8.633 0.077 25139 1920 1 4 . 1 1 83 83 ARG N N 83 117.035 117.035 117.687 -0.652 25139 1921 1 4 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.786 0.536 25139 1922 1 4 . 1 1 83 83 ARG C C 83 177.379 177.379 176.517 0.862 25139 1923 1 4 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.645 -0.961 25139 1924 1 4 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.540 -1.499 25139 1925 1 4 . 1 1 83 83 ARG H H 83 7.292 7.292 7.237 0.055 25139 1926 1 4 . 1 1 84 84 GLY N N 84 114.911 114.911 109.660 5.251 25139 1927 1 4 . 1 1 84 84 GLY C C 84 176.940 176.940 174.815 2.125 25139 1928 1 4 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.715 1.956 25139 1929 1 4 . 1 1 84 84 GLY H H 84 9.255 9.255 8.436 0.819 25139 1930 1 4 . 1 1 85 85 TRP N N 85 121.810 121.810 119.455 2.355 25139 1931 1 4 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.256 -0.089 25139 1932 1 4 . 1 1 85 85 TRP C C 85 178.272 178.272 177.287 0.985 25139 1933 1 4 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.879 1.166 25139 1934 1 4 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.307 -0.090 25139 1935 1 4 . 1 1 85 85 TRP H H 85 9.963 9.963 8.117 1.846 25139 1936 1 4 . 1 1 86 86 ASP N N 86 116.400 116.400 120.139 -3.739 25139 1937 1 4 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.468 -0.075 25139 1938 1 4 . 1 1 86 86 ASP C C 86 178.803 178.803 177.892 0.911 25139 1939 1 4 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.833 0.221 25139 1940 1 4 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.239 0.494 25139 1941 1 4 . 1 1 86 86 ASP H H 86 6.934 6.934 7.557 -0.623 25139 1942 1 4 . 1 1 87 87 CYS N N 87 122.454 122.454 118.931 3.523 25139 1943 1 4 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.193 0.057 25139 1944 1 4 . 1 1 87 87 CYS C C 87 174.956 174.956 176.616 -1.660 25139 1945 1 4 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.916 -3.769 25139 1946 1 4 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.275 11.210 25139 1947 1 4 . 1 1 87 87 CYS H H 87 7.603 7.603 7.468 0.135 25139 1948 1 4 . 1 1 88 88 VAL N N 88 119.192 119.192 116.437 2.755 25139 1949 1 4 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.144 -0.686 25139 1950 1 4 . 1 1 88 88 VAL C C 88 177.413 177.413 176.882 0.531 25139 1951 1 4 . 1 1 88 88 VAL CA C 88 66.976 66.976 64.722 2.254 25139 1952 1 4 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.640 -0.398 25139 1953 1 4 . 1 1 88 88 VAL H H 88 7.192 7.192 7.085 0.107 25139 1954 1 4 . 1 1 89 89 ARG N N 89 118.185 118.185 118.414 -0.229 25139 1955 1 4 . 1 1 89 89 ARG HA H 89 3.680 3.680 4.436 -0.756 25139 1956 1 4 . 1 1 89 89 ARG C C 89 178.677 178.677 177.938 0.739 25139 1957 1 4 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.404 1.551 25139 1958 1 4 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.438 0.353 25139 1959 1 4 . 1 1 89 89 ARG H H 89 7.971 7.971 7.517 0.454 25139 1960 1 4 . 1 1 90 90 ALA N N 90 120.815 120.815 122.809 -1.994 25139 1961 1 4 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.244 -0.169 25139 1962 1 4 . 1 1 90 90 ALA C C 90 177.416 177.416 178.753 -1.337 25139 1963 1 4 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.487 -0.233 25139 1964 1 4 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.221 -0.785 25139 1965 1 4 . 1 1 90 90 ALA H H 90 7.453 7.453 7.458 -0.005 25139 1966 1 4 . 1 1 91 91 CYS N N 91 120.380 120.380 116.208 4.172 25139 1967 1 4 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.246 0.125 25139 1968 1 4 . 1 1 91 91 CYS C C 91 176.654 176.654 175.942 0.712 25139 1969 1 4 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.964 -4.269 25139 1970 1 4 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.218 12.486 25139 1971 1 4 . 1 1 91 91 CYS H H 91 7.944 7.944 7.548 0.396 25139 1972 1 4 . 1 1 92 92 CYS N N 92 116.270 116.270 119.172 -2.902 25139 1973 1 4 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.646 -0.242 25139 1974 1 4 . 1 1 92 92 CYS C C 92 175.628 175.628 176.757 -1.129 25139 1975 1 4 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.267 -2.561 25139 1976 1 4 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.419 14.729 25139 1977 1 4 . 1 1 92 92 CYS H H 92 8.315 8.315 7.658 0.657 25139 1978 1 4 . 1 1 93 93 THR N N 93 107.283 107.283 111.926 -4.643 25139 1979 1 4 . 1 1 93 93 THR HA H 93 4.481 4.481 4.182 0.299 25139 1980 1 4 . 1 1 93 93 THR C C 93 173.606 173.606 175.420 -1.814 25139 1981 1 4 . 1 1 93 93 THR CA C 93 61.402 61.402 63.930 -2.528 25139 1982 1 4 . 1 1 93 93 THR CB C 93 69.046 69.046 69.078 -0.032 25139 1983 1 4 . 1 1 93 93 THR H H 93 7.445 7.445 7.472 -0.027 25139 1984 1 4 . 1 1 94 94 THR N N 94 121.432 121.432 120.863 0.569 25139 1985 1 4 . 1 1 94 94 THR HA H 94 4.398 4.398 4.453 -0.055 25139 1986 1 4 . 1 1 94 94 THR C C 94 173.493 173.493 174.452 -0.959 25139 1987 1 4 . 1 1 94 94 THR CA C 94 62.726 62.726 62.790 -0.064 25139 1988 1 4 . 1 1 94 94 THR CB C 94 69.704 69.704 69.073 0.631 25139 1989 1 4 . 1 1 94 94 THR H H 94 7.553 7.553 8.038 -0.485 25139 1990 1 4 . 1 1 95 95 GLN N N 95 129.410 129.410 126.794 2.616 25139 1991 1 4 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.007 -0.063 25139 1992 1 4 . 1 1 95 95 GLN C C 95 176.293 176.293 175.654 0.639 25139 1993 1 4 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.721 -0.681 25139 1994 1 4 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.668 -0.412 25139 1995 1 4 . 1 1 95 95 GLN H H 95 8.812 8.812 8.522 0.290 25139 1996 1 4 . 1 1 96 96 ASN N N 96 115.015 115.015 114.943 0.072 25139 1997 1 4 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.906 -0.707 25139 1998 1 4 . 1 1 96 96 ASN C C 96 172.260 172.260 174.068 -1.808 25139 1999 1 4 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.763 2.804 25139 2000 1 4 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.667 -1.830 25139 2001 1 4 . 1 1 96 96 ASN H H 96 8.791 8.791 8.129 0.662 25139 2002 1 4 . 1 1 97 97 CYS N N 97 115.830 115.830 121.117 -5.287 25139 2003 1 4 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.465 -0.364 25139 2004 1 4 . 1 1 97 97 CYS C C 97 175.025 175.025 173.553 1.472 25139 2005 1 4 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.350 -1.202 25139 2006 1 4 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.535 15.699 25139 2007 1 4 . 1 1 97 97 CYS H H 97 7.651 7.651 7.990 -0.339 25139 2008 1 4 . 1 1 98 98 ASN N N 98 125.148 125.148 124.253 0.895 25139 2009 1 4 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.977 0.156 25139 2010 1 4 . 1 1 98 98 ASN C C 98 171.892 171.892 174.300 -2.408 25139 2011 1 4 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.190 0.004 25139 2012 1 4 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.023 -1.075 25139 2013 1 4 . 1 1 98 98 ASN H H 98 8.736 8.736 8.420 0.316 25139 2014 1 4 . 1 1 99 99 LEU N N 99 120.898 120.898 122.757 -1.859 25139 2015 1 4 . 1 1 99 99 LEU C C 99 173.084 173.084 174.037 -0.953 25139 2016 1 4 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.632 2.489 25139 2017 1 4 . 1 1 99 99 LEU CB C 99 44.328 44.328 44.718 -0.390 25139 2018 1 4 . 1 1 99 99 LEU H H 99 8.200 8.200 8.062 0.138 25139 2019 1 4 . 1 1 100 100 ALA N N 100 128.085 128.085 130.573 -2.488 25139 2020 1 4 . 1 1 100 100 ALA C C 100 174.938 174.938 175.437 -0.499 25139 2021 1 4 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.427 -0.680 25139 2022 1 4 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.349 0.365 25139 2023 1 4 . 1 1 100 100 ALA H H 100 9.156 9.156 9.244 -0.088 25139 2024 1 4 . 1 1 101 101 LEU N N 101 128.723 128.723 128.222 0.501 25139 2025 1 4 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.237 -0.095 25139 2026 1 4 . 1 1 101 101 LEU C C 101 174.379 174.379 175.375 -0.996 25139 2027 1 4 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.696 -0.843 25139 2028 1 4 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.627 0.680 25139 2029 1 4 . 1 1 101 101 LEU H H 101 9.578 9.578 8.973 0.605 25139 2030 1 4 . 1 1 102 102 VAL N N 102 119.417 119.417 120.387 -0.970 25139 2031 1 4 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.301 0.227 25139 2032 1 4 . 1 1 102 102 VAL C C 102 173.660 173.660 174.073 -0.413 25139 2033 1 4 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.847 -0.227 25139 2034 1 4 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.649 -1.376 25139 2035 1 4 . 1 1 102 102 VAL H H 102 9.297 9.297 9.434 -0.137 25139 2036 1 4 . 1 1 103 103 GLU N N 103 124.427 124.427 123.801 0.626 25139 2037 1 4 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.217 -0.352 25139 2038 1 4 . 1 1 103 103 GLU C C 103 176.319 176.319 175.438 0.881 25139 2039 1 4 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.454 -0.353 25139 2040 1 4 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.641 0.560 25139 2041 1 4 . 1 1 103 103 GLU H H 103 7.749 7.749 8.269 -0.520 25139 2042 1 4 . 1 1 104 104 LEU N N 104 127.294 127.294 125.757 1.537 25139 2043 1 4 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.561 -0.241 25139 2044 1 4 . 1 1 104 104 LEU C C 104 176.593 176.593 177.804 -1.211 25139 2045 1 4 . 1 1 104 104 LEU CA C 104 56.084 56.084 52.802 3.282 25139 2046 1 4 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.767 -0.376 25139 2047 1 4 . 1 1 104 104 LEU H H 104 8.323 8.323 7.830 0.493 25139 2048 1 4 . 1 1 105 105 GLN N N 105 121.361 121.361 117.089 4.272 25139 2049 1 4 . 1 1 105 105 GLN C C 105 172.868 172.868 174.051 -1.183 25139 2050 1 4 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.265 -2.859 25139 2051 1 4 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.768 1.961 25139 2052 1 4 . 1 1 105 105 GLN H H 105 8.095 8.095 8.175 -0.080 25139 2053 1 4 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.333 0.076 25139 2054 1 4 . 1 1 106 106 PRO C C 106 177.770 177.770 176.754 1.016 25139 2055 1 4 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.973 -0.488 25139 2056 1 4 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.079 -0.311 25139 2057 1 4 . 1 1 107 107 ASP N N 107 116.484 116.484 114.414 2.070 25139 2058 1 4 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.572 -0.132 25139 2059 1 4 . 1 1 107 107 ASP C C 107 176.749 176.749 176.716 0.033 25139 2060 1 4 . 1 1 107 107 ASP CA C 107 55.455 55.455 54.632 0.823 25139 2061 1 4 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.381 -0.493 25139 2062 1 4 . 1 1 107 107 ASP H H 107 8.638 8.638 8.260 0.378 25139 2063 1 4 . 1 1 108 108 ARG N N 108 117.895 117.895 121.085 -3.190 25139 2064 1 4 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.628 -0.138 25139 2065 1 4 . 1 1 108 108 ARG C C 108 176.111 176.111 177.171 -1.060 25139 2066 1 4 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.789 -0.524 25139 2067 1 4 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.823 0.253 25139 2068 1 4 . 1 1 108 108 ARG H H 108 7.905 7.905 8.262 -0.357 25139 2069 1 4 . 1 1 109 109 GLY N N 109 108.307 108.307 106.693 1.614 25139 2070 1 4 . 1 1 109 109 GLY C C 109 173.949 173.949 173.382 0.567 25139 2071 1 4 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.011 -0.460 25139 2072 1 4 . 1 1 109 109 GLY H H 109 7.753 7.753 8.316 -0.563 25139 2073 1 4 . 1 1 110 110 GLU N N 110 120.035 120.035 121.544 -1.509 25139 2074 1 4 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.492 -0.401 25139 2075 1 4 . 1 1 110 110 GLU C C 110 177.045 177.045 176.248 0.797 25139 2076 1 4 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.506 1.776 25139 2077 1 4 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.018 -1.345 25139 2078 1 4 . 1 1 110 110 GLU H H 110 8.509 8.509 8.603 -0.094 25139 2079 1 4 . 1 1 111 111 ASP N N 111 121.160 121.160 119.139 2.021 25139 2080 1 4 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.586 -0.016 25139 2081 1 4 . 1 1 111 111 ASP C C 111 175.089 175.089 176.044 -0.955 25139 2082 1 4 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.293 -0.702 25139 2083 1 4 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.860 1.572 25139 2084 1 4 . 1 1 111 111 ASP H H 111 8.916 8.916 8.412 0.504 25139 2085 1 4 . 1 1 112 112 ALA N N 112 122.130 122.130 120.870 1.260 25139 2086 1 4 . 1 1 112 112 ALA C C 112 178.120 178.120 176.154 1.966 25139 2087 1 4 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.670 2.589 25139 2088 1 4 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.496 -1.726 25139 2089 1 4 . 1 1 112 112 ALA H H 112 7.361 7.361 7.483 -0.122 25139 2090 1 4 . 1 1 113 113 ILE N N 113 113.780 113.780 114.680 -0.900 25139 2091 1 4 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.866 0.020 25139 2092 1 4 . 1 1 113 113 ILE C C 113 174.258 174.258 174.740 -0.482 25139 2093 1 4 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.302 0.210 25139 2094 1 4 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.886 -0.038 25139 2095 1 4 . 1 1 113 113 ILE H H 113 7.667 7.667 8.452 -0.785 25139 2096 1 4 . 1 1 114 114 ALA N N 114 122.673 122.673 125.315 -2.642 25139 2097 1 4 . 1 1 114 114 ALA C C 114 176.984 176.984 176.730 0.254 25139 2098 1 4 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.007 -1.442 25139 2099 1 4 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.633 0.949 25139 2100 1 4 . 1 1 114 114 ALA H H 114 8.904 8.904 8.813 0.091 25139 2101 1 4 . 1 1 115 115 ALA N N 115 116.486 116.486 116.913 -0.427 25139 2102 1 4 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.436 -0.081 25139 2103 1 4 . 1 1 115 115 ALA C C 115 174.138 174.138 174.208 -0.070 25139 2104 1 4 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.817 1.503 25139 2105 1 4 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.484 1.499 25139 2106 1 4 . 1 1 115 115 ALA H H 115 7.182 7.182 7.233 -0.051 25139 2107 1 4 . 1 1 116 116 CYS N N 116 120.099 120.099 120.087 0.012 25139 2108 1 4 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.284 0.047 25139 2109 1 4 . 1 1 116 116 CYS C C 116 176.609 176.609 172.531 4.078 25139 2110 1 4 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.214 -2.265 25139 2111 1 4 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.776 11.608 25139 2112 1 4 . 1 1 116 116 CYS H H 116 8.298 8.298 7.852 0.446 25139 2113 1 4 . 1 1 117 117 PHE N N 117 126.406 126.406 125.968 0.438 25139 2114 1 4 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.130 0.069 25139 2115 1 4 . 1 1 117 117 PHE C C 117 173.385 173.385 174.354 -0.969 25139 2116 1 4 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.058 0.196 25139 2117 1 4 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.508 0.173 25139 2118 1 4 . 1 1 117 117 PHE H H 117 9.712 9.712 9.109 0.603 25139 2119 1 4 . 1 1 118 118 LEU N N 118 122.119 122.119 123.825 -1.706 25139 2120 1 4 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.483 -0.317 25139 2121 1 4 . 1 1 118 118 LEU C C 118 175.097 175.097 176.449 -1.352 25139 2122 1 4 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.138 -0.234 25139 2123 1 4 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.435 -1.137 25139 2124 1 4 . 1 1 118 118 LEU H H 118 8.719 8.719 9.265 -0.546 25139 2125 1 4 . 1 1 119 119 ILE N N 119 125.324 125.324 122.572 2.752 25139 2126 1 4 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.921 -0.044 25139 2127 1 4 . 1 1 119 119 ILE C C 119 173.825 173.825 175.301 -1.476 25139 2128 1 4 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.946 -0.839 25139 2129 1 4 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.420 -0.910 25139 2130 1 4 . 1 1 119 119 ILE H H 119 8.986 8.986 9.104 -0.118 25139 2131 1 4 . 1 1 120 120 ASN N N 120 121.534 121.534 123.931 -2.397 25139 2132 1 4 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.876 0.514 25139 2133 1 4 . 1 1 120 120 ASN C C 120 176.098 176.098 175.922 0.176 25139 2134 1 4 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.337 -3.880 25139 2135 1 4 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.227 0.691 25139 2136 1 4 . 1 1 120 120 ASN H H 120 8.694 8.694 9.101 -0.407 25139 2137 1 4 . 1 1 121 121 CYS N N 121 122.779 122.779 117.363 5.416 25139 2138 1 4 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.061 0.422 25139 2139 1 4 . 1 1 121 121 CYS C C 121 173.195 173.195 173.318 -0.123 25139 2140 1 4 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.939 -4.175 25139 2141 1 4 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.579 16.128 25139 2142 1 4 . 1 1 121 121 CYS H H 121 10.668 10.668 8.587 2.081 25139 2143 1 4 . 1 1 122 122 LEU N N 122 121.063 121.063 117.346 3.717 25139 2144 1 4 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.583 -0.218 25139 2145 1 4 . 1 1 122 122 LEU C C 122 176.743 176.743 175.577 1.166 25139 2146 1 4 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.966 0.698 25139 2147 1 4 . 1 1 122 122 LEU CB C 122 44.234 44.234 46.004 -1.770 25139 2148 1 4 . 1 1 122 122 LEU H H 122 8.256 8.256 7.992 0.264 25139 2149 1 4 . 1 1 123 123 TYR N N 123 123.081 123.081 122.729 0.352 25139 2150 1 4 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.738 -0.695 25139 2151 1 4 . 1 1 123 123 TYR C C 123 173.633 173.633 174.910 -1.277 25139 2152 1 4 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.119 -0.231 25139 2153 1 4 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.523 -0.442 25139 2154 1 4 . 1 1 123 123 TYR H H 123 8.990 8.990 8.964 0.026 25139 2155 1 4 . 1 1 124 124 GLU N N 124 128.742 128.742 127.184 1.558 25139 2156 1 4 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.735 -0.185 25139 2157 1 4 . 1 1 124 124 GLU C C 124 174.835 174.835 175.436 -0.601 25139 2158 1 4 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.453 0.179 25139 2159 1 4 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.263 -0.368 25139 2160 1 4 . 1 1 124 124 GLU H H 124 9.135 9.135 8.774 0.361 25139 2161 1 4 . 1 1 125 125 GLN N N 125 108.066 108.066 110.046 -1.980 25139 2162 1 4 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.931 -0.210 25139 2163 1 4 . 1 1 125 125 GLN C C 125 174.627 174.627 174.996 -0.369 25139 2164 1 4 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.360 0.679 25139 2165 1 4 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.708 -0.380 25139 2166 1 4 . 1 1 125 125 GLN H H 125 8.390 8.390 8.573 -0.183 25139 2167 1 4 . 1 1 126 126 ASN N N 126 118.528 118.528 117.886 0.642 25139 2168 1 4 . 1 1 126 126 ASN C C 126 173.713 173.713 175.020 -1.307 25139 2169 1 4 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.603 -0.414 25139 2170 1 4 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.887 0.914 25139 2171 1 4 . 1 1 126 126 ASN H H 126 8.092 8.092 7.962 0.130 25139 2172 1 4 . 1 1 127 127 PHE N N 127 124.680 124.680 122.399 2.281 25139 2173 1 4 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.741 0.296 25139 2174 1 4 . 1 1 127 127 PHE C C 127 177.125 177.125 176.475 0.650 25139 2175 1 4 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.956 1.456 25139 2176 1 4 . 1 1 127 127 PHE CB C 127 39.244 39.244 37.936 1.308 25139 2177 1 4 . 1 1 127 127 PHE H H 127 9.026 9.026 8.859 0.167 25139 2178 1 4 . 1 1 128 128 VAL N N 128 119.455 119.455 118.972 0.483 25139 2179 1 4 . 1 1 128 128 VAL C C 128 175.886 175.886 175.459 0.427 25139 2180 1 4 . 1 1 128 128 VAL CA C 128 60.919 60.919 62.033 -1.114 25139 2181 1 4 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.711 2.483 25139 2182 1 4 . 1 1 128 128 VAL H H 128 8.364 8.364 7.635 0.729 25139 2183 1 4 . 1 1 129 129 CYS N N 129 116.130 116.130 120.062 -3.932 25139 2184 1 4 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.761 -0.284 25139 2185 1 4 . 1 1 129 129 CYS C C 129 170.569 170.569 174.288 -3.719 25139 2186 1 4 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.205 -3.055 25139 2187 1 4 . 1 1 129 129 CYS CB C 129 44.617 44.617 24.992 19.625 25139 2188 1 4 . 1 1 129 129 CYS H H 129 5.390 5.390 7.223 -1.833 25139 2189 1 4 . 1 1 130 130 LYS N N 130 120.071 120.071 128.464 -8.393 25139 2190 1 4 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.203 0.358 25139 2191 1 4 . 1 1 130 130 LYS C C 130 176.853 176.853 174.822 2.031 25139 2192 1 4 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.220 -0.333 25139 2193 1 4 . 1 1 130 130 LYS CB C 130 35.642 35.642 33.601 2.041 25139 2194 1 4 . 1 1 130 130 LYS H H 130 8.066 8.066 8.472 -0.406 25139 2195 1 4 . 1 1 131 131 PHE N N 131 118.415 118.415 120.460 -2.045 25139 2196 1 4 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.398 -0.791 25139 2197 1 4 . 1 1 131 131 PHE C C 131 174.013 174.013 175.113 -1.100 25139 2198 1 4 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.335 1.376 25139 2199 1 4 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.274 0.806 25139 2200 1 4 . 1 1 131 131 PHE H H 131 8.714 8.714 8.233 0.481 25139 2201 1 4 . 1 1 132 132 ALA N N 132 124.209 124.209 122.990 1.219 25139 2202 1 4 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.006 -0.389 25139 2203 1 4 . 1 1 132 132 ALA C C 132 174.352 174.352 174.222 0.130 25139 2204 1 4 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.886 1.555 25139 2205 1 4 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.777 -0.313 25139 2206 1 4 . 1 1 132 132 ALA H H 132 9.295 9.295 8.829 0.466 25139 2207 1 4 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.269 -0.386 25139 2208 1 4 . 1 1 133 133 PRO C C 133 173.923 173.923 176.367 -2.444 25139 2209 1 4 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.704 0.367 25139 2210 1 4 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.400 -0.797 25139 2211 1 4 . 1 1 134 134 ARG N N 134 126.071 126.071 122.624 3.447 25139 2212 1 4 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.583 -0.328 25139 2213 1 4 . 1 1 134 134 ARG C C 134 177.065 177.065 176.797 0.268 25139 2214 1 4 . 1 1 134 134 ARG CA C 134 57.164 57.164 56.031 1.133 25139 2215 1 4 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.229 -1.046 25139 2216 1 4 . 1 1 134 134 ARG H H 134 8.672 8.672 8.617 0.055 25139 2217 1 4 . 1 1 135 135 GLU N N 135 125.683 125.683 123.760 1.923 25139 2218 1 4 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.315 0.038 25139 2219 1 4 . 1 1 135 135 GLU C C 135 178.081 178.081 177.390 0.691 25139 2220 1 4 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.706 -0.055 25139 2221 1 4 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.790 0.206 25139 2222 1 4 . 1 1 135 135 GLU H H 135 8.603 8.603 9.008 -0.405 25139 2223 1 4 . 1 1 136 136 GLY N N 136 110.031 110.031 107.859 2.172 25139 2224 1 4 . 1 1 136 136 GLY C C 136 173.079 173.079 172.411 0.668 25139 2225 1 4 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.815 0.963 25139 2226 1 4 . 1 1 136 136 GLY H H 136 9.036 9.036 8.515 0.521 25139 2227 1 4 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.618 0.057 25139 2228 1 4 . 1 1 137 137 PHE C C 137 174.936 174.936 173.997 0.939 25139 2229 1 4 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.452 -0.368 25139 2230 1 4 . 1 1 137 137 PHE CB C 137 44.696 44.696 43.253 1.443 25139 2231 1 4 . 1 1 138 138 ILE N N 138 117.417 117.417 114.773 2.644 25139 2232 1 4 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.678 -0.171 25139 2233 1 4 . 1 1 138 138 ILE C C 138 173.858 173.858 173.305 0.553 25139 2234 1 4 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.591 1.029 25139 2235 1 4 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.297 1.300 25139 2236 1 4 . 1 1 138 138 ILE H H 138 8.777 8.777 8.745 0.032 25139 2237 1 4 . 1 1 139 139 ASN N N 139 117.201 117.201 116.958 0.243 25139 2238 1 4 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.506 0.553 25139 2239 1 4 . 1 1 139 139 ASN C C 139 173.721 173.721 174.183 -0.462 25139 2240 1 4 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.670 -1.440 25139 2241 1 4 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.344 1.517 25139 2242 1 4 . 1 1 139 139 ASN H H 139 8.872 8.872 8.365 0.507 25139 2243 1 4 . 1 1 140 140 TYR N N 140 123.991 123.991 119.971 4.020 25139 2244 1 4 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.800 0.378 25139 2245 1 4 . 1 1 140 140 TYR C C 140 174.791 174.791 175.252 -0.461 25139 2246 1 4 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.335 -1.263 25139 2247 1 4 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.839 1.831 25139 2248 1 4 . 1 1 140 140 TYR H H 140 9.526 9.526 9.006 0.520 25139 2249 1 4 . 1 1 141 141 LEU N N 141 122.779 122.779 120.069 2.710 25139 2250 1 4 . 1 1 141 141 LEU C C 141 175.404 175.404 177.569 -2.165 25139 2251 1 4 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.941 2.163 25139 2252 1 4 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.372 -1.211 25139 2253 1 4 . 1 1 141 141 LEU H H 141 9.010 9.010 8.970 0.040 25139 2254 1 4 . 1 1 142 142 THR N N 142 113.189 113.189 111.769 1.420 25139 2255 1 4 . 1 1 142 142 THR HA H 142 4.061 4.061 4.153 -0.092 25139 2256 1 4 . 1 1 142 142 THR C C 142 175.940 175.940 176.020 -0.080 25139 2257 1 4 . 1 1 142 142 THR CA C 142 61.389 61.389 61.049 0.340 25139 2258 1 4 . 1 1 142 142 THR CB C 142 69.779 69.779 69.939 -0.161 25139 2259 1 4 . 1 1 142 142 THR H H 142 7.737 7.737 8.180 -0.443 25139 2260 1 4 . 1 1 143 143 ARG N N 143 120.975 120.975 119.531 1.444 25139 2261 1 4 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.966 -0.028 25139 2262 1 4 . 1 1 143 143 ARG C C 143 178.690 178.690 177.127 1.563 25139 2263 1 4 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.158 0.590 25139 2264 1 4 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.459 0.686 25139 2265 1 4 . 1 1 143 143 ARG H H 143 8.149 8.149 8.457 -0.308 25139 2266 1 4 . 1 1 144 144 GLU N N 144 116.997 116.997 119.697 -2.700 25139 2267 1 4 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.303 -0.194 25139 2268 1 4 . 1 1 144 144 GLU C C 144 178.442 178.442 178.966 -0.524 25139 2269 1 4 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.590 1.273 25139 2270 1 4 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.295 -0.713 25139 2271 1 4 . 1 1 144 144 GLU H H 144 8.622 8.622 7.659 0.963 25139 2272 1 4 . 1 1 145 145 VAL N N 145 111.213 111.213 117.028 -5.815 25139 2273 1 4 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.912 0.499 25139 2274 1 4 . 1 1 145 145 VAL C C 145 176.965 176.965 177.059 -0.094 25139 2275 1 4 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.332 -0.738 25139 2276 1 4 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.155 0.927 25139 2277 1 4 . 1 1 145 145 VAL H H 145 7.227 7.227 7.636 -0.409 25139 2278 1 4 . 1 1 146 146 TYR N N 146 123.512 123.512 121.509 2.003 25139 2279 1 4 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.118 -0.238 25139 2280 1 4 . 1 1 146 146 TYR C C 146 176.377 176.377 176.697 -0.320 25139 2281 1 4 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.906 0.631 25139 2282 1 4 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.708 -0.369 25139 2283 1 4 . 1 1 146 146 TYR H H 146 8.492 8.492 8.453 0.039 25139 2284 1 4 . 1 1 147 147 ARG N N 147 116.680 116.680 117.686 -1.006 25139 2285 1 4 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.956 -0.142 25139 2286 1 4 . 1 1 147 147 ARG C C 147 178.858 178.858 178.696 0.162 25139 2287 1 4 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.660 1.036 25139 2288 1 4 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.216 0.449 25139 2289 1 4 . 1 1 147 147 ARG H H 147 8.053 8.053 7.822 0.231 25139 2290 1 4 . 1 1 148 148 SER N N 148 115.306 115.306 115.199 0.107 25139 2291 1 4 . 1 1 148 148 SER HA H 148 3.998 3.998 4.395 -0.397 25139 2292 1 4 . 1 1 148 148 SER C C 148 175.786 175.786 175.917 -0.131 25139 2293 1 4 . 1 1 148 148 SER CA C 148 62.006 62.006 60.498 1.508 25139 2294 1 4 . 1 1 148 148 SER H H 148 7.139 7.139 7.484 -0.345 25139 2295 1 4 . 1 1 149 149 TYR N N 149 123.207 123.207 122.107 1.100 25139 2296 1 4 . 1 1 149 149 TYR C C 149 175.831 175.831 177.474 -1.643 25139 2297 1 4 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.414 -0.814 25139 2298 1 4 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.553 0.228 25139 2299 1 4 . 1 1 149 149 TYR H H 149 7.253 7.253 7.533 -0.280 25139 2300 1 4 . 1 1 150 150 ARG N N 150 118.708 118.708 117.976 0.732 25139 2301 1 4 . 1 1 150 150 ARG HA H 150 3.346 3.346 4.007 -0.661 25139 2302 1 4 . 1 1 150 150 ARG C C 150 177.644 177.644 177.858 -0.214 25139 2303 1 4 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.528 -0.204 25139 2304 1 4 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.556 -0.702 25139 2305 1 4 . 1 1 150 150 ARG H H 150 8.441 8.441 7.678 0.763 25139 2306 1 4 . 1 1 151 151 GLN N N 151 116.551 116.551 116.567 -0.016 25139 2307 1 4 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.152 -0.195 25139 2308 1 4 . 1 1 151 151 GLN C C 151 177.987 177.987 176.451 1.536 25139 2309 1 4 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.864 0.477 25139 2310 1 4 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.473 -0.009 25139 2311 1 4 . 1 1 151 151 GLN H H 151 7.332 7.332 7.623 -0.291 25139 2312 1 4 . 1 1 152 152 LEU N N 152 118.877 118.877 114.661 4.216 25139 2313 1 4 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.706 -0.527 25139 2314 1 4 . 1 1 152 152 LEU C C 152 179.070 179.070 177.111 1.959 25139 2315 1 4 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.791 1.291 25139 2316 1 4 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.584 -0.896 25139 2317 1 4 . 1 1 152 152 LEU H H 152 7.106 7.106 7.285 -0.179 25139 2318 1 4 . 1 1 153 153 VAL N N 153 119.076 119.076 114.256 4.820 25139 2319 1 4 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.239 -1.379 25139 2320 1 4 . 1 1 153 153 VAL C C 153 177.421 177.421 176.133 1.288 25139 2321 1 4 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.614 2.969 25139 2322 1 4 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.707 -2.189 25139 2323 1 4 . 1 1 153 153 VAL H H 153 7.427 7.427 7.259 0.168 25139 2324 1 4 . 1 1 154 154 ASP N N 154 119.888 119.888 120.503 -0.615 25139 2325 1 4 . 1 1 154 154 ASP C C 154 177.422 177.422 175.112 2.310 25139 2326 1 4 . 1 1 154 154 ASP CA C 154 56.071 56.071 52.829 3.242 25139 2327 1 4 . 1 1 154 154 ASP CB C 154 40.349 40.349 43.889 -3.541 25139 2328 1 4 . 1 1 154 154 ASP H H 154 7.930 7.930 7.790 0.140 25139 2329 1 4 . 1 1 155 155 HIS N N 155 117.821 117.821 120.056 -2.235 25139 2330 1 4 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.156 2.600 25139 2331 1 4 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.242 -0.062 25139 2332 1 4 . 1 1 155 155 HIS H H 155 7.680 7.680 8.416 -0.736 25139 2333 1 4 . 1 1 156 156 HIS N N 156 119.180 119.180 118.680 0.500 25139 2334 1 4 . 1 1 156 156 HIS CA C 156 57.931 57.931 55.696 2.235 25139 2335 1 4 . 1 1 156 156 HIS CB C 156 30.300 30.300 29.374 0.926 25139 2336 1 4 . 1 1 156 156 HIS H H 156 7.868 7.868 8.205 -0.337 25139 2337 1 5 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.849 1.055 25139 2338 1 5 . 1 1 48 48 ALA CB C 48 19.222 19.222 17.921 1.301 25139 2339 1 5 . 1 1 49 49 ASP N N 49 119.661 119.661 121.345 -1.684 25139 2340 1 5 . 1 1 49 49 ASP CA C 49 54.277 54.277 53.985 0.292 25139 2341 1 5 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.513 -0.451 25139 2342 1 5 . 1 1 49 49 ASP H H 49 8.462 8.462 7.782 0.680 25139 2343 1 5 . 1 1 51 51 LEU HA H 51 4.052 4.052 3.930 0.122 25139 2344 1 5 . 1 1 51 51 LEU C C 51 178.514 178.514 178.430 0.084 25139 2345 1 5 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.880 1.169 25139 2346 1 5 . 1 1 51 51 LEU CB C 51 41.193 41.193 40.699 0.494 25139 2347 1 5 . 1 1 52 52 ASN N N 52 113.819 113.819 120.194 -6.375 25139 2348 1 5 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.518 0.317 25139 2349 1 5 . 1 1 52 52 ASN C C 52 175.964 175.964 176.555 -0.591 25139 2350 1 5 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.408 -1.312 25139 2351 1 5 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.704 0.179 25139 2352 1 5 . 1 1 52 52 ASN H H 52 7.853 7.853 8.298 -0.445 25139 2353 1 5 . 1 1 53 53 SER N N 53 114.357 114.357 114.482 -0.125 25139 2354 1 5 . 1 1 53 53 SER CA C 53 59.908 59.908 59.679 0.229 25139 2355 1 5 . 1 1 53 53 SER CB C 53 64.395 64.395 63.581 0.814 25139 2356 1 5 . 1 1 53 53 SER H H 53 8.023 8.023 8.548 -0.525 25139 2357 1 5 . 1 1 54 54 PHE N N 54 121.037 121.037 119.469 1.568 25139 2358 1 5 . 1 1 54 54 PHE C C 54 175.522 175.522 175.786 -0.264 25139 2359 1 5 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.943 1.121 25139 2360 1 5 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.061 -0.008 25139 2361 1 5 . 1 1 54 54 PHE H H 54 7.731 7.731 7.791 -0.060 25139 2362 1 5 . 1 1 55 55 THR N N 55 116.535 116.535 118.875 -2.340 25139 2363 1 5 . 1 1 55 55 THR HA H 55 4.654 4.654 4.694 -0.040 25139 2364 1 5 . 1 1 55 55 THR C C 55 173.301 173.301 173.188 0.113 25139 2365 1 5 . 1 1 55 55 THR CA C 55 61.420 61.420 61.257 0.163 25139 2366 1 5 . 1 1 55 55 THR CB C 55 71.388 71.388 71.005 0.383 25139 2367 1 5 . 1 1 55 55 THR H H 55 8.929 8.929 9.298 -0.369 25139 2368 1 5 . 1 1 56 56 ALA N N 56 129.359 129.359 128.978 0.381 25139 2369 1 5 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.096 0.219 25139 2370 1 5 . 1 1 56 56 ALA C C 56 178.305 178.305 177.332 0.973 25139 2371 1 5 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.071 0.800 25139 2372 1 5 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.246 0.078 25139 2373 1 5 . 1 1 56 56 ALA H H 56 8.907 8.907 8.647 0.260 25139 2374 1 5 . 1 1 57 57 GLY N N 57 106.331 106.331 109.759 -3.428 25139 2375 1 5 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.524 1.087 25139 2376 1 5 . 1 1 57 57 GLY H H 57 7.978 7.978 8.216 -0.238 25139 2377 1 5 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.281 0.043 25139 2378 1 5 . 1 1 59 59 PRO C C 59 177.466 177.466 177.774 -0.308 25139 2379 1 5 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.230 1.254 25139 2380 1 5 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.037 -0.302 25139 2381 1 5 . 1 1 60 60 GLY N N 60 109.688 109.688 108.993 0.695 25139 2382 1 5 . 1 1 60 60 GLY C C 60 173.555 173.555 173.228 0.327 25139 2383 1 5 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.066 0.475 25139 2384 1 5 . 1 1 60 60 GLY H H 60 8.402 8.402 8.540 -0.138 25139 2385 1 5 . 1 1 61 61 PHE N N 61 122.491 122.491 121.478 1.013 25139 2386 1 5 . 1 1 61 61 PHE C C 61 175.146 175.146 174.825 0.321 25139 2387 1 5 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.842 1.440 25139 2388 1 5 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.453 -1.754 25139 2389 1 5 . 1 1 61 61 PHE H H 61 7.957 7.957 7.328 0.629 25139 2390 1 5 . 1 1 62 62 VAL N N 62 121.128 121.128 116.766 4.362 25139 2391 1 5 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.411 -0.326 25139 2392 1 5 . 1 1 62 62 VAL C C 62 174.937 174.937 174.571 0.366 25139 2393 1 5 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.918 0.790 25139 2394 1 5 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.997 0.435 25139 2395 1 5 . 1 1 62 62 VAL H H 62 7.994 7.994 8.990 -0.996 25139 2396 1 5 . 1 1 63 63 LEU N N 63 124.386 124.386 122.581 1.805 25139 2397 1 5 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.517 -1.201 25139 2398 1 5 . 1 1 63 63 LEU C C 63 175.278 175.278 176.416 -1.138 25139 2399 1 5 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.555 0.733 25139 2400 1 5 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.572 1.546 25139 2401 1 5 . 1 1 63 63 LEU H H 63 7.572 7.572 8.489 -0.917 25139 2402 1 5 . 1 1 64 64 ASP N N 64 126.746 126.746 129.152 -2.406 25139 2403 1 5 . 1 1 64 64 ASP C C 64 177.801 177.801 176.486 1.315 25139 2404 1 5 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.418 -2.697 25139 2405 1 5 . 1 1 64 64 ASP CB C 64 40.398 40.398 39.953 0.445 25139 2406 1 5 . 1 1 64 64 ASP H H 64 8.552 8.552 8.513 0.039 25139 2407 1 5 . 1 1 65 65 THR C C 65 175.002 175.002 175.619 -0.617 25139 2408 1 5 . 1 1 65 65 THR CB C 65 67.919 67.919 68.513 -0.594 25139 2409 1 5 . 1 1 66 66 GLN N N 66 120.804 120.804 118.716 2.088 25139 2410 1 5 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.222 -0.345 25139 2411 1 5 . 1 1 66 66 GLN C C 66 178.901 178.901 175.996 2.905 25139 2412 1 5 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.824 1.592 25139 2413 1 5 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.819 0.105 25139 2414 1 5 . 1 1 66 66 GLN H H 66 8.447 8.447 8.363 0.084 25139 2415 1 5 . 1 1 67 67 ALA N N 67 121.267 121.267 121.272 -0.005 25139 2416 1 5 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.350 -0.393 25139 2417 1 5 . 1 1 67 67 ALA C C 67 176.777 176.777 178.625 -1.848 25139 2418 1 5 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.595 0.729 25139 2419 1 5 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.528 -0.908 25139 2420 1 5 . 1 1 67 67 ALA H H 67 7.791 7.791 7.466 0.325 25139 2421 1 5 . 1 1 68 68 SER N N 68 113.339 113.339 113.919 -0.580 25139 2422 1 5 . 1 1 68 68 SER HA H 68 4.061 4.061 4.166 -0.105 25139 2423 1 5 . 1 1 68 68 SER C C 68 175.875 175.875 176.350 -0.475 25139 2424 1 5 . 1 1 68 68 SER CA C 68 62.970 62.970 61.673 1.297 25139 2425 1 5 . 1 1 68 68 SER CB C 68 61.330 61.330 63.729 -2.399 25139 2426 1 5 . 1 1 68 68 SER H H 68 7.785 7.785 7.721 0.064 25139 2427 1 5 . 1 1 69 69 VAL N N 69 125.140 125.140 117.168 7.972 25139 2428 1 5 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.183 -0.107 25139 2429 1 5 . 1 1 69 69 VAL C C 69 176.384 176.384 176.507 -0.123 25139 2430 1 5 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.893 0.838 25139 2431 1 5 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.376 0.113 25139 2432 1 5 . 1 1 69 69 VAL H H 69 8.572 8.572 8.058 0.514 25139 2433 1 5 . 1 1 70 70 SER N N 70 116.704 116.704 113.376 3.328 25139 2434 1 5 . 1 1 70 70 SER HA H 70 4.229 4.229 4.259 -0.030 25139 2435 1 5 . 1 1 70 70 SER C C 70 174.101 174.101 175.072 -0.971 25139 2436 1 5 . 1 1 70 70 SER CA C 70 61.627 61.627 59.717 1.910 25139 2437 1 5 . 1 1 70 70 SER H H 70 7.951 7.951 7.854 0.097 25139 2438 1 5 . 1 1 71 71 ASN N N 71 117.576 117.576 117.202 0.374 25139 2439 1 5 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.704 0.098 25139 2440 1 5 . 1 1 71 71 ASN C C 71 174.332 174.332 174.876 -0.544 25139 2441 1 5 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.821 -0.382 25139 2442 1 5 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.143 0.324 25139 2443 1 5 . 1 1 71 71 ASN H H 71 7.131 7.131 7.468 -0.337 25139 2444 1 5 . 1 1 72 72 GLY N N 72 103.925 103.925 105.414 -1.489 25139 2445 1 5 . 1 1 72 72 GLY C C 72 174.710 174.710 173.377 1.333 25139 2446 1 5 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.474 0.075 25139 2447 1 5 . 1 1 72 72 GLY H H 72 7.338 7.338 7.386 -0.048 25139 2448 1 5 . 1 1 73 73 ALA N N 73 124.942 124.942 123.139 1.803 25139 2449 1 5 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.540 -0.368 25139 2450 1 5 . 1 1 73 73 ALA C C 73 175.896 175.896 176.248 -0.352 25139 2451 1 5 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.750 0.923 25139 2452 1 5 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.118 -0.062 25139 2453 1 5 . 1 1 73 73 ALA H H 73 8.032 8.032 7.681 0.351 25139 2454 1 5 . 1 1 74 74 THR N N 74 113.423 113.423 116.484 -3.061 25139 2455 1 5 . 1 1 74 74 THR HA H 74 4.678 4.678 4.551 0.127 25139 2456 1 5 . 1 1 74 74 THR C C 74 173.339 173.339 173.300 0.039 25139 2457 1 5 . 1 1 74 74 THR CA C 74 61.545 61.545 60.523 1.022 25139 2458 1 5 . 1 1 74 74 THR CB C 74 71.319 71.319 71.437 -0.118 25139 2459 1 5 . 1 1 74 74 THR H H 74 8.530 8.530 8.231 0.299 25139 2460 1 5 . 1 1 75 75 PHE N N 75 128.180 128.180 130.175 -1.995 25139 2461 1 5 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.923 -0.319 25139 2462 1 5 . 1 1 75 75 PHE C C 75 174.623 174.623 175.145 -0.522 25139 2463 1 5 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.720 1.896 25139 2464 1 5 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.558 1.117 25139 2465 1 5 . 1 1 75 75 PHE H H 75 9.146 9.146 9.141 0.005 25139 2466 1 5 . 1 1 76 76 LEU N N 76 127.849 127.849 124.971 2.878 25139 2467 1 5 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.515 -0.164 25139 2468 1 5 . 1 1 76 76 LEU C C 76 176.339 176.339 176.814 -0.475 25139 2469 1 5 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.906 0.077 25139 2470 1 5 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.266 0.065 25139 2471 1 5 . 1 1 76 76 LEU H H 76 8.635 8.635 8.113 0.522 25139 2472 1 5 . 1 1 77 77 GLU N N 77 115.131 115.131 119.991 -4.860 25139 2473 1 5 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.609 -0.201 25139 2474 1 5 . 1 1 77 77 GLU C C 77 174.734 174.734 174.598 0.136 25139 2475 1 5 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.546 0.807 25139 2476 1 5 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.077 0.130 25139 2477 1 5 . 1 1 77 77 GLU H H 77 7.252 7.252 7.806 -0.554 25139 2478 1 5 . 1 1 78 78 SER N N 78 118.016 118.016 118.504 -0.488 25139 2479 1 5 . 1 1 78 78 SER HA H 78 5.561 5.561 5.364 0.197 25139 2480 1 5 . 1 1 78 78 SER C C 78 171.968 171.968 172.655 -0.687 25139 2481 1 5 . 1 1 78 78 SER CA C 78 54.061 54.061 55.489 -1.428 25139 2482 1 5 . 1 1 78 78 SER CB C 78 64.074 64.074 63.178 0.896 25139 2483 1 5 . 1 1 78 78 SER H H 78 9.033 9.033 8.644 0.389 25139 2484 1 5 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.711 -0.111 25139 2485 1 5 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.733 -0.323 25139 2486 1 5 . 1 1 80 80 THR N N 80 118.079 118.079 115.053 3.026 25139 2487 1 5 . 1 1 80 80 THR HA H 80 4.342 4.342 4.350 -0.008 25139 2488 1 5 . 1 1 80 80 THR C C 80 174.494 174.494 174.234 0.260 25139 2489 1 5 . 1 1 80 80 THR CA C 80 61.453 61.453 60.576 0.877 25139 2490 1 5 . 1 1 80 80 THR CB C 80 67.797 67.797 68.165 -0.368 25139 2491 1 5 . 1 1 80 80 THR H H 80 8.670 8.670 8.283 0.387 25139 2492 1 5 . 1 1 81 81 VAL N N 81 117.395 117.395 117.923 -0.528 25139 2493 1 5 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.925 0.682 25139 2494 1 5 . 1 1 81 81 VAL C C 81 175.518 175.518 175.360 0.158 25139 2495 1 5 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.969 -2.856 25139 2496 1 5 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.275 2.320 25139 2497 1 5 . 1 1 81 81 VAL H H 81 7.448 7.448 7.450 -0.002 25139 2498 1 5 . 1 1 82 82 ARG N N 82 117.852 117.852 119.756 -1.904 25139 2499 1 5 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.578 -0.057 25139 2500 1 5 . 1 1 82 82 ARG C C 82 176.992 176.992 176.205 0.787 25139 2501 1 5 . 1 1 82 82 ARG CA C 82 56.385 56.385 56.340 0.045 25139 2502 1 5 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.809 0.793 25139 2503 1 5 . 1 1 82 82 ARG H H 82 8.710 8.710 8.689 0.021 25139 2504 1 5 . 1 1 83 83 ARG N N 83 117.035 117.035 117.244 -0.209 25139 2505 1 5 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.601 0.721 25139 2506 1 5 . 1 1 83 83 ARG C C 83 177.379 177.379 176.703 0.676 25139 2507 1 5 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.532 -0.848 25139 2508 1 5 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.304 -0.263 25139 2509 1 5 . 1 1 83 83 ARG H H 83 7.292 7.292 7.704 -0.412 25139 2510 1 5 . 1 1 84 84 GLY N N 84 114.911 114.911 110.395 4.516 25139 2511 1 5 . 1 1 84 84 GLY C C 84 176.940 176.940 175.175 1.765 25139 2512 1 5 . 1 1 84 84 GLY CA C 84 48.672 48.672 47.008 1.664 25139 2513 1 5 . 1 1 84 84 GLY H H 84 9.255 9.255 9.031 0.224 25139 2514 1 5 . 1 1 85 85 TRP N N 85 121.810 121.810 120.819 0.991 25139 2515 1 5 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.244 -0.077 25139 2516 1 5 . 1 1 85 85 TRP C C 85 178.272 178.272 177.210 1.062 25139 2517 1 5 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.669 1.376 25139 2518 1 5 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.161 0.056 25139 2519 1 5 . 1 1 85 85 TRP H H 85 9.963 9.963 7.750 2.213 25139 2520 1 5 . 1 1 86 86 ASP N N 86 116.400 116.400 120.169 -3.769 25139 2521 1 5 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.454 -0.061 25139 2522 1 5 . 1 1 86 86 ASP C C 86 178.803 178.803 178.110 0.693 25139 2523 1 5 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.924 0.130 25139 2524 1 5 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.248 0.485 25139 2525 1 5 . 1 1 86 86 ASP H H 86 6.934 6.934 7.634 -0.700 25139 2526 1 5 . 1 1 87 87 CYS N N 87 122.454 122.454 119.459 2.995 25139 2527 1 5 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.220 0.030 25139 2528 1 5 . 1 1 87 87 CYS C C 87 174.956 174.956 176.562 -1.606 25139 2529 1 5 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.974 -3.827 25139 2530 1 5 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.181 11.304 25139 2531 1 5 . 1 1 87 87 CYS H H 87 7.603 7.603 7.446 0.157 25139 2532 1 5 . 1 1 88 88 VAL N N 88 119.192 119.192 120.355 -1.163 25139 2533 1 5 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.216 -0.758 25139 2534 1 5 . 1 1 88 88 VAL C C 88 177.413 177.413 177.969 -0.556 25139 2535 1 5 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.642 1.334 25139 2536 1 5 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.580 -0.338 25139 2537 1 5 . 1 1 88 88 VAL H H 88 7.192 7.192 7.438 -0.246 25139 2538 1 5 . 1 1 89 89 ARG N N 89 118.185 118.185 118.721 -0.536 25139 2539 1 5 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.985 -0.305 25139 2540 1 5 . 1 1 89 89 ARG C C 89 178.677 178.677 177.781 0.896 25139 2541 1 5 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.041 0.914 25139 2542 1 5 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.360 0.431 25139 2543 1 5 . 1 1 89 89 ARG H H 89 7.971 7.971 8.169 -0.198 25139 2544 1 5 . 1 1 90 90 ALA N N 90 120.815 120.815 122.030 -1.215 25139 2545 1 5 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.153 -0.078 25139 2546 1 5 . 1 1 90 90 ALA C C 90 177.416 177.416 179.346 -1.930 25139 2547 1 5 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.508 -0.254 25139 2548 1 5 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.375 -0.939 25139 2549 1 5 . 1 1 90 90 ALA H H 90 7.453 7.453 7.383 0.070 25139 2550 1 5 . 1 1 91 91 CYS N N 91 120.380 120.380 116.178 4.202 25139 2551 1 5 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.264 0.107 25139 2552 1 5 . 1 1 91 91 CYS C C 91 176.654 176.654 175.817 0.837 25139 2553 1 5 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.505 -3.810 25139 2554 1 5 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.104 12.600 25139 2555 1 5 . 1 1 91 91 CYS H H 91 7.944 7.944 7.577 0.367 25139 2556 1 5 . 1 1 92 92 CYS N N 92 116.270 116.270 117.496 -1.226 25139 2557 1 5 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.503 -0.099 25139 2558 1 5 . 1 1 92 92 CYS C C 92 175.628 175.628 176.381 -0.753 25139 2559 1 5 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.378 -1.672 25139 2560 1 5 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.816 15.333 25139 2561 1 5 . 1 1 92 92 CYS H H 92 8.315 8.315 7.713 0.602 25139 2562 1 5 . 1 1 93 93 THR N N 93 107.283 107.283 111.544 -4.261 25139 2563 1 5 . 1 1 93 93 THR HA H 93 4.481 4.481 4.359 0.122 25139 2564 1 5 . 1 1 93 93 THR C C 93 173.606 173.606 175.361 -1.755 25139 2565 1 5 . 1 1 93 93 THR CA C 93 61.402 61.402 62.834 -1.431 25139 2566 1 5 . 1 1 93 93 THR CB C 93 69.046 69.046 70.172 -1.126 25139 2567 1 5 . 1 1 93 93 THR H H 93 7.445 7.445 7.726 -0.281 25139 2568 1 5 . 1 1 94 94 THR N N 94 121.432 121.432 121.000 0.432 25139 2569 1 5 . 1 1 94 94 THR HA H 94 4.398 4.398 4.436 -0.038 25139 2570 1 5 . 1 1 94 94 THR C C 94 173.493 173.493 174.864 -1.371 25139 2571 1 5 . 1 1 94 94 THR CA C 94 62.726 62.726 63.142 -0.416 25139 2572 1 5 . 1 1 94 94 THR CB C 94 69.704 69.704 69.405 0.299 25139 2573 1 5 . 1 1 94 94 THR H H 94 7.553 7.553 7.970 -0.417 25139 2574 1 5 . 1 1 95 95 GLN N N 95 129.410 129.410 128.289 1.121 25139 2575 1 5 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.045 -0.101 25139 2576 1 5 . 1 1 95 95 GLN C C 95 176.293 176.293 176.362 -0.069 25139 2577 1 5 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.672 -0.632 25139 2578 1 5 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.875 -0.619 25139 2579 1 5 . 1 1 95 95 GLN H H 95 8.812 8.812 9.078 -0.266 25139 2580 1 5 . 1 1 96 96 ASN N N 96 115.015 115.015 114.767 0.248 25139 2581 1 5 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.861 -0.662 25139 2582 1 5 . 1 1 96 96 ASN C C 96 172.260 172.260 173.676 -1.416 25139 2583 1 5 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.973 2.594 25139 2584 1 5 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.916 -2.079 25139 2585 1 5 . 1 1 96 96 ASN H H 96 8.791 8.791 8.186 0.605 25139 2586 1 5 . 1 1 97 97 CYS N N 97 115.830 115.830 120.597 -4.767 25139 2587 1 5 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.441 -0.340 25139 2588 1 5 . 1 1 97 97 CYS C C 97 175.025 175.025 174.264 0.761 25139 2589 1 5 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.962 -1.815 25139 2590 1 5 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.553 16.680 25139 2591 1 5 . 1 1 97 97 CYS H H 97 7.651 7.651 7.623 0.028 25139 2592 1 5 . 1 1 98 98 ASN N N 98 125.148 125.148 125.623 -0.475 25139 2593 1 5 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.964 0.169 25139 2594 1 5 . 1 1 98 98 ASN C C 98 171.892 171.892 174.306 -2.414 25139 2595 1 5 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.464 -0.270 25139 2596 1 5 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.377 -1.429 25139 2597 1 5 . 1 1 98 98 ASN H H 98 8.736 8.736 8.346 0.390 25139 2598 1 5 . 1 1 99 99 LEU N N 99 120.898 120.898 120.059 0.839 25139 2599 1 5 . 1 1 99 99 LEU C C 99 173.084 173.084 173.917 -0.833 25139 2600 1 5 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.597 2.523 25139 2601 1 5 . 1 1 99 99 LEU CB C 99 44.328 44.328 46.113 -1.785 25139 2602 1 5 . 1 1 99 99 LEU H H 99 8.200 8.200 8.017 0.183 25139 2603 1 5 . 1 1 100 100 ALA N N 100 128.085 128.085 128.549 -0.464 25139 2604 1 5 . 1 1 100 100 ALA C C 100 174.938 174.938 175.292 -0.354 25139 2605 1 5 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.378 -0.631 25139 2606 1 5 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.877 -0.162 25139 2607 1 5 . 1 1 100 100 ALA H H 100 9.156 9.156 9.287 -0.131 25139 2608 1 5 . 1 1 101 101 LEU N N 101 128.723 128.723 128.269 0.454 25139 2609 1 5 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.373 -0.231 25139 2610 1 5 . 1 1 101 101 LEU C C 101 174.379 174.379 175.154 -0.775 25139 2611 1 5 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.135 -0.282 25139 2612 1 5 . 1 1 101 101 LEU CB C 101 45.307 45.307 45.274 0.033 25139 2613 1 5 . 1 1 101 101 LEU H H 101 9.578 9.578 9.154 0.424 25139 2614 1 5 . 1 1 102 102 VAL N N 102 119.417 119.417 120.165 -0.748 25139 2615 1 5 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.190 0.338 25139 2616 1 5 . 1 1 102 102 VAL C C 102 173.660 173.660 173.901 -0.241 25139 2617 1 5 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.069 -0.449 25139 2618 1 5 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.075 -1.802 25139 2619 1 5 . 1 1 102 102 VAL H H 102 9.297 9.297 9.367 -0.070 25139 2620 1 5 . 1 1 103 103 GLU N N 103 124.427 124.427 123.703 0.724 25139 2621 1 5 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.206 -0.341 25139 2622 1 5 . 1 1 103 103 GLU C C 103 176.319 176.319 175.243 1.076 25139 2623 1 5 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.381 -0.280 25139 2624 1 5 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.941 0.261 25139 2625 1 5 . 1 1 103 103 GLU H H 103 7.749 7.749 8.207 -0.458 25139 2626 1 5 . 1 1 104 104 LEU N N 104 127.294 127.294 125.624 1.670 25139 2627 1 5 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.445 -0.125 25139 2628 1 5 . 1 1 104 104 LEU C C 104 176.593 176.593 177.522 -0.929 25139 2629 1 5 . 1 1 104 104 LEU CA C 104 56.084 56.084 52.767 3.317 25139 2630 1 5 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.856 -0.466 25139 2631 1 5 . 1 1 104 104 LEU H H 104 8.323 8.323 8.251 0.072 25139 2632 1 5 . 1 1 105 105 GLN N N 105 121.361 121.361 118.341 3.020 25139 2633 1 5 . 1 1 105 105 GLN C C 105 172.868 172.868 174.725 -1.857 25139 2634 1 5 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.403 -2.997 25139 2635 1 5 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.951 1.778 25139 2636 1 5 . 1 1 105 105 GLN H H 105 8.095 8.095 8.166 -0.071 25139 2637 1 5 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.484 -0.075 25139 2638 1 5 . 1 1 106 106 PRO C C 106 177.770 177.770 176.766 1.004 25139 2639 1 5 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.562 -0.077 25139 2640 1 5 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.121 -0.353 25139 2641 1 5 . 1 1 107 107 ASP N N 107 116.484 116.484 116.004 0.480 25139 2642 1 5 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.558 -0.118 25139 2643 1 5 . 1 1 107 107 ASP C C 107 176.749 176.749 175.963 0.786 25139 2644 1 5 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.391 0.064 25139 2645 1 5 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.068 -1.180 25139 2646 1 5 . 1 1 107 107 ASP H H 107 8.638 8.638 8.466 0.172 25139 2647 1 5 . 1 1 108 108 ARG N N 108 117.895 117.895 120.326 -2.431 25139 2648 1 5 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.555 -0.065 25139 2649 1 5 . 1 1 108 108 ARG C C 108 176.111 176.111 176.663 -0.552 25139 2650 1 5 . 1 1 108 108 ARG CA C 108 55.265 55.265 54.944 0.321 25139 2651 1 5 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.807 0.269 25139 2652 1 5 . 1 1 108 108 ARG H H 108 7.905 7.905 8.244 -0.339 25139 2653 1 5 . 1 1 109 109 GLY N N 109 108.307 108.307 109.080 -0.773 25139 2654 1 5 . 1 1 109 109 GLY C C 109 173.949 173.949 174.753 -0.804 25139 2655 1 5 . 1 1 109 109 GLY CA C 109 44.551 44.551 46.387 -1.836 25139 2656 1 5 . 1 1 109 109 GLY H H 109 7.753 7.753 8.369 -0.616 25139 2657 1 5 . 1 1 110 110 GLU N N 110 120.035 120.035 122.912 -2.877 25139 2658 1 5 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.590 -0.499 25139 2659 1 5 . 1 1 110 110 GLU C C 110 177.045 177.045 177.031 0.014 25139 2660 1 5 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.101 2.181 25139 2661 1 5 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.357 -1.684 25139 2662 1 5 . 1 1 110 110 GLU H H 110 8.509 8.509 8.004 0.505 25139 2663 1 5 . 1 1 111 111 ASP N N 111 121.160 121.160 121.827 -0.667 25139 2664 1 5 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.521 0.049 25139 2665 1 5 . 1 1 111 111 ASP C C 111 175.089 175.089 175.531 -0.442 25139 2666 1 5 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.494 -1.903 25139 2667 1 5 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.494 0.938 25139 2668 1 5 . 1 1 111 111 ASP H H 111 8.916 8.916 8.250 0.666 25139 2669 1 5 . 1 1 112 112 ALA N N 112 122.130 122.130 118.572 3.558 25139 2670 1 5 . 1 1 112 112 ALA C C 112 178.120 178.120 175.558 2.562 25139 2671 1 5 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.327 2.932 25139 2672 1 5 . 1 1 112 112 ALA CB C 112 19.770 19.770 22.166 -2.396 25139 2673 1 5 . 1 1 112 112 ALA H H 112 7.361 7.361 7.354 0.007 25139 2674 1 5 . 1 1 113 113 ILE N N 113 113.780 113.780 113.713 0.067 25139 2675 1 5 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.775 0.111 25139 2676 1 5 . 1 1 113 113 ILE C C 113 174.258 174.258 174.767 -0.509 25139 2677 1 5 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.230 0.282 25139 2678 1 5 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.733 0.115 25139 2679 1 5 . 1 1 113 113 ILE H H 113 7.667 7.667 8.508 -0.841 25139 2680 1 5 . 1 1 114 114 ALA N N 114 122.673 122.673 125.720 -3.047 25139 2681 1 5 . 1 1 114 114 ALA C C 114 176.984 176.984 176.756 0.228 25139 2682 1 5 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.124 -1.560 25139 2683 1 5 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.553 1.029 25139 2684 1 5 . 1 1 114 114 ALA H H 114 8.904 8.904 8.777 0.127 25139 2685 1 5 . 1 1 115 115 ALA N N 115 116.486 116.486 116.582 -0.096 25139 2686 1 5 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.454 -0.099 25139 2687 1 5 . 1 1 115 115 ALA C C 115 174.138 174.138 174.197 -0.059 25139 2688 1 5 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.756 1.564 25139 2689 1 5 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.484 1.499 25139 2690 1 5 . 1 1 115 115 ALA H H 115 7.182 7.182 7.221 -0.039 25139 2691 1 5 . 1 1 116 116 CYS N N 116 120.099 120.099 119.361 0.738 25139 2692 1 5 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.214 0.117 25139 2693 1 5 . 1 1 116 116 CYS C C 116 176.609 176.609 172.420 4.189 25139 2694 1 5 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.250 -2.301 25139 2695 1 5 . 1 1 116 116 CYS CB C 116 40.384 40.384 29.026 11.358 25139 2696 1 5 . 1 1 116 116 CYS H H 116 8.298 8.298 7.777 0.521 25139 2697 1 5 . 1 1 117 117 PHE N N 117 126.406 126.406 124.602 1.804 25139 2698 1 5 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.207 -0.009 25139 2699 1 5 . 1 1 117 117 PHE C C 117 173.385 173.385 173.862 -0.477 25139 2700 1 5 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.101 0.153 25139 2701 1 5 . 1 1 117 117 PHE CB C 117 41.681 41.681 42.383 -0.702 25139 2702 1 5 . 1 1 117 117 PHE H H 117 9.712 9.712 9.055 0.657 25139 2703 1 5 . 1 1 118 118 LEU N N 118 122.119 122.119 122.787 -0.668 25139 2704 1 5 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.531 -0.365 25139 2705 1 5 . 1 1 118 118 LEU C C 118 175.097 175.097 176.219 -1.122 25139 2706 1 5 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.263 -0.359 25139 2707 1 5 . 1 1 118 118 LEU CB C 118 42.298 42.298 44.520 -2.222 25139 2708 1 5 . 1 1 118 118 LEU H H 118 8.719 8.719 9.582 -0.863 25139 2709 1 5 . 1 1 119 119 ILE N N 119 125.324 125.324 122.423 2.901 25139 2710 1 5 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.832 0.045 25139 2711 1 5 . 1 1 119 119 ILE C C 119 173.825 173.825 175.393 -1.568 25139 2712 1 5 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.795 -0.688 25139 2713 1 5 . 1 1 119 119 ILE CB C 119 41.510 41.510 41.719 -0.209 25139 2714 1 5 . 1 1 119 119 ILE H H 119 8.986 8.986 9.015 -0.029 25139 2715 1 5 . 1 1 120 120 ASN N N 120 121.534 121.534 124.903 -3.369 25139 2716 1 5 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.771 0.619 25139 2717 1 5 . 1 1 120 120 ASN C C 120 176.098 176.098 175.722 0.376 25139 2718 1 5 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.423 -3.966 25139 2719 1 5 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.043 0.875 25139 2720 1 5 . 1 1 120 120 ASN H H 120 8.694 8.694 9.052 -0.358 25139 2721 1 5 . 1 1 121 121 CYS N N 121 122.779 122.779 115.413 7.366 25139 2722 1 5 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.080 0.403 25139 2723 1 5 . 1 1 121 121 CYS C C 121 173.195 173.195 173.031 0.164 25139 2724 1 5 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.679 -3.915 25139 2725 1 5 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.820 15.887 25139 2726 1 5 . 1 1 121 121 CYS H H 121 10.668 10.668 8.398 2.270 25139 2727 1 5 . 1 1 122 122 LEU N N 122 121.063 121.063 116.082 4.981 25139 2728 1 5 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.599 -0.234 25139 2729 1 5 . 1 1 122 122 LEU C C 122 176.743 176.743 175.474 1.269 25139 2730 1 5 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.882 0.782 25139 2731 1 5 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.605 -1.371 25139 2732 1 5 . 1 1 122 122 LEU H H 122 8.256 8.256 7.350 0.906 25139 2733 1 5 . 1 1 123 123 TYR N N 123 123.081 123.081 123.015 0.066 25139 2734 1 5 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.741 -0.698 25139 2735 1 5 . 1 1 123 123 TYR C C 123 173.633 173.633 174.702 -1.069 25139 2736 1 5 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.166 -0.278 25139 2737 1 5 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.541 -0.460 25139 2738 1 5 . 1 1 123 123 TYR H H 123 8.990 8.990 8.952 0.038 25139 2739 1 5 . 1 1 124 124 GLU N N 124 128.742 128.742 125.484 3.258 25139 2740 1 5 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.683 -0.133 25139 2741 1 5 . 1 1 124 124 GLU C C 124 174.835 174.835 175.375 -0.540 25139 2742 1 5 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.435 0.197 25139 2743 1 5 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.427 -0.532 25139 2744 1 5 . 1 1 124 124 GLU H H 124 9.135 9.135 8.573 0.562 25139 2745 1 5 . 1 1 125 125 GLN N N 125 108.066 108.066 111.018 -2.952 25139 2746 1 5 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.998 -0.277 25139 2747 1 5 . 1 1 125 125 GLN C C 125 174.627 174.627 174.762 -0.135 25139 2748 1 5 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.045 0.994 25139 2749 1 5 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.368 -0.040 25139 2750 1 5 . 1 1 125 125 GLN H H 125 8.390 8.390 8.441 -0.051 25139 2751 1 5 . 1 1 126 126 ASN N N 126 118.528 118.528 117.800 0.728 25139 2752 1 5 . 1 1 126 126 ASN C C 126 173.713 173.713 174.782 -1.069 25139 2753 1 5 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.268 -0.079 25139 2754 1 5 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.980 0.821 25139 2755 1 5 . 1 1 126 126 ASN H H 126 8.092 8.092 7.960 0.132 25139 2756 1 5 . 1 1 127 127 PHE N N 127 124.680 124.680 121.913 2.767 25139 2757 1 5 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.809 0.228 25139 2758 1 5 . 1 1 127 127 PHE C C 127 177.125 177.125 176.453 0.672 25139 2759 1 5 . 1 1 127 127 PHE CA C 127 58.413 58.413 58.113 0.300 25139 2760 1 5 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.538 0.706 25139 2761 1 5 . 1 1 127 127 PHE H H 127 9.026 9.026 8.880 0.146 25139 2762 1 5 . 1 1 128 128 VAL N N 128 119.455 119.455 120.640 -1.185 25139 2763 1 5 . 1 1 128 128 VAL C C 128 175.886 175.886 175.409 0.477 25139 2764 1 5 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.213 -0.294 25139 2765 1 5 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.825 1.369 25139 2766 1 5 . 1 1 128 128 VAL H H 128 8.364 8.364 7.693 0.671 25139 2767 1 5 . 1 1 129 129 CYS N N 129 116.130 116.130 120.112 -3.982 25139 2768 1 5 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.884 -0.407 25139 2769 1 5 . 1 1 129 129 CYS C C 129 170.569 170.569 174.692 -4.123 25139 2770 1 5 . 1 1 129 129 CYS CA C 129 56.150 56.150 60.369 -4.219 25139 2771 1 5 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.735 17.882 25139 2772 1 5 . 1 1 129 129 CYS H H 129 5.390 5.390 7.395 -2.005 25139 2773 1 5 . 1 1 130 130 LYS N N 130 120.071 120.071 121.664 -1.593 25139 2774 1 5 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.508 0.053 25139 2775 1 5 . 1 1 130 130 LYS C C 130 176.853 176.853 174.468 2.385 25139 2776 1 5 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.747 0.140 25139 2777 1 5 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.489 1.153 25139 2778 1 5 . 1 1 130 130 LYS H H 130 8.066 8.066 8.564 -0.498 25139 2779 1 5 . 1 1 131 131 PHE N N 131 118.415 118.415 119.806 -1.391 25139 2780 1 5 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.478 -0.871 25139 2781 1 5 . 1 1 131 131 PHE C C 131 174.013 174.013 175.112 -1.099 25139 2782 1 5 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.507 1.204 25139 2783 1 5 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.600 0.480 25139 2784 1 5 . 1 1 131 131 PHE H H 131 8.714 8.714 8.355 0.359 25139 2785 1 5 . 1 1 132 132 ALA N N 132 124.209 124.209 123.224 0.985 25139 2786 1 5 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.044 -0.427 25139 2787 1 5 . 1 1 132 132 ALA C C 132 174.352 174.352 174.324 0.028 25139 2788 1 5 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.511 1.930 25139 2789 1 5 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.951 -0.486 25139 2790 1 5 . 1 1 132 132 ALA H H 132 9.295 9.295 9.013 0.282 25139 2791 1 5 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.248 -0.365 25139 2792 1 5 . 1 1 133 133 PRO C C 133 173.923 173.923 176.373 -2.450 25139 2793 1 5 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.597 0.474 25139 2794 1 5 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.327 -0.724 25139 2795 1 5 . 1 1 134 134 ARG N N 134 126.071 126.071 122.230 3.841 25139 2796 1 5 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.669 -0.414 25139 2797 1 5 . 1 1 134 134 ARG C C 134 177.065 177.065 177.071 -0.006 25139 2798 1 5 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.457 1.707 25139 2799 1 5 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.590 -1.407 25139 2800 1 5 . 1 1 134 134 ARG H H 134 8.672 8.672 8.625 0.047 25139 2801 1 5 . 1 1 135 135 GLU N N 135 125.683 125.683 122.980 2.703 25139 2802 1 5 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.360 -0.007 25139 2803 1 5 . 1 1 135 135 GLU C C 135 178.081 178.081 177.125 0.956 25139 2804 1 5 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.285 0.367 25139 2805 1 5 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.113 -0.117 25139 2806 1 5 . 1 1 135 135 GLU H H 135 8.603 8.603 9.023 -0.420 25139 2807 1 5 . 1 1 136 136 GLY N N 136 110.031 110.031 106.446 3.585 25139 2808 1 5 . 1 1 136 136 GLY C C 136 173.079 173.079 172.367 0.712 25139 2809 1 5 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.992 0.786 25139 2810 1 5 . 1 1 136 136 GLY H H 136 9.036 9.036 8.265 0.771 25139 2811 1 5 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.576 0.099 25139 2812 1 5 . 1 1 137 137 PHE C C 137 174.936 174.936 174.007 0.929 25139 2813 1 5 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.221 -0.137 25139 2814 1 5 . 1 1 137 137 PHE CB C 137 44.696 44.696 43.176 1.520 25139 2815 1 5 . 1 1 138 138 ILE N N 138 117.417 117.417 114.772 2.645 25139 2816 1 5 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.674 -0.167 25139 2817 1 5 . 1 1 138 138 ILE C C 138 173.858 173.858 173.368 0.490 25139 2818 1 5 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.645 0.975 25139 2819 1 5 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.318 1.279 25139 2820 1 5 . 1 1 138 138 ILE H H 138 8.777 8.777 8.825 -0.048 25139 2821 1 5 . 1 1 139 139 ASN N N 139 117.201 117.201 116.626 0.575 25139 2822 1 5 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.516 0.543 25139 2823 1 5 . 1 1 139 139 ASN C C 139 173.721 173.721 173.921 -0.200 25139 2824 1 5 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.704 -1.474 25139 2825 1 5 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.512 1.349 25139 2826 1 5 . 1 1 139 139 ASN H H 139 8.872 8.872 8.367 0.505 25139 2827 1 5 . 1 1 140 140 TYR N N 140 123.991 123.991 118.952 5.039 25139 2828 1 5 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.845 0.333 25139 2829 1 5 . 1 1 140 140 TYR C C 140 174.791 174.791 175.088 -0.297 25139 2830 1 5 . 1 1 140 140 TYR CA C 140 57.072 57.072 57.947 -0.875 25139 2831 1 5 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.162 1.508 25139 2832 1 5 . 1 1 140 140 TYR H H 140 9.526 9.526 9.116 0.410 25139 2833 1 5 . 1 1 141 141 LEU N N 141 122.779 122.779 120.477 2.302 25139 2834 1 5 . 1 1 141 141 LEU C C 141 175.404 175.404 177.312 -1.908 25139 2835 1 5 . 1 1 141 141 LEU CA C 141 55.103 55.103 53.015 2.088 25139 2836 1 5 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.333 -1.172 25139 2837 1 5 . 1 1 141 141 LEU H H 141 9.010 9.010 9.105 -0.095 25139 2838 1 5 . 1 1 142 142 THR N N 142 113.189 113.189 111.694 1.495 25139 2839 1 5 . 1 1 142 142 THR HA H 142 4.061 4.061 4.594 -0.533 25139 2840 1 5 . 1 1 142 142 THR C C 142 175.940 175.940 176.357 -0.417 25139 2841 1 5 . 1 1 142 142 THR CA C 142 61.389 61.389 60.448 0.941 25139 2842 1 5 . 1 1 142 142 THR CB C 142 69.779 69.779 70.584 -0.805 25139 2843 1 5 . 1 1 142 142 THR H H 142 7.737 7.737 8.110 -0.373 25139 2844 1 5 . 1 1 143 143 ARG N N 143 120.975 120.975 119.976 0.999 25139 2845 1 5 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.966 -0.028 25139 2846 1 5 . 1 1 143 143 ARG C C 143 178.690 178.690 178.096 0.594 25139 2847 1 5 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.009 0.739 25139 2848 1 5 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.646 0.499 25139 2849 1 5 . 1 1 143 143 ARG H H 143 8.149 8.149 8.493 -0.344 25139 2850 1 5 . 1 1 144 144 GLU N N 144 116.997 116.997 117.274 -0.277 25139 2851 1 5 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.183 -0.074 25139 2852 1 5 . 1 1 144 144 GLU C C 144 178.442 178.442 177.942 0.500 25139 2853 1 5 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.962 0.900 25139 2854 1 5 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.575 0.007 25139 2855 1 5 . 1 1 144 144 GLU H H 144 8.622 8.622 7.740 0.882 25139 2856 1 5 . 1 1 145 145 VAL N N 145 111.213 111.213 114.591 -3.378 25139 2857 1 5 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.145 0.266 25139 2858 1 5 . 1 1 145 145 VAL C C 145 176.965 176.965 177.021 -0.056 25139 2859 1 5 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.886 -0.292 25139 2860 1 5 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.782 0.300 25139 2861 1 5 . 1 1 145 145 VAL H H 145 7.227 7.227 7.454 -0.227 25139 2862 1 5 . 1 1 146 146 TYR N N 146 123.512 123.512 122.539 0.973 25139 2863 1 5 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.052 -0.172 25139 2864 1 5 . 1 1 146 146 TYR C C 146 176.377 176.377 176.643 -0.266 25139 2865 1 5 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.600 -0.063 25139 2866 1 5 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.928 -0.589 25139 2867 1 5 . 1 1 146 146 TYR H H 146 8.492 8.492 8.755 -0.263 25139 2868 1 5 . 1 1 147 147 ARG N N 147 116.680 116.680 117.098 -0.418 25139 2869 1 5 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.917 -0.103 25139 2870 1 5 . 1 1 147 147 ARG C C 147 178.858 178.858 177.456 1.402 25139 2871 1 5 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.911 0.785 25139 2872 1 5 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.342 0.323 25139 2873 1 5 . 1 1 147 147 ARG H H 147 8.053 8.053 8.572 -0.519 25139 2874 1 5 . 1 1 148 148 SER N N 148 115.306 115.306 114.934 0.372 25139 2875 1 5 . 1 1 148 148 SER HA H 148 3.998 3.998 4.490 -0.492 25139 2876 1 5 . 1 1 148 148 SER C C 148 175.786 175.786 175.930 -0.144 25139 2877 1 5 . 1 1 148 148 SER CA C 148 62.006 62.006 59.847 2.159 25139 2878 1 5 . 1 1 148 148 SER H H 148 7.139 7.139 7.427 -0.288 25139 2879 1 5 . 1 1 149 149 TYR N N 149 123.207 123.207 123.604 -0.397 25139 2880 1 5 . 1 1 149 149 TYR C C 149 175.831 175.831 177.253 -1.422 25139 2881 1 5 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.473 -0.873 25139 2882 1 5 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.295 0.486 25139 2883 1 5 . 1 1 149 149 TYR H H 149 7.253 7.253 7.983 -0.730 25139 2884 1 5 . 1 1 150 150 ARG N N 150 118.708 118.708 116.239 2.469 25139 2885 1 5 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.936 -0.590 25139 2886 1 5 . 1 1 150 150 ARG C C 150 177.644 177.644 177.192 0.452 25139 2887 1 5 . 1 1 150 150 ARG CA C 150 57.323 57.323 56.479 0.844 25139 2888 1 5 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.206 -0.352 25139 2889 1 5 . 1 1 150 150 ARG H H 150 8.441 8.441 7.569 0.872 25139 2890 1 5 . 1 1 151 151 GLN N N 151 116.551 116.551 117.158 -0.607 25139 2891 1 5 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.267 -0.310 25139 2892 1 5 . 1 1 151 151 GLN C C 151 177.987 177.987 176.628 1.359 25139 2893 1 5 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.057 1.284 25139 2894 1 5 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.821 -0.357 25139 2895 1 5 . 1 1 151 151 GLN H H 151 7.332 7.332 7.344 -0.012 25139 2896 1 5 . 1 1 152 152 LEU N N 152 118.877 118.877 114.917 3.960 25139 2897 1 5 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.602 -0.423 25139 2898 1 5 . 1 1 152 152 LEU C C 152 179.070 179.070 176.918 2.152 25139 2899 1 5 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.451 1.631 25139 2900 1 5 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.538 -0.849 25139 2901 1 5 . 1 1 152 152 LEU H H 152 7.106 7.106 7.289 -0.183 25139 2902 1 5 . 1 1 153 153 VAL N N 153 119.076 119.076 113.689 5.387 25139 2903 1 5 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.863 -1.003 25139 2904 1 5 . 1 1 153 153 VAL C C 153 177.421 177.421 175.814 1.607 25139 2905 1 5 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.239 3.344 25139 2906 1 5 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.075 -1.557 25139 2907 1 5 . 1 1 153 153 VAL H H 153 7.427 7.427 7.271 0.156 25139 2908 1 5 . 1 1 154 154 ASP N N 154 119.888 119.888 121.311 -1.423 25139 2909 1 5 . 1 1 154 154 ASP C C 154 177.422 177.422 175.804 1.618 25139 2910 1 5 . 1 1 154 154 ASP CA C 154 56.071 56.071 53.558 2.513 25139 2911 1 5 . 1 1 154 154 ASP CB C 154 40.349 40.349 41.555 -1.206 25139 2912 1 5 . 1 1 154 154 ASP H H 154 7.930 7.930 7.635 0.295 25139 2913 1 5 . 1 1 155 155 HIS N N 155 117.821 117.821 116.757 1.064 25139 2914 1 5 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.287 2.469 25139 2915 1 5 . 1 1 155 155 HIS CB C 155 30.180 30.180 31.097 -0.917 25139 2916 1 5 . 1 1 155 155 HIS H H 155 7.680 7.680 8.291 -0.611 25139 2917 1 5 . 1 1 156 156 HIS N N 156 119.180 119.180 121.001 -1.821 25139 2918 1 5 . 1 1 156 156 HIS CA C 156 57.931 57.931 54.781 3.151 25139 2919 1 5 . 1 1 156 156 HIS CB C 156 30.300 30.300 31.057 -0.757 25139 2920 1 5 . 1 1 156 156 HIS H H 156 7.868 7.868 8.185 -0.317 25139 2921 1 6 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.719 1.185 25139 2922 1 6 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.090 1.132 25139 2923 1 6 . 1 1 49 49 ASP N N 49 119.661 119.661 120.386 -0.725 25139 2924 1 6 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.015 0.262 25139 2925 1 6 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.816 -0.754 25139 2926 1 6 . 1 1 49 49 ASP H H 49 8.462 8.462 7.699 0.763 25139 2927 1 6 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.043 0.009 25139 2928 1 6 . 1 1 51 51 LEU C C 51 178.514 178.514 177.249 1.265 25139 2929 1 6 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.569 0.480 25139 2930 1 6 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.404 -0.211 25139 2931 1 6 . 1 1 52 52 ASN N N 52 113.819 113.819 117.024 -3.205 25139 2932 1 6 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.650 0.185 25139 2933 1 6 . 1 1 52 52 ASN C C 52 175.964 175.964 176.234 -0.270 25139 2934 1 6 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.150 -1.054 25139 2935 1 6 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.630 0.253 25139 2936 1 6 . 1 1 52 52 ASN H H 52 7.853 7.853 8.420 -0.567 25139 2937 1 6 . 1 1 53 53 SER N N 53 114.357 114.357 114.417 -0.060 25139 2938 1 6 . 1 1 53 53 SER CA C 53 59.908 59.908 59.141 0.767 25139 2939 1 6 . 1 1 53 53 SER CB C 53 64.395 64.395 63.862 0.533 25139 2940 1 6 . 1 1 53 53 SER H H 53 8.023 8.023 7.865 0.158 25139 2941 1 6 . 1 1 54 54 PHE N N 54 121.037 121.037 121.026 0.011 25139 2942 1 6 . 1 1 54 54 PHE C C 54 175.522 175.522 175.840 -0.318 25139 2943 1 6 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.115 0.948 25139 2944 1 6 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.174 -0.121 25139 2945 1 6 . 1 1 54 54 PHE H H 54 7.731 7.731 7.711 0.020 25139 2946 1 6 . 1 1 55 55 THR N N 55 116.535 116.535 118.549 -2.014 25139 2947 1 6 . 1 1 55 55 THR HA H 55 4.654 4.654 4.662 -0.008 25139 2948 1 6 . 1 1 55 55 THR C C 55 173.301 173.301 173.122 0.179 25139 2949 1 6 . 1 1 55 55 THR CA C 55 61.420 61.420 61.489 -0.069 25139 2950 1 6 . 1 1 55 55 THR CB C 55 71.388 71.388 71.266 0.122 25139 2951 1 6 . 1 1 55 55 THR H H 55 8.929 8.929 9.291 -0.362 25139 2952 1 6 . 1 1 56 56 ALA N N 56 129.359 129.359 128.727 0.632 25139 2953 1 6 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.091 0.224 25139 2954 1 6 . 1 1 56 56 ALA C C 56 178.305 178.305 177.284 1.021 25139 2955 1 6 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.244 0.627 25139 2956 1 6 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.241 0.083 25139 2957 1 6 . 1 1 56 56 ALA H H 56 8.907 8.907 8.669 0.238 25139 2958 1 6 . 1 1 57 57 GLY N N 57 106.331 106.331 110.497 -4.166 25139 2959 1 6 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.703 0.909 25139 2960 1 6 . 1 1 57 57 GLY H H 57 7.978 7.978 8.200 -0.222 25139 2961 1 6 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.307 0.017 25139 2962 1 6 . 1 1 59 59 PRO C C 59 177.466 177.466 177.424 0.042 25139 2963 1 6 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.176 1.308 25139 2964 1 6 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.114 -0.379 25139 2965 1 6 . 1 1 60 60 GLY N N 60 109.688 109.688 107.838 1.850 25139 2966 1 6 . 1 1 60 60 GLY C C 60 173.555 173.555 173.097 0.458 25139 2967 1 6 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.944 0.597 25139 2968 1 6 . 1 1 60 60 GLY H H 60 8.402 8.402 8.799 -0.397 25139 2969 1 6 . 1 1 61 61 PHE N N 61 122.491 122.491 121.990 0.501 25139 2970 1 6 . 1 1 61 61 PHE C C 61 175.146 175.146 174.994 0.152 25139 2971 1 6 . 1 1 61 61 PHE CA C 61 58.282 58.282 57.185 1.097 25139 2972 1 6 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.960 -2.261 25139 2973 1 6 . 1 1 61 61 PHE H H 61 7.957 7.957 7.199 0.758 25139 2974 1 6 . 1 1 62 62 VAL N N 62 121.128 121.128 115.376 5.752 25139 2975 1 6 . 1 1 62 62 VAL HA H 62 5.085 5.085 4.949 0.136 25139 2976 1 6 . 1 1 62 62 VAL C C 62 174.937 174.937 174.710 0.227 25139 2977 1 6 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.175 0.533 25139 2978 1 6 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.620 0.812 25139 2979 1 6 . 1 1 62 62 VAL H H 62 7.994 7.994 8.979 -0.985 25139 2980 1 6 . 1 1 63 63 LEU N N 63 124.386 124.386 122.933 1.453 25139 2981 1 6 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.451 -1.135 25139 2982 1 6 . 1 1 63 63 LEU C C 63 175.278 175.278 177.303 -2.025 25139 2983 1 6 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.995 0.293 25139 2984 1 6 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.135 1.983 25139 2985 1 6 . 1 1 63 63 LEU H H 63 7.572 7.572 8.859 -1.287 25139 2986 1 6 . 1 1 64 64 ASP N N 64 126.746 126.746 126.154 0.592 25139 2987 1 6 . 1 1 64 64 ASP C C 64 177.801 177.801 176.878 0.923 25139 2988 1 6 . 1 1 64 64 ASP CA C 64 51.721 51.721 56.142 -4.421 25139 2989 1 6 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.379 -0.981 25139 2990 1 6 . 1 1 64 64 ASP H H 64 8.552 8.552 8.732 -0.180 25139 2991 1 6 . 1 1 65 65 THR C C 65 175.002 175.002 175.079 -0.077 25139 2992 1 6 . 1 1 65 65 THR CB C 65 67.919 67.919 66.623 1.296 25139 2993 1 6 . 1 1 66 66 GLN N N 66 120.804 120.804 120.302 0.502 25139 2994 1 6 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.920 -0.043 25139 2995 1 6 . 1 1 66 66 GLN C C 66 178.901 178.901 177.351 1.550 25139 2996 1 6 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.511 0.905 25139 2997 1 6 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.345 -0.421 25139 2998 1 6 . 1 1 66 66 GLN H H 66 8.447 8.447 8.138 0.309 25139 2999 1 6 . 1 1 67 67 ALA N N 67 121.267 121.267 121.492 -0.225 25139 3000 1 6 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.083 -0.126 25139 3001 1 6 . 1 1 67 67 ALA C C 67 176.777 176.777 178.254 -1.477 25139 3002 1 6 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.123 0.201 25139 3003 1 6 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.032 0.588 25139 3004 1 6 . 1 1 67 67 ALA H H 67 7.791 7.791 7.905 -0.114 25139 3005 1 6 . 1 1 68 68 SER N N 68 113.339 113.339 113.124 0.215 25139 3006 1 6 . 1 1 68 68 SER HA H 68 4.061 4.061 4.195 -0.134 25139 3007 1 6 . 1 1 68 68 SER C C 68 175.875 175.875 176.508 -0.633 25139 3008 1 6 . 1 1 68 68 SER CA C 68 62.970 62.970 60.441 2.529 25139 3009 1 6 . 1 1 68 68 SER CB C 68 61.330 61.330 63.584 -2.254 25139 3010 1 6 . 1 1 68 68 SER H H 68 7.785 7.785 7.282 0.503 25139 3011 1 6 . 1 1 69 69 VAL N N 69 125.140 125.140 117.995 7.145 25139 3012 1 6 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.209 -0.133 25139 3013 1 6 . 1 1 69 69 VAL C C 69 176.384 176.384 176.579 -0.195 25139 3014 1 6 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.481 1.250 25139 3015 1 6 . 1 1 69 69 VAL CB C 69 31.489 31.489 30.881 0.608 25139 3016 1 6 . 1 1 69 69 VAL H H 69 8.572 8.572 8.100 0.472 25139 3017 1 6 . 1 1 70 70 SER N N 70 116.704 116.704 113.842 2.862 25139 3018 1 6 . 1 1 70 70 SER HA H 70 4.229 4.229 4.282 -0.053 25139 3019 1 6 . 1 1 70 70 SER C C 70 174.101 174.101 175.377 -1.276 25139 3020 1 6 . 1 1 70 70 SER CA C 70 61.627 61.627 59.645 1.982 25139 3021 1 6 . 1 1 70 70 SER H H 70 7.951 7.951 7.730 0.221 25139 3022 1 6 . 1 1 71 71 ASN N N 71 117.576 117.576 117.628 -0.052 25139 3023 1 6 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.639 0.163 25139 3024 1 6 . 1 1 71 71 ASN C C 71 174.332 174.332 175.032 -0.700 25139 3025 1 6 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.913 -0.474 25139 3026 1 6 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.583 -0.116 25139 3027 1 6 . 1 1 71 71 ASN H H 71 7.131 7.131 7.465 -0.334 25139 3028 1 6 . 1 1 72 72 GLY N N 72 103.925 103.925 105.512 -1.587 25139 3029 1 6 . 1 1 72 72 GLY C C 72 174.710 174.710 173.494 1.216 25139 3030 1 6 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.558 -0.009 25139 3031 1 6 . 1 1 72 72 GLY H H 72 7.338 7.338 7.434 -0.096 25139 3032 1 6 . 1 1 73 73 ALA N N 73 124.942 124.942 124.533 0.409 25139 3033 1 6 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.877 -0.705 25139 3034 1 6 . 1 1 73 73 ALA C C 73 175.896 175.896 176.977 -1.081 25139 3035 1 6 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.638 1.035 25139 3036 1 6 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.167 -0.111 25139 3037 1 6 . 1 1 73 73 ALA H H 73 8.032 8.032 7.938 0.094 25139 3038 1 6 . 1 1 74 74 THR N N 74 113.423 113.423 116.936 -3.513 25139 3039 1 6 . 1 1 74 74 THR HA H 74 4.678 4.678 4.609 0.069 25139 3040 1 6 . 1 1 74 74 THR C C 74 173.339 173.339 173.230 0.109 25139 3041 1 6 . 1 1 74 74 THR CA C 74 61.545 61.545 61.167 0.378 25139 3042 1 6 . 1 1 74 74 THR CB C 74 71.319 71.319 70.899 0.420 25139 3043 1 6 . 1 1 74 74 THR H H 74 8.530 8.530 8.783 -0.253 25139 3044 1 6 . 1 1 75 75 PHE N N 75 128.180 128.180 130.233 -2.053 25139 3045 1 6 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.889 -0.285 25139 3046 1 6 . 1 1 75 75 PHE C C 75 174.623 174.623 175.184 -0.561 25139 3047 1 6 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.795 1.821 25139 3048 1 6 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.678 0.997 25139 3049 1 6 . 1 1 75 75 PHE H H 75 9.146 9.146 9.154 -0.008 25139 3050 1 6 . 1 1 76 76 LEU N N 76 127.849 127.849 124.727 3.122 25139 3051 1 6 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.381 -0.030 25139 3052 1 6 . 1 1 76 76 LEU C C 76 176.339 176.339 176.940 -0.601 25139 3053 1 6 . 1 1 76 76 LEU CA C 76 55.983 55.983 56.048 -0.065 25139 3054 1 6 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.106 0.224 25139 3055 1 6 . 1 1 76 76 LEU H H 76 8.635 8.635 8.008 0.627 25139 3056 1 6 . 1 1 77 77 GLU N N 77 115.131 115.131 118.905 -3.774 25139 3057 1 6 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.461 -0.053 25139 3058 1 6 . 1 1 77 77 GLU C C 77 174.734 174.734 174.794 -0.060 25139 3059 1 6 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.506 0.847 25139 3060 1 6 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.201 0.006 25139 3061 1 6 . 1 1 77 77 GLU H H 77 7.252 7.252 7.596 -0.344 25139 3062 1 6 . 1 1 78 78 SER N N 78 118.016 118.016 117.355 0.661 25139 3063 1 6 . 1 1 78 78 SER HA H 78 5.561 5.561 5.137 0.424 25139 3064 1 6 . 1 1 78 78 SER C C 78 171.968 171.968 172.694 -0.726 25139 3065 1 6 . 1 1 78 78 SER CA C 78 54.061 54.061 54.501 -0.440 25139 3066 1 6 . 1 1 78 78 SER CB C 78 64.074 64.074 63.722 0.352 25139 3067 1 6 . 1 1 78 78 SER H H 78 9.033 9.033 8.622 0.411 25139 3068 1 6 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.828 -0.228 25139 3069 1 6 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.374 0.035 25139 3070 1 6 . 1 1 80 80 THR N N 80 118.079 118.079 116.195 1.884 25139 3071 1 6 . 1 1 80 80 THR HA H 80 4.342 4.342 4.266 0.076 25139 3072 1 6 . 1 1 80 80 THR C C 80 174.494 174.494 174.276 0.218 25139 3073 1 6 . 1 1 80 80 THR CA C 80 61.453 61.453 60.279 1.175 25139 3074 1 6 . 1 1 80 80 THR CB C 80 67.797 67.797 68.339 -0.542 25139 3075 1 6 . 1 1 80 80 THR H H 80 8.670 8.670 8.381 0.289 25139 3076 1 6 . 1 1 81 81 VAL N N 81 117.395 117.395 116.635 0.760 25139 3077 1 6 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.891 0.716 25139 3078 1 6 . 1 1 81 81 VAL C C 81 175.518 175.518 175.533 -0.015 25139 3079 1 6 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.563 -3.449 25139 3080 1 6 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.200 2.394 25139 3081 1 6 . 1 1 81 81 VAL H H 81 7.448 7.448 7.585 -0.137 25139 3082 1 6 . 1 1 82 82 ARG N N 82 117.852 117.852 119.857 -2.005 25139 3083 1 6 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.579 -0.058 25139 3084 1 6 . 1 1 82 82 ARG C C 82 176.992 176.992 176.458 0.534 25139 3085 1 6 . 1 1 82 82 ARG CA C 82 56.385 56.385 56.309 0.076 25139 3086 1 6 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.879 0.723 25139 3087 1 6 . 1 1 82 82 ARG H H 82 8.710 8.710 8.697 0.013 25139 3088 1 6 . 1 1 83 83 ARG N N 83 117.035 117.035 117.264 -0.229 25139 3089 1 6 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.817 0.505 25139 3090 1 6 . 1 1 83 83 ARG C C 83 177.379 177.379 176.732 0.647 25139 3091 1 6 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.602 -0.918 25139 3092 1 6 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.531 -0.490 25139 3093 1 6 . 1 1 83 83 ARG H H 83 7.292 7.292 7.748 -0.456 25139 3094 1 6 . 1 1 84 84 GLY N N 84 114.911 114.911 110.342 4.569 25139 3095 1 6 . 1 1 84 84 GLY C C 84 176.940 176.940 175.104 1.836 25139 3096 1 6 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.760 1.912 25139 3097 1 6 . 1 1 84 84 GLY H H 84 9.255 9.255 8.670 0.585 25139 3098 1 6 . 1 1 85 85 TRP N N 85 121.810 121.810 120.038 1.772 25139 3099 1 6 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.254 -0.087 25139 3100 1 6 . 1 1 85 85 TRP C C 85 178.272 178.272 178.062 0.210 25139 3101 1 6 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.852 1.193 25139 3102 1 6 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.246 -0.029 25139 3103 1 6 . 1 1 85 85 TRP H H 85 9.963 9.963 8.119 1.844 25139 3104 1 6 . 1 1 86 86 ASP N N 86 116.400 116.400 120.316 -3.916 25139 3105 1 6 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.540 -0.147 25139 3106 1 6 . 1 1 86 86 ASP C C 86 178.803 178.803 177.841 0.962 25139 3107 1 6 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.587 0.467 25139 3108 1 6 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.338 0.395 25139 3109 1 6 . 1 1 86 86 ASP H H 86 6.934 6.934 7.746 -0.812 25139 3110 1 6 . 1 1 87 87 CYS N N 87 122.454 122.454 119.801 2.653 25139 3111 1 6 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.230 0.020 25139 3112 1 6 . 1 1 87 87 CYS C C 87 174.956 174.956 176.492 -1.536 25139 3113 1 6 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.187 -4.040 25139 3114 1 6 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.061 11.424 25139 3115 1 6 . 1 1 87 87 CYS H H 87 7.603 7.603 7.498 0.105 25139 3116 1 6 . 1 1 88 88 VAL N N 88 119.192 119.192 120.486 -1.294 25139 3117 1 6 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.187 -0.729 25139 3118 1 6 . 1 1 88 88 VAL C C 88 177.413 177.413 177.722 -0.309 25139 3119 1 6 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.397 0.579 25139 3120 1 6 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.920 -0.678 25139 3121 1 6 . 1 1 88 88 VAL H H 88 7.192 7.192 7.660 -0.468 25139 3122 1 6 . 1 1 89 89 ARG N N 89 118.185 118.185 119.620 -1.435 25139 3123 1 6 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.937 -0.257 25139 3124 1 6 . 1 1 89 89 ARG C C 89 178.677 178.677 177.672 1.005 25139 3125 1 6 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.005 0.951 25139 3126 1 6 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.634 0.157 25139 3127 1 6 . 1 1 89 89 ARG H H 89 7.971 7.971 7.588 0.383 25139 3128 1 6 . 1 1 90 90 ALA N N 90 120.815 120.815 122.282 -1.467 25139 3129 1 6 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.127 -0.052 25139 3130 1 6 . 1 1 90 90 ALA C C 90 177.416 177.416 179.280 -1.864 25139 3131 1 6 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.357 -0.103 25139 3132 1 6 . 1 1 90 90 ALA CB C 90 17.436 17.436 17.916 -0.480 25139 3133 1 6 . 1 1 90 90 ALA H H 90 7.453 7.453 7.622 -0.169 25139 3134 1 6 . 1 1 91 91 CYS N N 91 120.380 120.380 116.206 4.174 25139 3135 1 6 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.231 0.140 25139 3136 1 6 . 1 1 91 91 CYS C C 91 176.654 176.654 175.951 0.703 25139 3137 1 6 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.737 -4.042 25139 3138 1 6 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.149 12.555 25139 3139 1 6 . 1 1 91 91 CYS H H 91 7.944 7.944 7.598 0.346 25139 3140 1 6 . 1 1 92 92 CYS N N 92 116.270 116.270 117.465 -1.195 25139 3141 1 6 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.581 -0.177 25139 3142 1 6 . 1 1 92 92 CYS C C 92 175.628 175.628 176.491 -0.863 25139 3143 1 6 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.937 -2.231 25139 3144 1 6 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.948 15.201 25139 3145 1 6 . 1 1 92 92 CYS H H 92 8.315 8.315 7.717 0.598 25139 3146 1 6 . 1 1 93 93 THR N N 93 107.283 107.283 111.258 -3.975 25139 3147 1 6 . 1 1 93 93 THR HA H 93 4.481 4.481 4.370 0.111 25139 3148 1 6 . 1 1 93 93 THR C C 93 173.606 173.606 175.344 -1.738 25139 3149 1 6 . 1 1 93 93 THR CA C 93 61.402 61.402 63.886 -2.484 25139 3150 1 6 . 1 1 93 93 THR CB C 93 69.046 69.046 69.526 -0.480 25139 3151 1 6 . 1 1 93 93 THR H H 93 7.445 7.445 7.619 -0.174 25139 3152 1 6 . 1 1 94 94 THR N N 94 121.432 121.432 121.511 -0.079 25139 3153 1 6 . 1 1 94 94 THR HA H 94 4.398 4.398 4.460 -0.062 25139 3154 1 6 . 1 1 94 94 THR C C 94 173.493 173.493 174.954 -1.461 25139 3155 1 6 . 1 1 94 94 THR CA C 94 62.726 62.726 63.118 -0.392 25139 3156 1 6 . 1 1 94 94 THR CB C 94 69.704 69.704 68.674 1.030 25139 3157 1 6 . 1 1 94 94 THR H H 94 7.553 7.553 7.893 -0.340 25139 3158 1 6 . 1 1 95 95 GLN N N 95 129.410 129.410 128.199 1.211 25139 3159 1 6 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.018 -0.074 25139 3160 1 6 . 1 1 95 95 GLN C C 95 176.293 176.293 176.246 0.047 25139 3161 1 6 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.803 -0.763 25139 3162 1 6 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.696 -0.440 25139 3163 1 6 . 1 1 95 95 GLN H H 95 8.812 8.812 8.766 0.046 25139 3164 1 6 . 1 1 96 96 ASN N N 96 115.015 115.015 114.302 0.713 25139 3165 1 6 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.817 -0.618 25139 3166 1 6 . 1 1 96 96 ASN C C 96 172.260 172.260 174.057 -1.797 25139 3167 1 6 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.219 2.348 25139 3168 1 6 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.884 -2.047 25139 3169 1 6 . 1 1 96 96 ASN H H 96 8.791 8.791 8.211 0.580 25139 3170 1 6 . 1 1 97 97 CYS N N 97 115.830 115.830 121.014 -5.184 25139 3171 1 6 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.474 -0.373 25139 3172 1 6 . 1 1 97 97 CYS C C 97 175.025 175.025 174.110 0.915 25139 3173 1 6 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.537 -1.389 25139 3174 1 6 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.451 15.783 25139 3175 1 6 . 1 1 97 97 CYS H H 97 7.651 7.651 7.924 -0.273 25139 3176 1 6 . 1 1 98 98 ASN N N 98 125.148 125.148 125.245 -0.097 25139 3177 1 6 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.908 0.225 25139 3178 1 6 . 1 1 98 98 ASN C C 98 171.892 171.892 174.273 -2.381 25139 3179 1 6 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.156 0.038 25139 3180 1 6 . 1 1 98 98 ASN CB C 98 39.948 39.948 40.792 -0.844 25139 3181 1 6 . 1 1 98 98 ASN H H 98 8.736 8.736 8.597 0.139 25139 3182 1 6 . 1 1 99 99 LEU N N 99 120.898 120.898 122.303 -1.405 25139 3183 1 6 . 1 1 99 99 LEU C C 99 173.084 173.084 174.089 -1.005 25139 3184 1 6 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.894 2.226 25139 3185 1 6 . 1 1 99 99 LEU CB C 99 44.328 44.328 44.959 -0.631 25139 3186 1 6 . 1 1 99 99 LEU H H 99 8.200 8.200 7.940 0.260 25139 3187 1 6 . 1 1 100 100 ALA N N 100 128.085 128.085 130.293 -2.208 25139 3188 1 6 . 1 1 100 100 ALA C C 100 174.938 174.938 175.546 -0.608 25139 3189 1 6 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.424 -0.677 25139 3190 1 6 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.512 0.202 25139 3191 1 6 . 1 1 100 100 ALA H H 100 9.156 9.156 9.265 -0.109 25139 3192 1 6 . 1 1 101 101 LEU N N 101 128.723 128.723 128.478 0.245 25139 3193 1 6 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.408 -0.266 25139 3194 1 6 . 1 1 101 101 LEU C C 101 174.379 174.379 175.232 -0.853 25139 3195 1 6 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.309 -0.456 25139 3196 1 6 . 1 1 101 101 LEU CB C 101 45.307 45.307 45.073 0.234 25139 3197 1 6 . 1 1 101 101 LEU H H 101 9.578 9.578 9.070 0.508 25139 3198 1 6 . 1 1 102 102 VAL N N 102 119.417 119.417 120.411 -0.994 25139 3199 1 6 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.387 0.141 25139 3200 1 6 . 1 1 102 102 VAL C C 102 173.660 173.660 174.114 -0.454 25139 3201 1 6 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.091 -0.471 25139 3202 1 6 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.344 -2.071 25139 3203 1 6 . 1 1 102 102 VAL H H 102 9.297 9.297 9.445 -0.148 25139 3204 1 6 . 1 1 103 103 GLU N N 103 124.427 124.427 122.655 1.772 25139 3205 1 6 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.644 -0.779 25139 3206 1 6 . 1 1 103 103 GLU C C 103 176.319 176.319 174.859 1.460 25139 3207 1 6 . 1 1 103 103 GLU CA C 103 54.101 54.101 53.992 0.109 25139 3208 1 6 . 1 1 103 103 GLU CB C 103 32.201 32.201 32.012 0.189 25139 3209 1 6 . 1 1 103 103 GLU H H 103 7.749 7.749 8.300 -0.551 25139 3210 1 6 . 1 1 104 104 LEU N N 104 127.294 127.294 125.186 2.108 25139 3211 1 6 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.604 -0.284 25139 3212 1 6 . 1 1 104 104 LEU C C 104 176.593 176.593 177.663 -1.070 25139 3213 1 6 . 1 1 104 104 LEU CA C 104 56.084 56.084 52.967 3.117 25139 3214 1 6 . 1 1 104 104 LEU CB C 104 42.391 42.391 43.221 -0.830 25139 3215 1 6 . 1 1 104 104 LEU H H 104 8.323 8.323 8.400 -0.077 25139 3216 1 6 . 1 1 105 105 GLN N N 105 121.361 121.361 117.666 3.695 25139 3217 1 6 . 1 1 105 105 GLN C C 105 172.868 172.868 174.074 -1.206 25139 3218 1 6 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.238 -2.832 25139 3219 1 6 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.860 1.869 25139 3220 1 6 . 1 1 105 105 GLN H H 105 8.095 8.095 8.172 -0.077 25139 3221 1 6 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.448 -0.039 25139 3222 1 6 . 1 1 106 106 PRO C C 106 177.770 177.770 176.850 0.920 25139 3223 1 6 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.625 -0.140 25139 3224 1 6 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.037 -0.269 25139 3225 1 6 . 1 1 107 107 ASP N N 107 116.484 116.484 114.741 1.743 25139 3226 1 6 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.557 -0.117 25139 3227 1 6 . 1 1 107 107 ASP C C 107 176.749 176.749 176.155 0.594 25139 3228 1 6 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.614 -0.159 25139 3229 1 6 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.623 -0.735 25139 3230 1 6 . 1 1 107 107 ASP H H 107 8.638 8.638 8.408 0.230 25139 3231 1 6 . 1 1 108 108 ARG N N 108 117.895 117.895 120.129 -2.234 25139 3232 1 6 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.642 -0.152 25139 3233 1 6 . 1 1 108 108 ARG C C 108 176.111 176.111 177.066 -0.955 25139 3234 1 6 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.338 -0.073 25139 3235 1 6 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.844 0.232 25139 3236 1 6 . 1 1 108 108 ARG H H 108 7.905 7.905 8.303 -0.398 25139 3237 1 6 . 1 1 109 109 GLY N N 109 108.307 108.307 106.888 1.419 25139 3238 1 6 . 1 1 109 109 GLY C C 109 173.949 173.949 173.466 0.483 25139 3239 1 6 . 1 1 109 109 GLY CA C 109 44.551 44.551 44.938 -0.387 25139 3240 1 6 . 1 1 109 109 GLY H H 109 7.753 7.753 8.071 -0.318 25139 3241 1 6 . 1 1 110 110 GLU N N 110 120.035 120.035 121.781 -1.746 25139 3242 1 6 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.546 -0.455 25139 3243 1 6 . 1 1 110 110 GLU C C 110 177.045 177.045 176.787 0.258 25139 3244 1 6 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.414 1.868 25139 3245 1 6 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.782 -1.109 25139 3246 1 6 . 1 1 110 110 GLU H H 110 8.509 8.509 8.648 -0.139 25139 3247 1 6 . 1 1 111 111 ASP N N 111 121.160 121.160 119.880 1.280 25139 3248 1 6 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.528 0.042 25139 3249 1 6 . 1 1 111 111 ASP C C 111 175.089 175.089 176.294 -1.205 25139 3250 1 6 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.215 -1.624 25139 3251 1 6 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.930 1.502 25139 3252 1 6 . 1 1 111 111 ASP H H 111 8.916 8.916 8.552 0.364 25139 3253 1 6 . 1 1 112 112 ALA N N 112 122.130 122.130 119.647 2.483 25139 3254 1 6 . 1 1 112 112 ALA C C 112 178.120 178.120 175.687 2.433 25139 3255 1 6 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.412 2.847 25139 3256 1 6 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.711 -1.941 25139 3257 1 6 . 1 1 112 112 ALA H H 112 7.361 7.361 7.406 -0.045 25139 3258 1 6 . 1 1 113 113 ILE N N 113 113.780 113.780 114.030 -0.250 25139 3259 1 6 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.864 0.022 25139 3260 1 6 . 1 1 113 113 ILE C C 113 174.258 174.258 174.792 -0.534 25139 3261 1 6 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.297 0.215 25139 3262 1 6 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.893 -0.045 25139 3263 1 6 . 1 1 113 113 ILE H H 113 7.667 7.667 8.504 -0.837 25139 3264 1 6 . 1 1 114 114 ALA N N 114 122.673 122.673 125.795 -3.122 25139 3265 1 6 . 1 1 114 114 ALA C C 114 176.984 176.984 176.859 0.125 25139 3266 1 6 . 1 1 114 114 ALA CA C 114 51.564 51.564 52.858 -1.294 25139 3267 1 6 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.630 0.952 25139 3268 1 6 . 1 1 114 114 ALA H H 114 8.904 8.904 8.730 0.174 25139 3269 1 6 . 1 1 115 115 ALA N N 115 116.486 116.486 117.465 -0.979 25139 3270 1 6 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.459 -0.104 25139 3271 1 6 . 1 1 115 115 ALA C C 115 174.138 174.138 174.245 -0.107 25139 3272 1 6 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.911 1.409 25139 3273 1 6 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.447 1.536 25139 3274 1 6 . 1 1 115 115 ALA H H 115 7.182 7.182 7.286 -0.104 25139 3275 1 6 . 1 1 116 116 CYS N N 116 120.099 120.099 120.312 -0.213 25139 3276 1 6 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.325 0.006 25139 3277 1 6 . 1 1 116 116 CYS C C 116 176.609 176.609 172.610 3.999 25139 3278 1 6 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.454 -2.505 25139 3279 1 6 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.592 11.792 25139 3280 1 6 . 1 1 116 116 CYS H H 116 8.298 8.298 7.976 0.322 25139 3281 1 6 . 1 1 117 117 PHE N N 117 126.406 126.406 126.086 0.320 25139 3282 1 6 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.148 0.051 25139 3283 1 6 . 1 1 117 117 PHE C C 117 173.385 173.385 174.313 -0.928 25139 3284 1 6 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.026 0.228 25139 3285 1 6 . 1 1 117 117 PHE CB C 117 41.681 41.681 42.050 -0.369 25139 3286 1 6 . 1 1 117 117 PHE H H 117 9.712 9.712 9.113 0.599 25139 3287 1 6 . 1 1 118 118 LEU N N 118 122.119 122.119 122.803 -0.684 25139 3288 1 6 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.614 -0.448 25139 3289 1 6 . 1 1 118 118 LEU C C 118 175.097 175.097 176.424 -1.327 25139 3290 1 6 . 1 1 118 118 LEU CA C 118 53.904 53.904 53.946 -0.042 25139 3291 1 6 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.966 -1.668 25139 3292 1 6 . 1 1 118 118 LEU H H 118 8.719 8.719 9.325 -0.606 25139 3293 1 6 . 1 1 119 119 ILE N N 119 125.324 125.324 122.785 2.539 25139 3294 1 6 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.970 -0.093 25139 3295 1 6 . 1 1 119 119 ILE C C 119 173.825 173.825 175.731 -1.906 25139 3296 1 6 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.778 -0.671 25139 3297 1 6 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.629 -1.119 25139 3298 1 6 . 1 1 119 119 ILE H H 119 8.986 8.986 9.017 -0.031 25139 3299 1 6 . 1 1 120 120 ASN N N 120 121.534 121.534 123.646 -2.112 25139 3300 1 6 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.853 0.537 25139 3301 1 6 . 1 1 120 120 ASN C C 120 176.098 176.098 176.045 0.053 25139 3302 1 6 . 1 1 120 120 ASN CA C 120 51.457 51.457 54.769 -3.312 25139 3303 1 6 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.935 0.983 25139 3304 1 6 . 1 1 120 120 ASN H H 120 8.694 8.694 9.041 -0.347 25139 3305 1 6 . 1 1 121 121 CYS N N 121 122.779 122.779 118.541 4.238 25139 3306 1 6 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.085 0.398 25139 3307 1 6 . 1 1 121 121 CYS C C 121 173.195 173.195 173.268 -0.073 25139 3308 1 6 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.978 -4.215 25139 3309 1 6 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.394 16.313 25139 3310 1 6 . 1 1 121 121 CYS H H 121 10.668 10.668 8.587 2.081 25139 3311 1 6 . 1 1 122 122 LEU N N 122 121.063 121.063 117.615 3.448 25139 3312 1 6 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.601 -0.236 25139 3313 1 6 . 1 1 122 122 LEU C C 122 176.743 176.743 175.715 1.028 25139 3314 1 6 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.033 0.631 25139 3315 1 6 . 1 1 122 122 LEU CB C 122 44.234 44.234 46.137 -1.903 25139 3316 1 6 . 1 1 122 122 LEU H H 122 8.256 8.256 7.889 0.367 25139 3317 1 6 . 1 1 123 123 TYR N N 123 123.081 123.081 123.777 -0.696 25139 3318 1 6 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.770 -0.727 25139 3319 1 6 . 1 1 123 123 TYR C C 123 173.633 173.633 175.069 -1.436 25139 3320 1 6 . 1 1 123 123 TYR CA C 123 57.888 57.888 57.981 -0.093 25139 3321 1 6 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.812 -0.731 25139 3322 1 6 . 1 1 123 123 TYR H H 123 8.990 8.990 8.968 0.022 25139 3323 1 6 . 1 1 124 124 GLU N N 124 128.742 128.742 127.048 1.694 25139 3324 1 6 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.716 -0.166 25139 3325 1 6 . 1 1 124 124 GLU C C 124 174.835 174.835 175.409 -0.574 25139 3326 1 6 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.459 0.173 25139 3327 1 6 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.213 -0.318 25139 3328 1 6 . 1 1 124 124 GLU H H 124 9.135 9.135 8.773 0.362 25139 3329 1 6 . 1 1 125 125 GLN N N 125 108.066 108.066 109.925 -1.859 25139 3330 1 6 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.928 -0.207 25139 3331 1 6 . 1 1 125 125 GLN C C 125 174.627 174.627 174.939 -0.312 25139 3332 1 6 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.332 0.707 25139 3333 1 6 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.700 -0.372 25139 3334 1 6 . 1 1 125 125 GLN H H 125 8.390 8.390 8.555 -0.165 25139 3335 1 6 . 1 1 126 126 ASN N N 126 118.528 118.528 117.445 1.083 25139 3336 1 6 . 1 1 126 126 ASN C C 126 173.713 173.713 174.645 -0.932 25139 3337 1 6 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.832 -0.643 25139 3338 1 6 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.787 1.014 25139 3339 1 6 . 1 1 126 126 ASN H H 126 8.092 8.092 7.944 0.148 25139 3340 1 6 . 1 1 127 127 PHE N N 127 124.680 124.680 122.035 2.645 25139 3341 1 6 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.828 0.209 25139 3342 1 6 . 1 1 127 127 PHE C C 127 177.125 177.125 176.586 0.539 25139 3343 1 6 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.226 1.187 25139 3344 1 6 . 1 1 127 127 PHE CB C 127 39.244 39.244 37.980 1.264 25139 3345 1 6 . 1 1 127 127 PHE H H 127 9.026 9.026 8.851 0.175 25139 3346 1 6 . 1 1 128 128 VAL N N 128 119.455 119.455 118.074 1.381 25139 3347 1 6 . 1 1 128 128 VAL C C 128 175.886 175.886 175.687 0.199 25139 3348 1 6 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.738 -0.819 25139 3349 1 6 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.136 2.058 25139 3350 1 6 . 1 1 128 128 VAL H H 128 8.364 8.364 7.642 0.722 25139 3351 1 6 . 1 1 129 129 CYS N N 129 116.130 116.130 120.166 -4.036 25139 3352 1 6 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.741 -0.264 25139 3353 1 6 . 1 1 129 129 CYS C C 129 170.569 170.569 174.411 -3.842 25139 3354 1 6 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.268 -3.118 25139 3355 1 6 . 1 1 129 129 CYS CB C 129 44.617 44.617 24.711 19.906 25139 3356 1 6 . 1 1 129 129 CYS H H 129 5.390 5.390 7.365 -1.975 25139 3357 1 6 . 1 1 130 130 LYS N N 130 120.071 120.071 128.246 -8.175 25139 3358 1 6 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.282 0.279 25139 3359 1 6 . 1 1 130 130 LYS C C 130 176.853 176.853 174.668 2.185 25139 3360 1 6 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.760 -0.873 25139 3361 1 6 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.493 1.149 25139 3362 1 6 . 1 1 130 130 LYS H H 130 8.066 8.066 8.403 -0.337 25139 3363 1 6 . 1 1 131 131 PHE N N 131 118.415 118.415 119.323 -0.908 25139 3364 1 6 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.521 -0.914 25139 3365 1 6 . 1 1 131 131 PHE C C 131 174.013 174.013 175.156 -1.143 25139 3366 1 6 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.319 1.392 25139 3367 1 6 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.510 0.571 25139 3368 1 6 . 1 1 131 131 PHE H H 131 8.714 8.714 8.247 0.467 25139 3369 1 6 . 1 1 132 132 ALA N N 132 124.209 124.209 122.734 1.475 25139 3370 1 6 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.077 -0.460 25139 3371 1 6 . 1 1 132 132 ALA C C 132 174.352 174.352 174.376 -0.024 25139 3372 1 6 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.484 1.957 25139 3373 1 6 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.879 -0.415 25139 3374 1 6 . 1 1 132 132 ALA H H 132 9.295 9.295 9.043 0.252 25139 3375 1 6 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.382 -0.499 25139 3376 1 6 . 1 1 133 133 PRO C C 133 173.923 173.923 176.406 -2.483 25139 3377 1 6 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.444 0.627 25139 3378 1 6 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.718 -1.115 25139 3379 1 6 . 1 1 134 134 ARG N N 134 126.071 126.071 125.415 0.656 25139 3380 1 6 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.747 -0.492 25139 3381 1 6 . 1 1 134 134 ARG C C 134 177.065 177.065 175.990 1.075 25139 3382 1 6 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.119 3.045 25139 3383 1 6 . 1 1 134 134 ARG CB C 134 32.183 32.183 32.064 0.119 25139 3384 1 6 . 1 1 134 134 ARG H H 134 8.672 8.672 8.441 0.231 25139 3385 1 6 . 1 1 135 135 GLU N N 135 125.683 125.683 121.481 4.202 25139 3386 1 6 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.396 -0.043 25139 3387 1 6 . 1 1 135 135 GLU C C 135 178.081 178.081 176.790 1.291 25139 3388 1 6 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.893 -0.242 25139 3389 1 6 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.998 -0.002 25139 3390 1 6 . 1 1 135 135 GLU H H 135 8.603 8.603 8.867 -0.264 25139 3391 1 6 . 1 1 136 136 GLY N N 136 110.031 110.031 106.881 3.150 25139 3392 1 6 . 1 1 136 136 GLY C C 136 173.079 173.079 174.115 -1.036 25139 3393 1 6 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.746 1.032 25139 3394 1 6 . 1 1 136 136 GLY H H 136 9.036 9.036 8.478 0.558 25139 3395 1 6 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.452 1.223 25139 3396 1 6 . 1 1 137 137 PHE C C 137 174.936 174.936 175.817 -0.881 25139 3397 1 6 . 1 1 137 137 PHE CA C 137 56.084 56.084 59.981 -3.897 25139 3398 1 6 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.118 5.578 25139 3399 1 6 . 1 1 138 138 ILE N N 138 117.417 117.417 114.826 2.591 25139 3400 1 6 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.665 -0.158 25139 3401 1 6 . 1 1 138 138 ILE C C 138 173.858 173.858 173.874 -0.016 25139 3402 1 6 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.464 1.156 25139 3403 1 6 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.010 1.587 25139 3404 1 6 . 1 1 138 138 ILE H H 138 8.777 8.777 8.698 0.079 25139 3405 1 6 . 1 1 139 139 ASN N N 139 117.201 117.201 116.698 0.503 25139 3406 1 6 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.636 0.423 25139 3407 1 6 . 1 1 139 139 ASN C C 139 173.721 173.721 173.877 -0.156 25139 3408 1 6 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.732 -1.502 25139 3409 1 6 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.177 1.684 25139 3410 1 6 . 1 1 139 139 ASN H H 139 8.872 8.872 8.327 0.545 25139 3411 1 6 . 1 1 140 140 TYR N N 140 123.991 123.991 119.009 4.982 25139 3412 1 6 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.894 0.284 25139 3413 1 6 . 1 1 140 140 TYR C C 140 174.791 174.791 175.112 -0.321 25139 3414 1 6 . 1 1 140 140 TYR CA C 140 57.072 57.072 57.565 -0.493 25139 3415 1 6 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.461 1.209 25139 3416 1 6 . 1 1 140 140 TYR H H 140 9.526 9.526 8.944 0.582 25139 3417 1 6 . 1 1 141 141 LEU N N 141 122.779 122.779 121.659 1.120 25139 3418 1 6 . 1 1 141 141 LEU C C 141 175.404 175.404 177.705 -2.301 25139 3419 1 6 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.702 2.401 25139 3420 1 6 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.538 -0.377 25139 3421 1 6 . 1 1 141 141 LEU H H 141 9.010 9.010 9.190 -0.180 25139 3422 1 6 . 1 1 142 142 THR N N 142 113.189 113.189 112.708 0.481 25139 3423 1 6 . 1 1 142 142 THR HA H 142 4.061 4.061 4.199 -0.138 25139 3424 1 6 . 1 1 142 142 THR C C 142 175.940 175.940 176.316 -0.376 25139 3425 1 6 . 1 1 142 142 THR CA C 142 61.389 61.389 60.997 0.392 25139 3426 1 6 . 1 1 142 142 THR CB C 142 69.779 69.779 70.224 -0.445 25139 3427 1 6 . 1 1 142 142 THR H H 142 7.737 7.737 8.061 -0.324 25139 3428 1 6 . 1 1 143 143 ARG N N 143 120.975 120.975 120.223 0.752 25139 3429 1 6 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.005 -0.067 25139 3430 1 6 . 1 1 143 143 ARG C C 143 178.690 178.690 177.147 1.543 25139 3431 1 6 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.544 1.204 25139 3432 1 6 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.725 0.420 25139 3433 1 6 . 1 1 143 143 ARG H H 143 8.149 8.149 8.567 -0.418 25139 3434 1 6 . 1 1 144 144 GLU N N 144 116.997 116.997 118.442 -1.445 25139 3435 1 6 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.310 -0.201 25139 3436 1 6 . 1 1 144 144 GLU C C 144 178.442 178.442 177.383 1.059 25139 3437 1 6 . 1 1 144 144 GLU CA C 144 59.863 59.863 57.589 2.274 25139 3438 1 6 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.214 -0.632 25139 3439 1 6 . 1 1 144 144 GLU H H 144 8.622 8.622 7.557 1.065 25139 3440 1 6 . 1 1 145 145 VAL N N 145 111.213 111.213 120.510 -9.297 25139 3441 1 6 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.892 0.519 25139 3442 1 6 . 1 1 145 145 VAL C C 145 176.965 176.965 176.793 0.172 25139 3443 1 6 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.118 -0.524 25139 3444 1 6 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.178 -0.096 25139 3445 1 6 . 1 1 145 145 VAL H H 145 7.227 7.227 7.788 -0.561 25139 3446 1 6 . 1 1 146 146 TYR N N 146 123.512 123.512 121.415 2.097 25139 3447 1 6 . 1 1 146 146 TYR HA H 146 3.880 3.880 3.994 -0.114 25139 3448 1 6 . 1 1 146 146 TYR C C 146 176.377 176.377 176.746 -0.369 25139 3449 1 6 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.971 0.566 25139 3450 1 6 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.373 -0.034 25139 3451 1 6 . 1 1 146 146 TYR H H 146 8.492 8.492 8.772 -0.280 25139 3452 1 6 . 1 1 147 147 ARG N N 147 116.680 116.680 117.378 -0.698 25139 3453 1 6 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.878 -0.064 25139 3454 1 6 . 1 1 147 147 ARG C C 147 178.858 178.858 178.504 0.354 25139 3455 1 6 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.368 0.328 25139 3456 1 6 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.667 -0.002 25139 3457 1 6 . 1 1 147 147 ARG H H 147 8.053 8.053 8.012 0.041 25139 3458 1 6 . 1 1 148 148 SER N N 148 115.306 115.306 114.112 1.194 25139 3459 1 6 . 1 1 148 148 SER HA H 148 3.998 3.998 4.433 -0.435 25139 3460 1 6 . 1 1 148 148 SER C C 148 175.786 175.786 175.718 0.068 25139 3461 1 6 . 1 1 148 148 SER CA C 148 62.006 62.006 60.195 1.811 25139 3462 1 6 . 1 1 148 148 SER H H 148 7.139 7.139 7.461 -0.322 25139 3463 1 6 . 1 1 149 149 TYR N N 149 123.207 123.207 123.120 0.087 25139 3464 1 6 . 1 1 149 149 TYR C C 149 175.831 175.831 177.376 -1.545 25139 3465 1 6 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.690 -1.090 25139 3466 1 6 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.398 0.383 25139 3467 1 6 . 1 1 149 149 TYR H H 149 7.253 7.253 7.359 -0.106 25139 3468 1 6 . 1 1 150 150 ARG N N 150 118.708 118.708 116.234 2.474 25139 3469 1 6 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.856 -0.510 25139 3470 1 6 . 1 1 150 150 ARG C C 150 177.644 177.644 178.403 -0.759 25139 3471 1 6 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.693 -0.370 25139 3472 1 6 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.382 -0.528 25139 3473 1 6 . 1 1 150 150 ARG H H 150 8.441 8.441 7.556 0.885 25139 3474 1 6 . 1 1 151 151 GLN N N 151 116.551 116.551 116.623 -0.072 25139 3475 1 6 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.045 -0.088 25139 3476 1 6 . 1 1 151 151 GLN C C 151 177.987 177.987 177.104 0.883 25139 3477 1 6 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.899 0.442 25139 3478 1 6 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.532 -0.068 25139 3479 1 6 . 1 1 151 151 GLN H H 151 7.332 7.332 7.431 -0.099 25139 3480 1 6 . 1 1 152 152 LEU N N 152 118.877 118.877 114.574 4.303 25139 3481 1 6 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.724 -0.545 25139 3482 1 6 . 1 1 152 152 LEU C C 152 179.070 179.070 177.642 1.428 25139 3483 1 6 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.457 0.625 25139 3484 1 6 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.554 -0.866 25139 3485 1 6 . 1 1 152 152 LEU H H 152 7.106 7.106 7.283 -0.177 25139 3486 1 6 . 1 1 153 153 VAL N N 153 119.076 119.076 114.993 4.083 25139 3487 1 6 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.647 -0.787 25139 3488 1 6 . 1 1 153 153 VAL C C 153 177.421 177.421 176.632 0.789 25139 3489 1 6 . 1 1 153 153 VAL CA C 153 64.583 64.583 63.498 1.085 25139 3490 1 6 . 1 1 153 153 VAL CB C 153 31.518 31.518 31.513 0.005 25139 3491 1 6 . 1 1 153 153 VAL H H 153 7.427 7.427 7.119 0.308 25139 3492 1 6 . 1 1 154 154 ASP N N 154 119.888 119.888 118.999 0.889 25139 3493 1 6 . 1 1 154 154 ASP C C 154 177.422 177.422 176.008 1.414 25139 3494 1 6 . 1 1 154 154 ASP CA C 154 56.071 56.071 55.215 0.856 25139 3495 1 6 . 1 1 154 154 ASP CB C 154 40.349 40.349 40.434 -0.085 25139 3496 1 6 . 1 1 154 154 ASP H H 154 7.930 7.930 7.644 0.286 25139 3497 1 6 . 1 1 155 155 HIS N N 155 117.821 117.821 119.357 -1.536 25139 3498 1 6 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.871 1.885 25139 3499 1 6 . 1 1 155 155 HIS CB C 155 30.180 30.180 28.489 1.691 25139 3500 1 6 . 1 1 155 155 HIS H H 155 7.680 7.680 7.661 0.019 25139 3501 1 6 . 1 1 156 156 HIS N N 156 119.180 119.180 124.123 -4.943 25139 3502 1 6 . 1 1 156 156 HIS CA C 156 57.931 57.931 56.087 1.843 25139 3503 1 6 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.355 -0.056 25139 3504 1 6 . 1 1 156 156 HIS H H 156 7.868 7.868 8.169 -0.301 25139 3505 1 7 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.737 1.167 25139 3506 1 7 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.148 0.074 25139 3507 1 7 . 1 1 49 49 ASP N N 49 119.661 119.661 126.198 -6.537 25139 3508 1 7 . 1 1 49 49 ASP CA C 49 54.277 54.277 53.793 0.484 25139 3509 1 7 . 1 1 49 49 ASP CB C 49 41.062 41.062 39.295 1.767 25139 3510 1 7 . 1 1 49 49 ASP H H 49 8.462 8.462 8.862 -0.400 25139 3511 1 7 . 1 1 51 51 LEU HA H 51 4.052 4.052 3.944 0.108 25139 3512 1 7 . 1 1 51 51 LEU C C 51 178.514 178.514 176.793 1.721 25139 3513 1 7 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.576 0.473 25139 3514 1 7 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.466 -0.273 25139 3515 1 7 . 1 1 52 52 ASN N N 52 113.819 113.819 119.475 -5.656 25139 3516 1 7 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.643 0.192 25139 3517 1 7 . 1 1 52 52 ASN C C 52 175.964 175.964 176.529 -0.565 25139 3518 1 7 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.347 -1.252 25139 3519 1 7 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.542 0.341 25139 3520 1 7 . 1 1 52 52 ASN H H 52 7.853 7.853 8.554 -0.701 25139 3521 1 7 . 1 1 53 53 SER N N 53 114.357 114.357 115.376 -1.019 25139 3522 1 7 . 1 1 53 53 SER CA C 53 59.908 59.908 60.483 -0.575 25139 3523 1 7 . 1 1 53 53 SER CB C 53 64.395 64.395 63.202 1.193 25139 3524 1 7 . 1 1 53 53 SER H H 53 8.023 8.023 7.952 0.070 25139 3525 1 7 . 1 1 54 54 PHE N N 54 121.037 121.037 119.030 2.007 25139 3526 1 7 . 1 1 54 54 PHE C C 54 175.522 175.522 175.999 -0.477 25139 3527 1 7 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.042 1.022 25139 3528 1 7 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.425 -0.372 25139 3529 1 7 . 1 1 54 54 PHE H H 54 7.731 7.731 7.692 0.039 25139 3530 1 7 . 1 1 55 55 THR N N 55 116.535 116.535 119.156 -2.621 25139 3531 1 7 . 1 1 55 55 THR HA H 55 4.654 4.654 4.716 -0.062 25139 3532 1 7 . 1 1 55 55 THR C C 55 173.301 173.301 173.254 0.047 25139 3533 1 7 . 1 1 55 55 THR CA C 55 61.420 61.420 61.239 0.181 25139 3534 1 7 . 1 1 55 55 THR CB C 55 71.388 71.388 71.070 0.318 25139 3535 1 7 . 1 1 55 55 THR H H 55 8.929 8.929 9.290 -0.361 25139 3536 1 7 . 1 1 56 56 ALA N N 56 129.359 129.359 129.231 0.128 25139 3537 1 7 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.022 0.293 25139 3538 1 7 . 1 1 56 56 ALA C C 56 178.305 178.305 177.775 0.530 25139 3539 1 7 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.134 0.737 25139 3540 1 7 . 1 1 56 56 ALA CB C 56 19.324 19.324 18.801 0.523 25139 3541 1 7 . 1 1 56 56 ALA H H 56 8.907 8.907 8.806 0.101 25139 3542 1 7 . 1 1 57 57 GLY N N 57 106.331 106.331 110.900 -4.569 25139 3543 1 7 . 1 1 57 57 GLY CA C 57 44.611 44.611 44.385 0.226 25139 3544 1 7 . 1 1 57 57 GLY H H 57 7.978 7.978 8.408 -0.430 25139 3545 1 7 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.370 -0.046 25139 3546 1 7 . 1 1 59 59 PRO C C 59 177.466 177.466 177.383 0.083 25139 3547 1 7 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.030 1.454 25139 3548 1 7 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.087 -0.352 25139 3549 1 7 . 1 1 60 60 GLY N N 60 109.688 109.688 107.709 1.979 25139 3550 1 7 . 1 1 60 60 GLY C C 60 173.555 173.555 172.862 0.693 25139 3551 1 7 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.929 0.612 25139 3552 1 7 . 1 1 60 60 GLY H H 60 8.402 8.402 8.788 -0.386 25139 3553 1 7 . 1 1 61 61 PHE N N 61 122.491 122.491 121.690 0.801 25139 3554 1 7 . 1 1 61 61 PHE C C 61 175.146 175.146 174.528 0.618 25139 3555 1 7 . 1 1 61 61 PHE CA C 61 58.282 58.282 57.096 1.186 25139 3556 1 7 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.469 -2.770 25139 3557 1 7 . 1 1 61 61 PHE H H 61 7.957 7.957 7.190 0.767 25139 3558 1 7 . 1 1 62 62 VAL N N 62 121.128 121.128 117.036 4.092 25139 3559 1 7 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.381 -0.296 25139 3560 1 7 . 1 1 62 62 VAL C C 62 174.937 174.937 174.717 0.220 25139 3561 1 7 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.806 0.902 25139 3562 1 7 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.099 1.333 25139 3563 1 7 . 1 1 62 62 VAL H H 62 7.994 7.994 8.950 -0.956 25139 3564 1 7 . 1 1 63 63 LEU N N 63 124.386 124.386 122.537 1.849 25139 3565 1 7 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.363 -1.047 25139 3566 1 7 . 1 1 63 63 LEU C C 63 175.278 175.278 176.548 -1.270 25139 3567 1 7 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.562 0.726 25139 3568 1 7 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.489 1.629 25139 3569 1 7 . 1 1 63 63 LEU H H 63 7.572 7.572 8.618 -1.046 25139 3570 1 7 . 1 1 64 64 ASP N N 64 126.746 126.746 129.710 -2.964 25139 3571 1 7 . 1 1 64 64 ASP C C 64 177.801 177.801 176.657 1.144 25139 3572 1 7 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.002 -2.281 25139 3573 1 7 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.068 0.330 25139 3574 1 7 . 1 1 64 64 ASP H H 64 8.552 8.552 8.450 0.102 25139 3575 1 7 . 1 1 65 65 THR C C 65 175.002 175.002 175.609 -0.607 25139 3576 1 7 . 1 1 65 65 THR CB C 65 67.919 67.919 68.537 -0.618 25139 3577 1 7 . 1 1 66 66 GLN N N 66 120.804 120.804 119.487 1.317 25139 3578 1 7 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.170 -0.293 25139 3579 1 7 . 1 1 66 66 GLN C C 66 178.901 178.901 176.485 2.416 25139 3580 1 7 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.793 1.623 25139 3581 1 7 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.663 0.261 25139 3582 1 7 . 1 1 66 66 GLN H H 66 8.447 8.447 8.296 0.151 25139 3583 1 7 . 1 1 67 67 ALA N N 67 121.267 121.267 122.064 -0.797 25139 3584 1 7 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.242 -0.285 25139 3585 1 7 . 1 1 67 67 ALA C C 67 176.777 176.777 179.036 -2.259 25139 3586 1 7 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.879 0.445 25139 3587 1 7 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.057 -0.437 25139 3588 1 7 . 1 1 67 67 ALA H H 67 7.791 7.791 7.481 0.310 25139 3589 1 7 . 1 1 68 68 SER N N 68 113.339 113.339 114.856 -1.517 25139 3590 1 7 . 1 1 68 68 SER HA H 68 4.061 4.061 4.092 -0.031 25139 3591 1 7 . 1 1 68 68 SER C C 68 175.875 175.875 176.401 -0.526 25139 3592 1 7 . 1 1 68 68 SER CA C 68 62.970 62.970 62.209 0.761 25139 3593 1 7 . 1 1 68 68 SER CB C 68 61.330 61.330 63.511 -2.182 25139 3594 1 7 . 1 1 68 68 SER H H 68 7.785 7.785 7.996 -0.211 25139 3595 1 7 . 1 1 69 69 VAL N N 69 125.140 125.140 116.869 8.271 25139 3596 1 7 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.130 -0.054 25139 3597 1 7 . 1 1 69 69 VAL C C 69 176.384 176.384 176.632 -0.248 25139 3598 1 7 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.318 1.413 25139 3599 1 7 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.457 0.031 25139 3600 1 7 . 1 1 69 69 VAL H H 69 8.572 8.572 7.600 0.972 25139 3601 1 7 . 1 1 70 70 SER N N 70 116.704 116.704 113.481 3.223 25139 3602 1 7 . 1 1 70 70 SER HA H 70 4.229 4.229 4.214 0.015 25139 3603 1 7 . 1 1 70 70 SER C C 70 174.101 174.101 175.396 -1.295 25139 3604 1 7 . 1 1 70 70 SER CA C 70 61.627 61.627 59.357 2.270 25139 3605 1 7 . 1 1 70 70 SER H H 70 7.951 7.951 7.787 0.164 25139 3606 1 7 . 1 1 71 71 ASN N N 71 117.576 117.576 117.197 0.379 25139 3607 1 7 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.694 0.108 25139 3608 1 7 . 1 1 71 71 ASN C C 71 174.332 174.332 174.926 -0.594 25139 3609 1 7 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.800 -0.361 25139 3610 1 7 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.778 0.689 25139 3611 1 7 . 1 1 71 71 ASN H H 71 7.131 7.131 7.516 -0.385 25139 3612 1 7 . 1 1 72 72 GLY N N 72 103.925 103.925 105.424 -1.499 25139 3613 1 7 . 1 1 72 72 GLY C C 72 174.710 174.710 173.483 1.227 25139 3614 1 7 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.529 0.020 25139 3615 1 7 . 1 1 72 72 GLY H H 72 7.338 7.338 7.375 -0.037 25139 3616 1 7 . 1 1 73 73 ALA N N 73 124.942 124.942 123.261 1.681 25139 3617 1 7 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.519 -0.347 25139 3618 1 7 . 1 1 73 73 ALA C C 73 175.896 175.896 176.275 -0.379 25139 3619 1 7 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.995 0.678 25139 3620 1 7 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.066 -0.010 25139 3621 1 7 . 1 1 73 73 ALA H H 73 8.032 8.032 7.665 0.367 25139 3622 1 7 . 1 1 74 74 THR N N 74 113.423 113.423 116.571 -3.148 25139 3623 1 7 . 1 1 74 74 THR HA H 74 4.678 4.678 4.553 0.125 25139 3624 1 7 . 1 1 74 74 THR C C 74 173.339 173.339 173.253 0.086 25139 3625 1 7 . 1 1 74 74 THR CA C 74 61.545 61.545 60.568 0.977 25139 3626 1 7 . 1 1 74 74 THR CB C 74 71.319 71.319 71.677 -0.358 25139 3627 1 7 . 1 1 74 74 THR H H 74 8.530 8.530 8.228 0.302 25139 3628 1 7 . 1 1 75 75 PHE N N 75 128.180 128.180 129.346 -1.166 25139 3629 1 7 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.818 -0.214 25139 3630 1 7 . 1 1 75 75 PHE C C 75 174.623 174.623 174.896 -0.273 25139 3631 1 7 . 1 1 75 75 PHE CA C 75 57.616 57.616 57.486 0.130 25139 3632 1 7 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.893 -0.218 25139 3633 1 7 . 1 1 75 75 PHE H H 75 9.146 9.146 9.112 0.034 25139 3634 1 7 . 1 1 76 76 LEU N N 76 127.849 127.849 126.083 1.766 25139 3635 1 7 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.549 -0.198 25139 3636 1 7 . 1 1 76 76 LEU C C 76 176.339 176.339 176.253 0.086 25139 3637 1 7 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.325 0.658 25139 3638 1 7 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.550 -0.219 25139 3639 1 7 . 1 1 76 76 LEU H H 76 8.635 8.635 8.222 0.413 25139 3640 1 7 . 1 1 77 77 GLU N N 77 115.131 115.131 120.209 -5.078 25139 3641 1 7 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.423 -0.015 25139 3642 1 7 . 1 1 77 77 GLU C C 77 174.734 174.734 174.335 0.399 25139 3643 1 7 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.125 1.228 25139 3644 1 7 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.922 0.285 25139 3645 1 7 . 1 1 77 77 GLU H H 77 7.252 7.252 7.535 -0.283 25139 3646 1 7 . 1 1 78 78 SER N N 78 118.016 118.016 119.417 -1.401 25139 3647 1 7 . 1 1 78 78 SER HA H 78 5.561 5.561 5.143 0.418 25139 3648 1 7 . 1 1 78 78 SER C C 78 171.968 171.968 172.859 -0.891 25139 3649 1 7 . 1 1 78 78 SER CA C 78 54.061 54.061 54.810 -0.750 25139 3650 1 7 . 1 1 78 78 SER CB C 78 64.074 64.074 63.408 0.666 25139 3651 1 7 . 1 1 78 78 SER H H 78 9.033 9.033 8.493 0.540 25139 3652 1 7 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.910 -0.310 25139 3653 1 7 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.369 0.041 25139 3654 1 7 . 1 1 80 80 THR N N 80 118.079 118.079 114.435 3.644 25139 3655 1 7 . 1 1 80 80 THR HA H 80 4.342 4.342 4.381 -0.039 25139 3656 1 7 . 1 1 80 80 THR C C 80 174.494 174.494 174.210 0.284 25139 3657 1 7 . 1 1 80 80 THR CA C 80 61.453 61.453 59.981 1.472 25139 3658 1 7 . 1 1 80 80 THR CB C 80 67.797 67.797 68.455 -0.658 25139 3659 1 7 . 1 1 80 80 THR H H 80 8.670 8.670 8.175 0.495 25139 3660 1 7 . 1 1 81 81 VAL N N 81 117.395 117.395 118.177 -0.782 25139 3661 1 7 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.976 0.631 25139 3662 1 7 . 1 1 81 81 VAL C C 81 175.518 175.518 175.470 0.048 25139 3663 1 7 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.539 -3.425 25139 3664 1 7 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.418 2.177 25139 3665 1 7 . 1 1 81 81 VAL H H 81 7.448 7.448 7.508 -0.060 25139 3666 1 7 . 1 1 82 82 ARG N N 82 117.852 117.852 119.697 -1.845 25139 3667 1 7 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.420 0.101 25139 3668 1 7 . 1 1 82 82 ARG C C 82 176.992 176.992 176.522 0.470 25139 3669 1 7 . 1 1 82 82 ARG CA C 82 56.385 56.385 56.630 -0.246 25139 3670 1 7 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.846 0.756 25139 3671 1 7 . 1 1 82 82 ARG H H 82 8.710 8.710 8.686 0.024 25139 3672 1 7 . 1 1 83 83 ARG N N 83 117.035 117.035 117.241 -0.206 25139 3673 1 7 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.944 0.378 25139 3674 1 7 . 1 1 83 83 ARG C C 83 177.379 177.379 176.865 0.514 25139 3675 1 7 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.747 -1.063 25139 3676 1 7 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.566 -0.526 25139 3677 1 7 . 1 1 83 83 ARG H H 83 7.292 7.292 7.716 -0.424 25139 3678 1 7 . 1 1 84 84 GLY N N 84 114.911 114.911 109.815 5.096 25139 3679 1 7 . 1 1 84 84 GLY C C 84 176.940 176.940 175.169 1.771 25139 3680 1 7 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.960 1.712 25139 3681 1 7 . 1 1 84 84 GLY H H 84 9.255 9.255 8.707 0.548 25139 3682 1 7 . 1 1 85 85 TRP N N 85 121.810 121.810 120.150 1.660 25139 3683 1 7 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.135 0.032 25139 3684 1 7 . 1 1 85 85 TRP C C 85 178.272 178.272 178.199 0.073 25139 3685 1 7 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.956 0.089 25139 3686 1 7 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.192 0.025 25139 3687 1 7 . 1 1 85 85 TRP H H 85 9.963 9.963 8.001 1.962 25139 3688 1 7 . 1 1 86 86 ASP N N 86 116.400 116.400 119.471 -3.071 25139 3689 1 7 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.476 -0.083 25139 3690 1 7 . 1 1 86 86 ASP C C 86 178.803 178.803 177.652 1.151 25139 3691 1 7 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.745 0.309 25139 3692 1 7 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.113 0.620 25139 3693 1 7 . 1 1 86 86 ASP H H 86 6.934 6.934 8.019 -1.085 25139 3694 1 7 . 1 1 87 87 CYS N N 87 122.454 122.454 119.696 2.758 25139 3695 1 7 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.260 -0.010 25139 3696 1 7 . 1 1 87 87 CYS C C 87 174.956 174.956 176.583 -1.627 25139 3697 1 7 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.015 -3.868 25139 3698 1 7 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.458 11.027 25139 3699 1 7 . 1 1 87 87 CYS H H 87 7.603 7.603 7.665 -0.062 25139 3700 1 7 . 1 1 88 88 VAL N N 88 119.192 119.192 120.758 -1.566 25139 3701 1 7 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.433 -0.975 25139 3702 1 7 . 1 1 88 88 VAL C C 88 177.413 177.413 177.031 0.382 25139 3703 1 7 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.183 1.792 25139 3704 1 7 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.109 -0.867 25139 3705 1 7 . 1 1 88 88 VAL H H 88 7.192 7.192 7.416 -0.224 25139 3706 1 7 . 1 1 89 89 ARG N N 89 118.185 118.185 118.611 -0.426 25139 3707 1 7 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.868 -0.188 25139 3708 1 7 . 1 1 89 89 ARG C C 89 178.677 178.677 177.665 1.012 25139 3709 1 7 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.002 0.953 25139 3710 1 7 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.326 0.465 25139 3711 1 7 . 1 1 89 89 ARG H H 89 7.971 7.971 7.417 0.554 25139 3712 1 7 . 1 1 90 90 ALA N N 90 120.815 120.815 121.763 -0.948 25139 3713 1 7 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.151 -0.076 25139 3714 1 7 . 1 1 90 90 ALA C C 90 177.416 177.416 178.523 -1.107 25139 3715 1 7 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.017 0.237 25139 3716 1 7 . 1 1 90 90 ALA CB C 90 17.436 17.436 17.948 -0.512 25139 3717 1 7 . 1 1 90 90 ALA H H 90 7.453 7.453 7.628 -0.175 25139 3718 1 7 . 1 1 91 91 CYS N N 91 120.380 120.380 116.020 4.360 25139 3719 1 7 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.195 0.176 25139 3720 1 7 . 1 1 91 91 CYS C C 91 176.654 176.654 175.844 0.810 25139 3721 1 7 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.626 -3.931 25139 3722 1 7 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.014 12.690 25139 3723 1 7 . 1 1 91 91 CYS H H 91 7.944 7.944 7.516 0.428 25139 3724 1 7 . 1 1 92 92 CYS N N 92 116.270 116.270 117.870 -1.600 25139 3725 1 7 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.509 -0.105 25139 3726 1 7 . 1 1 92 92 CYS C C 92 175.628 175.628 176.455 -0.827 25139 3727 1 7 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.981 -2.275 25139 3728 1 7 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.050 15.099 25139 3729 1 7 . 1 1 92 92 CYS H H 92 8.315 8.315 7.758 0.557 25139 3730 1 7 . 1 1 93 93 THR N N 93 107.283 107.283 111.524 -4.241 25139 3731 1 7 . 1 1 93 93 THR HA H 93 4.481 4.481 4.336 0.145 25139 3732 1 7 . 1 1 93 93 THR C C 93 173.606 173.606 175.398 -1.792 25139 3733 1 7 . 1 1 93 93 THR CA C 93 61.402 61.402 63.959 -2.557 25139 3734 1 7 . 1 1 93 93 THR CB C 93 69.046 69.046 69.246 -0.200 25139 3735 1 7 . 1 1 93 93 THR H H 93 7.445 7.445 7.630 -0.185 25139 3736 1 7 . 1 1 94 94 THR N N 94 121.432 121.432 121.581 -0.149 25139 3737 1 7 . 1 1 94 94 THR HA H 94 4.398 4.398 4.412 -0.014 25139 3738 1 7 . 1 1 94 94 THR C C 94 173.493 173.493 174.975 -1.482 25139 3739 1 7 . 1 1 94 94 THR CA C 94 62.726 62.726 62.992 -0.266 25139 3740 1 7 . 1 1 94 94 THR CB C 94 69.704 69.704 68.370 1.334 25139 3741 1 7 . 1 1 94 94 THR H H 94 7.553 7.553 7.951 -0.398 25139 3742 1 7 . 1 1 95 95 GLN N N 95 129.410 129.410 128.008 1.402 25139 3743 1 7 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.983 -0.039 25139 3744 1 7 . 1 1 95 95 GLN C C 95 176.293 176.293 176.442 -0.149 25139 3745 1 7 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.638 -0.598 25139 3746 1 7 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.977 -0.721 25139 3747 1 7 . 1 1 95 95 GLN H H 95 8.812 8.812 8.918 -0.106 25139 3748 1 7 . 1 1 96 96 ASN N N 96 115.015 115.015 114.432 0.583 25139 3749 1 7 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.828 -0.629 25139 3750 1 7 . 1 1 96 96 ASN C C 96 172.260 172.260 173.739 -1.479 25139 3751 1 7 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.090 2.477 25139 3752 1 7 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.980 -2.143 25139 3753 1 7 . 1 1 96 96 ASN H H 96 8.791 8.791 8.159 0.632 25139 3754 1 7 . 1 1 97 97 CYS N N 97 115.830 115.830 121.056 -5.226 25139 3755 1 7 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.427 -0.326 25139 3756 1 7 . 1 1 97 97 CYS C C 97 175.025 175.025 173.618 1.407 25139 3757 1 7 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.913 -1.765 25139 3758 1 7 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.237 15.997 25139 3759 1 7 . 1 1 97 97 CYS H H 97 7.651 7.651 7.830 -0.179 25139 3760 1 7 . 1 1 98 98 ASN N N 98 125.148 125.148 124.411 0.737 25139 3761 1 7 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.092 0.041 25139 3762 1 7 . 1 1 98 98 ASN C C 98 171.892 171.892 174.255 -2.363 25139 3763 1 7 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.480 -0.286 25139 3764 1 7 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.645 -1.697 25139 3765 1 7 . 1 1 98 98 ASN H H 98 8.736 8.736 8.524 0.212 25139 3766 1 7 . 1 1 99 99 LEU N N 99 120.898 120.898 121.502 -0.604 25139 3767 1 7 . 1 1 99 99 LEU C C 99 173.084 173.084 174.046 -0.962 25139 3768 1 7 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.888 2.232 25139 3769 1 7 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.412 -1.084 25139 3770 1 7 . 1 1 99 99 LEU H H 99 8.200 8.200 8.057 0.143 25139 3771 1 7 . 1 1 100 100 ALA N N 100 128.085 128.085 130.179 -2.094 25139 3772 1 7 . 1 1 100 100 ALA C C 100 174.938 174.938 175.484 -0.546 25139 3773 1 7 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.562 -0.815 25139 3774 1 7 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.073 0.641 25139 3775 1 7 . 1 1 100 100 ALA H H 100 9.156 9.156 9.189 -0.033 25139 3776 1 7 . 1 1 101 101 LEU N N 101 128.723 128.723 127.839 0.884 25139 3777 1 7 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.395 -0.253 25139 3778 1 7 . 1 1 101 101 LEU C C 101 174.379 174.379 175.326 -0.947 25139 3779 1 7 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.576 -0.723 25139 3780 1 7 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.824 0.483 25139 3781 1 7 . 1 1 101 101 LEU H H 101 9.578 9.578 8.716 0.862 25139 3782 1 7 . 1 1 102 102 VAL N N 102 119.417 119.417 120.529 -1.112 25139 3783 1 7 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.316 0.212 25139 3784 1 7 . 1 1 102 102 VAL C C 102 173.660 173.660 174.127 -0.467 25139 3785 1 7 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.175 -0.555 25139 3786 1 7 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.048 -1.775 25139 3787 1 7 . 1 1 102 102 VAL H H 102 9.297 9.297 9.399 -0.102 25139 3788 1 7 . 1 1 103 103 GLU N N 103 124.427 124.427 124.713 -0.286 25139 3789 1 7 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.598 -0.733 25139 3790 1 7 . 1 1 103 103 GLU C C 103 176.319 176.319 175.481 0.838 25139 3791 1 7 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.743 -0.642 25139 3792 1 7 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.817 0.384 25139 3793 1 7 . 1 1 103 103 GLU H H 103 7.749 7.749 8.451 -0.702 25139 3794 1 7 . 1 1 104 104 LEU N N 104 127.294 127.294 125.885 1.409 25139 3795 1 7 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.558 -0.238 25139 3796 1 7 . 1 1 104 104 LEU C C 104 176.593 176.593 177.816 -1.223 25139 3797 1 7 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.178 2.906 25139 3798 1 7 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.645 -0.254 25139 3799 1 7 . 1 1 104 104 LEU H H 104 8.323 8.323 8.270 0.053 25139 3800 1 7 . 1 1 105 105 GLN N N 105 121.361 121.361 114.174 7.187 25139 3801 1 7 . 1 1 105 105 GLN C C 105 172.868 172.868 174.023 -1.155 25139 3802 1 7 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.230 -2.824 25139 3803 1 7 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.355 3.374 25139 3804 1 7 . 1 1 105 105 GLN H H 105 8.095 8.095 8.159 -0.064 25139 3805 1 7 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.431 -0.022 25139 3806 1 7 . 1 1 106 106 PRO C C 106 177.770 177.770 176.769 1.001 25139 3807 1 7 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.563 -0.078 25139 3808 1 7 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.111 -0.343 25139 3809 1 7 . 1 1 107 107 ASP N N 107 116.484 116.484 115.114 1.370 25139 3810 1 7 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.560 -0.120 25139 3811 1 7 . 1 1 107 107 ASP C C 107 176.749 176.749 176.144 0.605 25139 3812 1 7 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.604 -0.149 25139 3813 1 7 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.580 -0.691 25139 3814 1 7 . 1 1 107 107 ASP H H 107 8.638 8.638 8.409 0.229 25139 3815 1 7 . 1 1 108 108 ARG N N 108 117.895 117.895 120.273 -2.378 25139 3816 1 7 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.644 -0.154 25139 3817 1 7 . 1 1 108 108 ARG C C 108 176.111 176.111 177.074 -0.963 25139 3818 1 7 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.259 0.006 25139 3819 1 7 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.770 0.306 25139 3820 1 7 . 1 1 108 108 ARG H H 108 7.905 7.905 8.344 -0.439 25139 3821 1 7 . 1 1 109 109 GLY N N 109 108.307 108.307 107.030 1.277 25139 3822 1 7 . 1 1 109 109 GLY C C 109 173.949 173.949 173.457 0.492 25139 3823 1 7 . 1 1 109 109 GLY CA C 109 44.551 44.551 44.939 -0.388 25139 3824 1 7 . 1 1 109 109 GLY H H 109 7.753 7.753 8.068 -0.315 25139 3825 1 7 . 1 1 110 110 GLU N N 110 120.035 120.035 122.116 -2.081 25139 3826 1 7 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.348 -0.257 25139 3827 1 7 . 1 1 110 110 GLU C C 110 177.045 177.045 176.542 0.503 25139 3828 1 7 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.156 2.126 25139 3829 1 7 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.037 -1.363 25139 3830 1 7 . 1 1 110 110 GLU H H 110 8.509 8.509 8.646 -0.137 25139 3831 1 7 . 1 1 111 111 ASP N N 111 121.160 121.160 121.652 -0.492 25139 3832 1 7 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.473 0.097 25139 3833 1 7 . 1 1 111 111 ASP C C 111 175.089 175.089 175.749 -0.660 25139 3834 1 7 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.587 -1.996 25139 3835 1 7 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.892 1.540 25139 3836 1 7 . 1 1 111 111 ASP H H 111 8.916 8.916 8.595 0.321 25139 3837 1 7 . 1 1 112 112 ALA N N 112 122.130 122.130 119.097 3.033 25139 3838 1 7 . 1 1 112 112 ALA C C 112 178.120 178.120 176.387 1.733 25139 3839 1 7 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.918 2.341 25139 3840 1 7 . 1 1 112 112 ALA CB C 112 19.770 19.770 20.696 -0.926 25139 3841 1 7 . 1 1 112 112 ALA H H 112 7.361 7.361 7.559 -0.198 25139 3842 1 7 . 1 1 113 113 ILE N N 113 113.780 113.780 114.015 -0.235 25139 3843 1 7 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.872 0.014 25139 3844 1 7 . 1 1 113 113 ILE C C 113 174.258 174.258 174.914 -0.656 25139 3845 1 7 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.320 0.192 25139 3846 1 7 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.918 -0.070 25139 3847 1 7 . 1 1 113 113 ILE H H 113 7.667 7.667 8.375 -0.708 25139 3848 1 7 . 1 1 114 114 ALA N N 114 122.673 122.673 124.905 -2.232 25139 3849 1 7 . 1 1 114 114 ALA C C 114 176.984 176.984 176.793 0.191 25139 3850 1 7 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.141 -1.577 25139 3851 1 7 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.713 0.869 25139 3852 1 7 . 1 1 114 114 ALA H H 114 8.904 8.904 9.012 -0.108 25139 3853 1 7 . 1 1 115 115 ALA N N 115 116.486 116.486 117.065 -0.579 25139 3854 1 7 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.445 -0.090 25139 3855 1 7 . 1 1 115 115 ALA C C 115 174.138 174.138 174.196 -0.058 25139 3856 1 7 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.947 1.373 25139 3857 1 7 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.388 1.595 25139 3858 1 7 . 1 1 115 115 ALA H H 115 7.182 7.182 7.284 -0.102 25139 3859 1 7 . 1 1 116 116 CYS N N 116 120.099 120.099 120.118 -0.019 25139 3860 1 7 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.295 0.036 25139 3861 1 7 . 1 1 116 116 CYS C C 116 176.609 176.609 172.623 3.986 25139 3862 1 7 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.126 -2.177 25139 3863 1 7 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.739 11.645 25139 3864 1 7 . 1 1 116 116 CYS H H 116 8.298 8.298 7.885 0.413 25139 3865 1 7 . 1 1 117 117 PHE N N 117 126.406 126.406 126.209 0.197 25139 3866 1 7 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.168 0.031 25139 3867 1 7 . 1 1 117 117 PHE C C 117 173.385 173.385 174.454 -1.069 25139 3868 1 7 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.179 0.075 25139 3869 1 7 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.239 0.443 25139 3870 1 7 . 1 1 117 117 PHE H H 117 9.712 9.712 9.160 0.552 25139 3871 1 7 . 1 1 118 118 LEU N N 118 122.119 122.119 124.038 -1.919 25139 3872 1 7 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.511 -0.345 25139 3873 1 7 . 1 1 118 118 LEU C C 118 175.097 175.097 176.209 -1.112 25139 3874 1 7 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.088 -0.184 25139 3875 1 7 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.523 -1.225 25139 3876 1 7 . 1 1 118 118 LEU H H 118 8.719 8.719 9.234 -0.515 25139 3877 1 7 . 1 1 119 119 ILE N N 119 125.324 125.324 122.467 2.857 25139 3878 1 7 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.970 -0.093 25139 3879 1 7 . 1 1 119 119 ILE C C 119 173.825 173.825 175.345 -1.520 25139 3880 1 7 . 1 1 119 119 ILE CA C 119 59.107 59.107 60.036 -0.929 25139 3881 1 7 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.302 -0.792 25139 3882 1 7 . 1 1 119 119 ILE H H 119 8.986 8.986 8.969 0.017 25139 3883 1 7 . 1 1 120 120 ASN N N 120 121.534 121.534 124.395 -2.861 25139 3884 1 7 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.794 0.596 25139 3885 1 7 . 1 1 120 120 ASN C C 120 176.098 176.098 176.156 -0.058 25139 3886 1 7 . 1 1 120 120 ASN CA C 120 51.457 51.457 54.903 -3.446 25139 3887 1 7 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.861 1.057 25139 3888 1 7 . 1 1 120 120 ASN H H 120 8.694 8.694 9.069 -0.375 25139 3889 1 7 . 1 1 121 121 CYS N N 121 122.779 122.779 116.980 5.799 25139 3890 1 7 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.194 0.289 25139 3891 1 7 . 1 1 121 121 CYS C C 121 173.195 173.195 173.404 -0.209 25139 3892 1 7 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.582 -3.818 25139 3893 1 7 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.905 15.802 25139 3894 1 7 . 1 1 121 121 CYS H H 121 10.668 10.668 8.587 2.081 25139 3895 1 7 . 1 1 122 122 LEU N N 122 121.063 121.063 117.303 3.760 25139 3896 1 7 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.515 -0.150 25139 3897 1 7 . 1 1 122 122 LEU C C 122 176.743 176.743 175.862 0.881 25139 3898 1 7 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.057 0.607 25139 3899 1 7 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.290 -1.056 25139 3900 1 7 . 1 1 122 122 LEU H H 122 8.256 8.256 7.374 0.882 25139 3901 1 7 . 1 1 123 123 TYR N N 123 123.081 123.081 123.633 -0.552 25139 3902 1 7 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.770 -0.727 25139 3903 1 7 . 1 1 123 123 TYR C C 123 173.633 173.633 174.821 -1.188 25139 3904 1 7 . 1 1 123 123 TYR CA C 123 57.888 57.888 57.999 -0.111 25139 3905 1 7 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.639 -0.558 25139 3906 1 7 . 1 1 123 123 TYR H H 123 8.990 8.990 8.974 0.016 25139 3907 1 7 . 1 1 124 124 GLU N N 124 128.742 128.742 126.380 2.362 25139 3908 1 7 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.707 -0.157 25139 3909 1 7 . 1 1 124 124 GLU C C 124 174.835 174.835 175.510 -0.675 25139 3910 1 7 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.389 0.243 25139 3911 1 7 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.190 -0.295 25139 3912 1 7 . 1 1 124 124 GLU H H 124 9.135 9.135 8.808 0.327 25139 3913 1 7 . 1 1 125 125 GLN N N 125 108.066 108.066 109.011 -0.945 25139 3914 1 7 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.843 -0.122 25139 3915 1 7 . 1 1 125 125 GLN C C 125 174.627 174.627 174.577 0.050 25139 3916 1 7 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.769 0.270 25139 3917 1 7 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.696 -0.368 25139 3918 1 7 . 1 1 125 125 GLN H H 125 8.390 8.390 8.432 -0.042 25139 3919 1 7 . 1 1 126 126 ASN N N 126 118.528 118.528 117.646 0.882 25139 3920 1 7 . 1 1 126 126 ASN C C 126 173.713 173.713 174.915 -1.202 25139 3921 1 7 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.255 -0.066 25139 3922 1 7 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.929 0.872 25139 3923 1 7 . 1 1 126 126 ASN H H 126 8.092 8.092 7.917 0.175 25139 3924 1 7 . 1 1 127 127 PHE N N 127 124.680 124.680 122.152 2.528 25139 3925 1 7 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.805 0.232 25139 3926 1 7 . 1 1 127 127 PHE C C 127 177.125 177.125 176.630 0.495 25139 3927 1 7 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.754 1.659 25139 3928 1 7 . 1 1 127 127 PHE CB C 127 39.244 39.244 37.855 1.389 25139 3929 1 7 . 1 1 127 127 PHE H H 127 9.026 9.026 8.898 0.128 25139 3930 1 7 . 1 1 128 128 VAL N N 128 119.455 119.455 117.760 1.695 25139 3931 1 7 . 1 1 128 128 VAL C C 128 175.886 175.886 175.855 0.031 25139 3932 1 7 . 1 1 128 128 VAL CA C 128 60.919 60.919 62.162 -1.243 25139 3933 1 7 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.251 1.943 25139 3934 1 7 . 1 1 128 128 VAL H H 128 8.364 8.364 7.692 0.672 25139 3935 1 7 . 1 1 129 129 CYS N N 129 116.130 116.130 120.108 -3.978 25139 3936 1 7 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.798 -0.321 25139 3937 1 7 . 1 1 129 129 CYS C C 129 170.569 170.569 174.525 -3.956 25139 3938 1 7 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.747 -3.597 25139 3939 1 7 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.740 18.877 25139 3940 1 7 . 1 1 129 129 CYS H H 129 5.390 5.390 7.270 -1.880 25139 3941 1 7 . 1 1 130 130 LYS N N 130 120.071 120.071 126.248 -6.177 25139 3942 1 7 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.413 0.148 25139 3943 1 7 . 1 1 130 130 LYS C C 130 176.853 176.853 174.699 2.154 25139 3944 1 7 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.052 -0.165 25139 3945 1 7 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.415 1.227 25139 3946 1 7 . 1 1 130 130 LYS H H 130 8.066 8.066 8.509 -0.443 25139 3947 1 7 . 1 1 131 131 PHE N N 131 118.415 118.415 120.100 -1.685 25139 3948 1 7 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.414 -0.807 25139 3949 1 7 . 1 1 131 131 PHE C C 131 174.013 174.013 174.984 -0.971 25139 3950 1 7 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.613 1.098 25139 3951 1 7 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.711 0.369 25139 3952 1 7 . 1 1 131 131 PHE H H 131 8.714 8.714 8.375 0.339 25139 3953 1 7 . 1 1 132 132 ALA N N 132 124.209 124.209 123.097 1.112 25139 3954 1 7 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.061 -0.444 25139 3955 1 7 . 1 1 132 132 ALA C C 132 174.352 174.352 174.342 0.010 25139 3956 1 7 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.500 1.941 25139 3957 1 7 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.964 -0.500 25139 3958 1 7 . 1 1 132 132 ALA H H 132 9.295 9.295 9.083 0.212 25139 3959 1 7 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.463 -0.580 25139 3960 1 7 . 1 1 133 133 PRO C C 133 173.923 173.923 176.593 -2.670 25139 3961 1 7 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.594 0.477 25139 3962 1 7 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.563 -0.960 25139 3963 1 7 . 1 1 134 134 ARG N N 134 126.071 126.071 124.487 1.584 25139 3964 1 7 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.665 -0.410 25139 3965 1 7 . 1 1 134 134 ARG C C 134 177.065 177.065 176.117 0.948 25139 3966 1 7 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.705 2.459 25139 3967 1 7 . 1 1 134 134 ARG CB C 134 32.183 32.183 31.821 0.362 25139 3968 1 7 . 1 1 134 134 ARG H H 134 8.672 8.672 8.244 0.428 25139 3969 1 7 . 1 1 135 135 GLU N N 135 125.683 125.683 120.380 5.303 25139 3970 1 7 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.455 -0.102 25139 3971 1 7 . 1 1 135 135 GLU C C 135 178.081 178.081 177.282 0.799 25139 3972 1 7 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.302 0.349 25139 3973 1 7 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.330 -0.334 25139 3974 1 7 . 1 1 135 135 GLU H H 135 8.603 8.603 8.876 -0.273 25139 3975 1 7 . 1 1 136 136 GLY N N 136 110.031 110.031 107.453 2.578 25139 3976 1 7 . 1 1 136 136 GLY C C 136 173.079 173.079 172.285 0.794 25139 3977 1 7 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.652 1.126 25139 3978 1 7 . 1 1 136 136 GLY H H 136 9.036 9.036 8.234 0.802 25139 3979 1 7 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.702 -0.027 25139 3980 1 7 . 1 1 137 137 PHE C C 137 174.936 174.936 174.200 0.736 25139 3981 1 7 . 1 1 137 137 PHE CA C 137 56.084 56.084 55.975 0.109 25139 3982 1 7 . 1 1 137 137 PHE CB C 137 44.696 44.696 43.237 1.459 25139 3983 1 7 . 1 1 138 138 ILE N N 138 117.417 117.417 114.284 3.133 25139 3984 1 7 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.656 -0.149 25139 3985 1 7 . 1 1 138 138 ILE C C 138 173.858 173.858 173.396 0.462 25139 3986 1 7 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.932 0.688 25139 3987 1 7 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.370 1.227 25139 3988 1 7 . 1 1 138 138 ILE H H 138 8.777 8.777 9.116 -0.339 25139 3989 1 7 . 1 1 139 139 ASN N N 139 117.201 117.201 116.937 0.264 25139 3990 1 7 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.586 0.473 25139 3991 1 7 . 1 1 139 139 ASN C C 139 173.721 173.721 174.264 -0.543 25139 3992 1 7 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.816 -1.586 25139 3993 1 7 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.416 1.445 25139 3994 1 7 . 1 1 139 139 ASN H H 139 8.872 8.872 8.443 0.429 25139 3995 1 7 . 1 1 140 140 TYR N N 140 123.991 123.991 120.227 3.764 25139 3996 1 7 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.796 0.382 25139 3997 1 7 . 1 1 140 140 TYR C C 140 174.791 174.791 175.313 -0.522 25139 3998 1 7 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.494 -1.422 25139 3999 1 7 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.675 1.995 25139 4000 1 7 . 1 1 140 140 TYR H H 140 9.526 9.526 8.640 0.886 25139 4001 1 7 . 1 1 141 141 LEU N N 141 122.779 122.779 120.317 2.462 25139 4002 1 7 . 1 1 141 141 LEU C C 141 175.404 175.404 177.667 -2.263 25139 4003 1 7 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.808 2.295 25139 4004 1 7 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.852 -0.692 25139 4005 1 7 . 1 1 141 141 LEU H H 141 9.010 9.010 9.166 -0.156 25139 4006 1 7 . 1 1 142 142 THR N N 142 113.189 113.189 111.612 1.577 25139 4007 1 7 . 1 1 142 142 THR HA H 142 4.061 4.061 4.312 -0.251 25139 4008 1 7 . 1 1 142 142 THR C C 142 175.940 175.940 176.299 -0.359 25139 4009 1 7 . 1 1 142 142 THR CA C 142 61.389 61.389 61.098 0.291 25139 4010 1 7 . 1 1 142 142 THR CB C 142 69.779 69.779 70.441 -0.661 25139 4011 1 7 . 1 1 142 142 THR H H 142 7.737 7.737 8.159 -0.422 25139 4012 1 7 . 1 1 143 143 ARG N N 143 120.975 120.975 121.642 -0.667 25139 4013 1 7 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.041 -0.103 25139 4014 1 7 . 1 1 143 143 ARG C C 143 178.690 178.690 176.811 1.879 25139 4015 1 7 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.419 1.329 25139 4016 1 7 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.396 0.749 25139 4017 1 7 . 1 1 143 143 ARG H H 143 8.149 8.149 8.616 -0.467 25139 4018 1 7 . 1 1 144 144 GLU N N 144 116.997 116.997 118.228 -1.231 25139 4019 1 7 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.342 -0.233 25139 4020 1 7 . 1 1 144 144 GLU C C 144 178.442 178.442 177.242 1.200 25139 4021 1 7 . 1 1 144 144 GLU CA C 144 59.863 59.863 57.581 2.283 25139 4022 1 7 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.141 -0.559 25139 4023 1 7 . 1 1 144 144 GLU H H 144 8.622 8.622 7.498 1.124 25139 4024 1 7 . 1 1 145 145 VAL N N 145 111.213 111.213 119.820 -8.607 25139 4025 1 7 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.781 0.630 25139 4026 1 7 . 1 1 145 145 VAL C C 145 176.965 176.965 176.334 0.631 25139 4027 1 7 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.362 -0.768 25139 4028 1 7 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.187 -0.105 25139 4029 1 7 . 1 1 145 145 VAL H H 145 7.227 7.227 7.867 -0.640 25139 4030 1 7 . 1 1 146 146 TYR N N 146 123.512 123.512 121.073 2.439 25139 4031 1 7 . 1 1 146 146 TYR HA H 146 3.880 3.880 3.981 -0.101 25139 4032 1 7 . 1 1 146 146 TYR C C 146 176.377 176.377 176.787 -0.410 25139 4033 1 7 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.844 0.693 25139 4034 1 7 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.452 -0.113 25139 4035 1 7 . 1 1 146 146 TYR H H 146 8.492 8.492 8.686 -0.194 25139 4036 1 7 . 1 1 147 147 ARG N N 147 116.680 116.680 117.281 -0.601 25139 4037 1 7 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.953 -0.139 25139 4038 1 7 . 1 1 147 147 ARG C C 147 178.858 178.858 177.998 0.860 25139 4039 1 7 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.313 0.383 25139 4040 1 7 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.748 -0.083 25139 4041 1 7 . 1 1 147 147 ARG H H 147 8.053 8.053 8.097 -0.044 25139 4042 1 7 . 1 1 148 148 SER N N 148 115.306 115.306 113.801 1.505 25139 4043 1 7 . 1 1 148 148 SER HA H 148 3.998 3.998 4.591 -0.593 25139 4044 1 7 . 1 1 148 148 SER C C 148 175.786 175.786 175.306 0.480 25139 4045 1 7 . 1 1 148 148 SER CA C 148 62.006 62.006 60.063 1.943 25139 4046 1 7 . 1 1 148 148 SER H H 148 7.139 7.139 7.411 -0.272 25139 4047 1 7 . 1 1 149 149 TYR N N 149 123.207 123.207 122.840 0.367 25139 4048 1 7 . 1 1 149 149 TYR C C 149 175.831 175.831 177.708 -1.877 25139 4049 1 7 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.383 -0.783 25139 4050 1 7 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.339 0.442 25139 4051 1 7 . 1 1 149 149 TYR H H 149 7.253 7.253 7.532 -0.279 25139 4052 1 7 . 1 1 150 150 ARG N N 150 118.708 118.708 118.006 0.702 25139 4053 1 7 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.848 -0.502 25139 4054 1 7 . 1 1 150 150 ARG C C 150 177.644 177.644 177.956 -0.312 25139 4055 1 7 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.724 -0.401 25139 4056 1 7 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.202 -0.348 25139 4057 1 7 . 1 1 150 150 ARG H H 150 8.441 8.441 7.592 0.849 25139 4058 1 7 . 1 1 151 151 GLN N N 151 116.551 116.551 114.615 1.936 25139 4059 1 7 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.049 -0.092 25139 4060 1 7 . 1 1 151 151 GLN C C 151 177.987 177.987 176.804 1.183 25139 4061 1 7 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.793 0.548 25139 4062 1 7 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.639 -0.175 25139 4063 1 7 . 1 1 151 151 GLN H H 151 7.332 7.332 7.485 -0.153 25139 4064 1 7 . 1 1 152 152 LEU N N 152 118.877 118.877 114.102 4.775 25139 4065 1 7 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.555 -0.376 25139 4066 1 7 . 1 1 152 152 LEU C C 152 179.070 179.070 177.209 1.861 25139 4067 1 7 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.401 1.681 25139 4068 1 7 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.174 -0.486 25139 4069 1 7 . 1 1 152 152 LEU H H 152 7.106 7.106 7.271 -0.165 25139 4070 1 7 . 1 1 153 153 VAL N N 153 119.076 119.076 114.135 4.941 25139 4071 1 7 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.035 -1.175 25139 4072 1 7 . 1 1 153 153 VAL C C 153 177.421 177.421 176.140 1.281 25139 4073 1 7 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.148 2.435 25139 4074 1 7 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.100 -1.583 25139 4075 1 7 . 1 1 153 153 VAL H H 153 7.427 7.427 7.135 0.292 25139 4076 1 7 . 1 1 154 154 ASP N N 154 119.888 119.888 122.687 -2.799 25139 4077 1 7 . 1 1 154 154 ASP C C 154 177.422 177.422 175.950 1.472 25139 4078 1 7 . 1 1 154 154 ASP CA C 154 56.071 56.071 54.719 1.352 25139 4079 1 7 . 1 1 154 154 ASP CB C 154 40.349 40.349 41.720 -1.371 25139 4080 1 7 . 1 1 154 154 ASP H H 154 7.930 7.930 7.611 0.319 25139 4081 1 7 . 1 1 155 155 HIS N N 155 117.821 117.821 119.578 -1.757 25139 4082 1 7 . 1 1 155 155 HIS CA C 155 57.756 57.756 54.960 2.796 25139 4083 1 7 . 1 1 155 155 HIS CB C 155 30.180 30.180 32.493 -2.313 25139 4084 1 7 . 1 1 155 155 HIS H H 155 7.680 7.680 8.542 -0.862 25139 4085 1 7 . 1 1 156 156 HIS N N 156 119.180 119.180 119.892 -0.712 25139 4086 1 7 . 1 1 156 156 HIS CA C 156 57.931 57.931 57.040 0.891 25139 4087 1 7 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.129 0.171 25139 4088 1 7 . 1 1 156 156 HIS H H 156 7.868 7.868 8.527 -0.659 25139 4089 1 8 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.847 0.057 25139 4090 1 8 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.062 1.160 25139 4091 1 8 . 1 1 49 49 ASP N N 49 119.661 119.661 118.597 1.064 25139 4092 1 8 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.199 0.078 25139 4093 1 8 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.737 -0.675 25139 4094 1 8 . 1 1 49 49 ASP H H 49 8.462 8.462 7.992 0.470 25139 4095 1 8 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.004 0.048 25139 4096 1 8 . 1 1 51 51 LEU C C 51 178.514 178.514 178.192 0.322 25139 4097 1 8 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.089 0.960 25139 4098 1 8 . 1 1 51 51 LEU CB C 51 41.193 41.193 40.314 0.879 25139 4099 1 8 . 1 1 52 52 ASN N N 52 113.819 113.819 118.839 -5.020 25139 4100 1 8 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.581 0.254 25139 4101 1 8 . 1 1 52 52 ASN C C 52 175.964 175.964 175.920 0.044 25139 4102 1 8 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.302 -1.206 25139 4103 1 8 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.060 -0.177 25139 4104 1 8 . 1 1 52 52 ASN H H 52 7.853 7.853 8.274 -0.421 25139 4105 1 8 . 1 1 53 53 SER N N 53 114.357 114.357 112.634 1.723 25139 4106 1 8 . 1 1 53 53 SER CA C 53 59.908 59.908 59.003 0.905 25139 4107 1 8 . 1 1 53 53 SER CB C 53 64.395 64.395 63.977 0.418 25139 4108 1 8 . 1 1 53 53 SER H H 53 8.023 8.023 7.846 0.177 25139 4109 1 8 . 1 1 54 54 PHE N N 54 121.037 121.037 120.657 0.380 25139 4110 1 8 . 1 1 54 54 PHE C C 54 175.522 175.522 175.646 -0.124 25139 4111 1 8 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.153 0.911 25139 4112 1 8 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.442 -0.389 25139 4113 1 8 . 1 1 54 54 PHE H H 54 7.731 7.731 7.731 0.000 25139 4114 1 8 . 1 1 55 55 THR N N 55 116.535 116.535 118.464 -1.929 25139 4115 1 8 . 1 1 55 55 THR HA H 55 4.654 4.654 4.681 -0.027 25139 4116 1 8 . 1 1 55 55 THR C C 55 173.301 173.301 173.238 0.063 25139 4117 1 8 . 1 1 55 55 THR CA C 55 61.420 61.420 61.168 0.252 25139 4118 1 8 . 1 1 55 55 THR CB C 55 71.388 71.388 71.201 0.187 25139 4119 1 8 . 1 1 55 55 THR H H 55 8.929 8.929 9.311 -0.382 25139 4120 1 8 . 1 1 56 56 ALA N N 56 129.359 129.359 128.801 0.558 25139 4121 1 8 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.081 0.234 25139 4122 1 8 . 1 1 56 56 ALA C C 56 178.305 178.305 177.069 1.236 25139 4123 1 8 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.671 1.200 25139 4124 1 8 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.345 -0.021 25139 4125 1 8 . 1 1 56 56 ALA H H 56 8.907 8.907 8.690 0.217 25139 4126 1 8 . 1 1 57 57 GLY N N 57 106.331 106.331 109.800 -3.469 25139 4127 1 8 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.663 0.948 25139 4128 1 8 . 1 1 57 57 GLY H H 57 7.978 7.978 8.151 -0.173 25139 4129 1 8 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.327 -0.003 25139 4130 1 8 . 1 1 59 59 PRO C C 59 177.466 177.466 177.416 0.050 25139 4131 1 8 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.035 1.449 25139 4132 1 8 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.153 -0.418 25139 4133 1 8 . 1 1 60 60 GLY N N 60 109.688 109.688 108.471 1.217 25139 4134 1 8 . 1 1 60 60 GLY C C 60 173.555 173.555 173.457 0.098 25139 4135 1 8 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.194 0.346 25139 4136 1 8 . 1 1 60 60 GLY H H 60 8.402 8.402 8.553 -0.151 25139 4137 1 8 . 1 1 61 61 PHE N N 61 122.491 122.491 122.499 -0.008 25139 4138 1 8 . 1 1 61 61 PHE C C 61 175.146 175.146 174.681 0.465 25139 4139 1 8 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.177 2.105 25139 4140 1 8 . 1 1 61 61 PHE CB C 61 38.699 38.699 39.548 -0.849 25139 4141 1 8 . 1 1 61 61 PHE H H 61 7.957 7.957 7.218 0.739 25139 4142 1 8 . 1 1 62 62 VAL N N 62 121.128 121.128 118.339 2.789 25139 4143 1 8 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.341 -0.256 25139 4144 1 8 . 1 1 62 62 VAL C C 62 174.937 174.937 174.879 0.058 25139 4145 1 8 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.889 0.819 25139 4146 1 8 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.557 0.875 25139 4147 1 8 . 1 1 62 62 VAL H H 62 7.994 7.994 8.581 -0.587 25139 4148 1 8 . 1 1 63 63 LEU N N 63 124.386 124.386 122.284 2.102 25139 4149 1 8 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.574 -1.258 25139 4150 1 8 . 1 1 63 63 LEU C C 63 175.278 175.278 176.474 -1.196 25139 4151 1 8 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.887 0.401 25139 4152 1 8 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.297 1.821 25139 4153 1 8 . 1 1 63 63 LEU H H 63 7.572 7.572 8.473 -0.901 25139 4154 1 8 . 1 1 64 64 ASP N N 64 126.746 126.746 128.733 -1.987 25139 4155 1 8 . 1 1 64 64 ASP C C 64 177.801 177.801 176.217 1.584 25139 4156 1 8 . 1 1 64 64 ASP CA C 64 51.721 51.721 52.395 -0.674 25139 4157 1 8 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.014 -0.616 25139 4158 1 8 . 1 1 64 64 ASP H H 64 8.552 8.552 8.570 -0.018 25139 4159 1 8 . 1 1 65 65 THR C C 65 175.002 175.002 175.892 -0.890 25139 4160 1 8 . 1 1 65 65 THR CB C 65 67.919 67.919 68.678 -0.759 25139 4161 1 8 . 1 1 66 66 GLN N N 66 120.804 120.804 119.886 0.918 25139 4162 1 8 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.050 -0.173 25139 4163 1 8 . 1 1 66 66 GLN C C 66 178.901 178.901 177.760 1.141 25139 4164 1 8 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.458 0.958 25139 4165 1 8 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.834 0.090 25139 4166 1 8 . 1 1 66 66 GLN H H 66 8.447 8.447 8.392 0.055 25139 4167 1 8 . 1 1 67 67 ALA N N 67 121.267 121.267 122.230 -0.963 25139 4168 1 8 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.092 -0.135 25139 4169 1 8 . 1 1 67 67 ALA C C 67 176.777 176.777 179.081 -2.304 25139 4170 1 8 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.192 0.132 25139 4171 1 8 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.180 0.440 25139 4172 1 8 . 1 1 67 67 ALA H H 67 7.791 7.791 7.622 0.169 25139 4173 1 8 . 1 1 68 68 SER N N 68 113.339 113.339 113.177 0.162 25139 4174 1 8 . 1 1 68 68 SER HA H 68 4.061 4.061 4.216 -0.155 25139 4175 1 8 . 1 1 68 68 SER C C 68 175.875 175.875 176.527 -0.652 25139 4176 1 8 . 1 1 68 68 SER CA C 68 62.970 62.970 60.514 2.456 25139 4177 1 8 . 1 1 68 68 SER CB C 68 61.330 61.330 63.676 -2.346 25139 4178 1 8 . 1 1 68 68 SER H H 68 7.785 7.785 7.707 0.078 25139 4179 1 8 . 1 1 69 69 VAL N N 69 125.140 125.140 117.870 7.270 25139 4180 1 8 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.230 -0.154 25139 4181 1 8 . 1 1 69 69 VAL C C 69 176.384 176.384 176.943 -0.559 25139 4182 1 8 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.413 1.318 25139 4183 1 8 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.312 0.177 25139 4184 1 8 . 1 1 69 69 VAL H H 69 8.572 8.572 7.911 0.661 25139 4185 1 8 . 1 1 70 70 SER N N 70 116.704 116.704 113.969 2.735 25139 4186 1 8 . 1 1 70 70 SER HA H 70 4.229 4.229 4.244 -0.015 25139 4187 1 8 . 1 1 70 70 SER C C 70 174.101 174.101 175.491 -1.390 25139 4188 1 8 . 1 1 70 70 SER CA C 70 61.627 61.627 59.196 2.431 25139 4189 1 8 . 1 1 70 70 SER H H 70 7.951 7.951 7.735 0.216 25139 4190 1 8 . 1 1 71 71 ASN N N 71 117.576 117.576 116.992 0.584 25139 4191 1 8 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.660 0.142 25139 4192 1 8 . 1 1 71 71 ASN C C 71 174.332 174.332 174.809 -0.477 25139 4193 1 8 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.877 -0.438 25139 4194 1 8 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.905 0.562 25139 4195 1 8 . 1 1 71 71 ASN H H 71 7.131 7.131 7.536 -0.405 25139 4196 1 8 . 1 1 72 72 GLY N N 72 103.925 103.925 105.577 -1.652 25139 4197 1 8 . 1 1 72 72 GLY C C 72 174.710 174.710 173.535 1.175 25139 4198 1 8 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.575 -0.026 25139 4199 1 8 . 1 1 72 72 GLY H H 72 7.338 7.338 7.434 -0.096 25139 4200 1 8 . 1 1 73 73 ALA N N 73 124.942 124.942 123.368 1.574 25139 4201 1 8 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.521 -0.349 25139 4202 1 8 . 1 1 73 73 ALA C C 73 175.896 175.896 176.101 -0.205 25139 4203 1 8 . 1 1 73 73 ALA CA C 73 52.673 52.673 52.012 0.661 25139 4204 1 8 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.157 -0.102 25139 4205 1 8 . 1 1 73 73 ALA H H 73 8.032 8.032 7.717 0.315 25139 4206 1 8 . 1 1 74 74 THR N N 74 113.423 113.423 116.295 -2.872 25139 4207 1 8 . 1 1 74 74 THR HA H 74 4.678 4.678 4.589 0.089 25139 4208 1 8 . 1 1 74 74 THR C C 74 173.339 173.339 173.325 0.014 25139 4209 1 8 . 1 1 74 74 THR CA C 74 61.545 61.545 61.405 0.140 25139 4210 1 8 . 1 1 74 74 THR CB C 74 71.319 71.319 71.374 -0.055 25139 4211 1 8 . 1 1 74 74 THR H H 74 8.530 8.530 8.266 0.264 25139 4212 1 8 . 1 1 75 75 PHE N N 75 128.180 128.180 130.336 -2.156 25139 4213 1 8 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.939 -0.335 25139 4214 1 8 . 1 1 75 75 PHE C C 75 174.623 174.623 175.117 -0.494 25139 4215 1 8 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.221 2.395 25139 4216 1 8 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.781 0.894 25139 4217 1 8 . 1 1 75 75 PHE H H 75 9.146 9.146 9.096 0.050 25139 4218 1 8 . 1 1 76 76 LEU N N 76 127.849 127.849 124.732 3.117 25139 4219 1 8 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.485 -0.134 25139 4220 1 8 . 1 1 76 76 LEU C C 76 176.339 176.339 176.791 -0.452 25139 4221 1 8 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.969 0.014 25139 4222 1 8 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.206 0.124 25139 4223 1 8 . 1 1 76 76 LEU H H 76 8.635 8.635 8.075 0.560 25139 4224 1 8 . 1 1 77 77 GLU N N 77 115.131 115.131 119.826 -4.695 25139 4225 1 8 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.495 -0.087 25139 4226 1 8 . 1 1 77 77 GLU C C 77 174.734 174.734 174.831 -0.097 25139 4227 1 8 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.570 0.783 25139 4228 1 8 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.897 0.310 25139 4229 1 8 . 1 1 77 77 GLU H H 77 7.252 7.252 7.711 -0.459 25139 4230 1 8 . 1 1 78 78 SER N N 78 118.016 118.016 119.813 -1.797 25139 4231 1 8 . 1 1 78 78 SER HA H 78 5.561 5.561 5.274 0.287 25139 4232 1 8 . 1 1 78 78 SER C C 78 171.968 171.968 172.377 -0.409 25139 4233 1 8 . 1 1 78 78 SER CA C 78 54.061 54.061 54.934 -0.873 25139 4234 1 8 . 1 1 78 78 SER CB C 78 64.074 64.074 63.074 1.000 25139 4235 1 8 . 1 1 78 78 SER H H 78 9.033 9.033 8.673 0.360 25139 4236 1 8 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.882 -0.282 25139 4237 1 8 . 1 1 79 79 PRO CB C 79 32.410 32.410 33.174 -0.764 25139 4238 1 8 . 1 1 80 80 THR N N 80 118.079 118.079 114.470 3.609 25139 4239 1 8 . 1 1 80 80 THR HA H 80 4.342 4.342 4.328 0.014 25139 4240 1 8 . 1 1 80 80 THR C C 80 174.494 174.494 174.617 -0.123 25139 4241 1 8 . 1 1 80 80 THR CA C 80 61.453 61.453 60.137 1.316 25139 4242 1 8 . 1 1 80 80 THR CB C 80 67.797 67.797 68.799 -1.002 25139 4243 1 8 . 1 1 80 80 THR H H 80 8.670 8.670 8.202 0.468 25139 4244 1 8 . 1 1 81 81 VAL N N 81 117.395 117.395 118.751 -1.356 25139 4245 1 8 . 1 1 81 81 VAL HA H 81 4.607 4.607 4.019 0.588 25139 4246 1 8 . 1 1 81 81 VAL C C 81 175.518 175.518 176.128 -0.610 25139 4247 1 8 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.637 -2.523 25139 4248 1 8 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.434 2.160 25139 4249 1 8 . 1 1 81 81 VAL H H 81 7.448 7.448 7.391 0.057 25139 4250 1 8 . 1 1 82 82 ARG N N 82 117.852 117.852 121.286 -3.434 25139 4251 1 8 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.442 0.079 25139 4252 1 8 . 1 1 82 82 ARG C C 82 176.992 176.992 175.759 1.233 25139 4253 1 8 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.977 0.407 25139 4254 1 8 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.296 1.306 25139 4255 1 8 . 1 1 82 82 ARG H H 82 8.710 8.710 8.695 0.015 25139 4256 1 8 . 1 1 83 83 ARG N N 83 117.035 117.035 118.182 -1.147 25139 4257 1 8 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.917 0.405 25139 4258 1 8 . 1 1 83 83 ARG C C 83 177.379 177.379 176.582 0.797 25139 4259 1 8 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.834 -1.150 25139 4260 1 8 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.243 -1.202 25139 4261 1 8 . 1 1 83 83 ARG H H 83 7.292 7.292 7.627 -0.335 25139 4262 1 8 . 1 1 84 84 GLY N N 84 114.911 114.911 109.974 4.937 25139 4263 1 8 . 1 1 84 84 GLY C C 84 176.940 176.940 175.116 1.824 25139 4264 1 8 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.902 1.770 25139 4265 1 8 . 1 1 84 84 GLY H H 84 9.255 9.255 8.725 0.530 25139 4266 1 8 . 1 1 85 85 TRP N N 85 121.810 121.810 120.342 1.468 25139 4267 1 8 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.083 0.084 25139 4268 1 8 . 1 1 85 85 TRP C C 85 178.272 178.272 177.861 0.411 25139 4269 1 8 . 1 1 85 85 TRP CA C 85 60.045 60.045 60.264 -0.220 25139 4270 1 8 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.130 0.087 25139 4271 1 8 . 1 1 85 85 TRP H H 85 9.963 9.963 7.849 2.114 25139 4272 1 8 . 1 1 86 86 ASP N N 86 116.400 116.400 118.958 -2.558 25139 4273 1 8 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.417 -0.024 25139 4274 1 8 . 1 1 86 86 ASP C C 86 178.803 178.803 177.950 0.853 25139 4275 1 8 . 1 1 86 86 ASP CA C 86 57.054 57.054 57.044 0.011 25139 4276 1 8 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.235 0.498 25139 4277 1 8 . 1 1 86 86 ASP H H 86 6.934 6.934 8.028 -1.094 25139 4278 1 8 . 1 1 87 87 CYS N N 87 122.454 122.454 119.625 2.829 25139 4279 1 8 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.253 -0.003 25139 4280 1 8 . 1 1 87 87 CYS C C 87 174.956 174.956 176.655 -1.699 25139 4281 1 8 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.057 -3.910 25139 4282 1 8 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.470 11.015 25139 4283 1 8 . 1 1 87 87 CYS H H 87 7.603 7.603 7.616 -0.013 25139 4284 1 8 . 1 1 88 88 VAL N N 88 119.192 119.192 121.006 -1.814 25139 4285 1 8 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.462 -1.004 25139 4286 1 8 . 1 1 88 88 VAL C C 88 177.413 177.413 177.052 0.361 25139 4287 1 8 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.150 1.826 25139 4288 1 8 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.065 -0.823 25139 4289 1 8 . 1 1 88 88 VAL H H 88 7.192 7.192 7.546 -0.354 25139 4290 1 8 . 1 1 89 89 ARG N N 89 118.185 118.185 118.945 -0.760 25139 4291 1 8 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.908 -0.228 25139 4292 1 8 . 1 1 89 89 ARG C C 89 178.677 178.677 177.504 1.173 25139 4293 1 8 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.863 1.092 25139 4294 1 8 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.393 0.398 25139 4295 1 8 . 1 1 89 89 ARG H H 89 7.971 7.971 7.667 0.304 25139 4296 1 8 . 1 1 90 90 ALA N N 90 120.815 120.815 121.619 -0.804 25139 4297 1 8 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.145 -0.070 25139 4298 1 8 . 1 1 90 90 ALA C C 90 177.416 177.416 178.666 -1.250 25139 4299 1 8 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.180 0.074 25139 4300 1 8 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.152 -0.716 25139 4301 1 8 . 1 1 90 90 ALA H H 90 7.453 7.453 7.583 -0.130 25139 4302 1 8 . 1 1 91 91 CYS N N 91 120.380 120.380 116.523 3.857 25139 4303 1 8 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.261 0.110 25139 4304 1 8 . 1 1 91 91 CYS C C 91 176.654 176.654 176.015 0.639 25139 4305 1 8 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.857 -4.162 25139 4306 1 8 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.476 12.228 25139 4307 1 8 . 1 1 91 91 CYS H H 91 7.944 7.944 7.468 0.476 25139 4308 1 8 . 1 1 92 92 CYS N N 92 116.270 116.270 117.088 -0.818 25139 4309 1 8 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.612 -0.208 25139 4310 1 8 . 1 1 92 92 CYS C C 92 175.628 175.628 176.395 -0.767 25139 4311 1 8 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.584 -1.878 25139 4312 1 8 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.604 15.545 25139 4313 1 8 . 1 1 92 92 CYS H H 92 8.315 8.315 7.739 0.576 25139 4314 1 8 . 1 1 93 93 THR N N 93 107.283 107.283 110.482 -3.199 25139 4315 1 8 . 1 1 93 93 THR HA H 93 4.481 4.481 4.458 0.023 25139 4316 1 8 . 1 1 93 93 THR C C 93 173.606 173.606 175.372 -1.766 25139 4317 1 8 . 1 1 93 93 THR CA C 93 61.402 61.402 63.216 -1.814 25139 4318 1 8 . 1 1 93 93 THR CB C 93 69.046 69.046 70.302 -1.256 25139 4319 1 8 . 1 1 93 93 THR H H 93 7.445 7.445 7.628 -0.183 25139 4320 1 8 . 1 1 94 94 THR N N 94 121.432 121.432 121.736 -0.304 25139 4321 1 8 . 1 1 94 94 THR HA H 94 4.398 4.398 4.509 -0.111 25139 4322 1 8 . 1 1 94 94 THR C C 94 173.493 173.493 175.140 -1.647 25139 4323 1 8 . 1 1 94 94 THR CA C 94 62.726 62.726 62.876 -0.150 25139 4324 1 8 . 1 1 94 94 THR CB C 94 69.704 69.704 68.489 1.215 25139 4325 1 8 . 1 1 94 94 THR H H 94 7.553 7.553 8.095 -0.542 25139 4326 1 8 . 1 1 95 95 GLN N N 95 129.410 129.410 128.274 1.136 25139 4327 1 8 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.045 -0.101 25139 4328 1 8 . 1 1 95 95 GLN C C 95 176.293 176.293 176.669 -0.376 25139 4329 1 8 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.803 -0.763 25139 4330 1 8 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.846 -0.590 25139 4331 1 8 . 1 1 95 95 GLN H H 95 8.812 8.812 8.944 -0.132 25139 4332 1 8 . 1 1 96 96 ASN N N 96 115.015 115.015 115.428 -0.413 25139 4333 1 8 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.722 -0.523 25139 4334 1 8 . 1 1 96 96 ASN C C 96 172.260 172.260 173.823 -1.563 25139 4335 1 8 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.522 2.045 25139 4336 1 8 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.776 -1.939 25139 4337 1 8 . 1 1 96 96 ASN H H 96 8.791 8.791 8.136 0.655 25139 4338 1 8 . 1 1 97 97 CYS N N 97 115.830 115.830 119.402 -3.572 25139 4339 1 8 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.519 -0.418 25139 4340 1 8 . 1 1 97 97 CYS C C 97 175.025 175.025 173.933 1.092 25139 4341 1 8 . 1 1 97 97 CYS CA C 97 58.148 58.148 60.033 -1.885 25139 4342 1 8 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.234 16.000 25139 4343 1 8 . 1 1 97 97 CYS H H 97 7.651 7.651 7.700 -0.049 25139 4344 1 8 . 1 1 98 98 ASN N N 98 125.148 125.148 124.893 0.255 25139 4345 1 8 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.004 0.129 25139 4346 1 8 . 1 1 98 98 ASN C C 98 171.892 171.892 174.364 -2.472 25139 4347 1 8 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.556 -0.362 25139 4348 1 8 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.169 -1.222 25139 4349 1 8 . 1 1 98 98 ASN H H 98 8.736 8.736 8.432 0.304 25139 4350 1 8 . 1 1 99 99 LEU N N 99 120.898 120.898 120.123 0.775 25139 4351 1 8 . 1 1 99 99 LEU C C 99 173.084 173.084 173.956 -0.872 25139 4352 1 8 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.670 2.450 25139 4353 1 8 . 1 1 99 99 LEU CB C 99 44.328 44.328 46.083 -1.755 25139 4354 1 8 . 1 1 99 99 LEU H H 99 8.200 8.200 8.050 0.150 25139 4355 1 8 . 1 1 100 100 ALA N N 100 128.085 128.085 129.112 -1.027 25139 4356 1 8 . 1 1 100 100 ALA C C 100 174.938 174.938 175.361 -0.423 25139 4357 1 8 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.523 -0.776 25139 4358 1 8 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.317 0.397 25139 4359 1 8 . 1 1 100 100 ALA H H 100 9.156 9.156 9.328 -0.172 25139 4360 1 8 . 1 1 101 101 LEU N N 101 128.723 128.723 127.405 1.318 25139 4361 1 8 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.271 -0.129 25139 4362 1 8 . 1 1 101 101 LEU C C 101 174.379 174.379 175.432 -1.053 25139 4363 1 8 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.090 -0.237 25139 4364 1 8 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.450 0.857 25139 4365 1 8 . 1 1 101 101 LEU H H 101 9.578 9.578 9.082 0.496 25139 4366 1 8 . 1 1 102 102 VAL N N 102 119.417 119.417 117.931 1.486 25139 4367 1 8 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.067 0.461 25139 4368 1 8 . 1 1 102 102 VAL C C 102 173.660 173.660 173.741 -0.081 25139 4369 1 8 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.934 -0.314 25139 4370 1 8 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.777 -1.504 25139 4371 1 8 . 1 1 102 102 VAL H H 102 9.297 9.297 9.387 -0.090 25139 4372 1 8 . 1 1 103 103 GLU N N 103 124.427 124.427 123.714 0.713 25139 4373 1 8 . 1 1 103 103 GLU HA H 103 3.865 3.865 3.652 0.213 25139 4374 1 8 . 1 1 103 103 GLU C C 103 176.319 176.319 175.322 0.997 25139 4375 1 8 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.375 -0.274 25139 4376 1 8 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.438 0.763 25139 4377 1 8 . 1 1 103 103 GLU H H 103 7.749 7.749 8.207 -0.458 25139 4378 1 8 . 1 1 104 104 LEU N N 104 127.294 127.294 126.203 1.091 25139 4379 1 8 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.465 -0.145 25139 4380 1 8 . 1 1 104 104 LEU C C 104 176.593 176.593 176.990 -0.397 25139 4381 1 8 . 1 1 104 104 LEU CA C 104 56.084 56.084 54.282 1.802 25139 4382 1 8 . 1 1 104 104 LEU CB C 104 42.391 42.391 43.105 -0.714 25139 4383 1 8 . 1 1 104 104 LEU H H 104 8.323 8.323 8.417 -0.094 25139 4384 1 8 . 1 1 105 105 GLN N N 105 121.361 121.361 117.986 3.375 25139 4385 1 8 . 1 1 105 105 GLN C C 105 172.868 172.868 174.376 -1.508 25139 4386 1 8 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.346 -2.940 25139 4387 1 8 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.341 2.388 25139 4388 1 8 . 1 1 105 105 GLN H H 105 8.095 8.095 8.092 0.003 25139 4389 1 8 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.470 -0.061 25139 4390 1 8 . 1 1 106 106 PRO C C 106 177.770 177.770 176.646 1.124 25139 4391 1 8 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.356 0.129 25139 4392 1 8 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.278 -0.510 25139 4393 1 8 . 1 1 107 107 ASP N N 107 116.484 116.484 116.026 0.458 25139 4394 1 8 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.552 -0.112 25139 4395 1 8 . 1 1 107 107 ASP C C 107 176.749 176.749 176.237 0.512 25139 4396 1 8 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.410 0.045 25139 4397 1 8 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.904 -1.016 25139 4398 1 8 . 1 1 107 107 ASP H H 107 8.638 8.638 8.437 0.201 25139 4399 1 8 . 1 1 108 108 ARG N N 108 117.895 117.895 120.503 -2.608 25139 4400 1 8 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.627 -0.137 25139 4401 1 8 . 1 1 108 108 ARG C C 108 176.111 176.111 176.936 -0.825 25139 4402 1 8 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.396 -0.131 25139 4403 1 8 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.026 0.050 25139 4404 1 8 . 1 1 108 108 ARG H H 108 7.905 7.905 8.348 -0.443 25139 4405 1 8 . 1 1 109 109 GLY N N 109 108.307 108.307 106.697 1.610 25139 4406 1 8 . 1 1 109 109 GLY C C 109 173.949 173.949 173.739 0.210 25139 4407 1 8 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.151 -0.600 25139 4408 1 8 . 1 1 109 109 GLY H H 109 7.753 7.753 8.063 -0.310 25139 4409 1 8 . 1 1 110 110 GLU N N 110 120.035 120.035 122.460 -2.425 25139 4410 1 8 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.332 -0.241 25139 4411 1 8 . 1 1 110 110 GLU C C 110 177.045 177.045 176.662 0.383 25139 4412 1 8 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.969 1.313 25139 4413 1 8 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.583 -0.910 25139 4414 1 8 . 1 1 110 110 GLU H H 110 8.509 8.509 8.603 -0.094 25139 4415 1 8 . 1 1 111 111 ASP N N 111 121.160 121.160 121.780 -0.620 25139 4416 1 8 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.480 0.090 25139 4417 1 8 . 1 1 111 111 ASP C C 111 175.089 175.089 175.476 -0.387 25139 4418 1 8 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.456 -1.865 25139 4419 1 8 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.891 1.541 25139 4420 1 8 . 1 1 111 111 ASP H H 111 8.916 8.916 8.562 0.354 25139 4421 1 8 . 1 1 112 112 ALA N N 112 122.130 122.130 118.988 3.142 25139 4422 1 8 . 1 1 112 112 ALA C C 112 178.120 178.120 175.960 2.160 25139 4423 1 8 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.569 2.690 25139 4424 1 8 . 1 1 112 112 ALA CB C 112 19.770 19.770 20.587 -0.817 25139 4425 1 8 . 1 1 112 112 ALA H H 112 7.361 7.361 7.784 -0.423 25139 4426 1 8 . 1 1 113 113 ILE N N 113 113.780 113.780 114.677 -0.897 25139 4427 1 8 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.744 0.142 25139 4428 1 8 . 1 1 113 113 ILE C C 113 174.258 174.258 174.820 -0.562 25139 4429 1 8 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.329 0.183 25139 4430 1 8 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.853 -0.005 25139 4431 1 8 . 1 1 113 113 ILE H H 113 7.667 7.667 8.253 -0.586 25139 4432 1 8 . 1 1 114 114 ALA N N 114 122.673 122.673 125.205 -2.532 25139 4433 1 8 . 1 1 114 114 ALA C C 114 176.984 176.984 176.741 0.243 25139 4434 1 8 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.023 -1.459 25139 4435 1 8 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.627 0.955 25139 4436 1 8 . 1 1 114 114 ALA H H 114 8.904 8.904 8.773 0.131 25139 4437 1 8 . 1 1 115 115 ALA N N 115 116.486 116.486 116.859 -0.373 25139 4438 1 8 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.441 -0.086 25139 4439 1 8 . 1 1 115 115 ALA C C 115 174.138 174.138 174.083 0.055 25139 4440 1 8 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.817 1.503 25139 4441 1 8 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.451 1.532 25139 4442 1 8 . 1 1 115 115 ALA H H 115 7.182 7.182 7.191 -0.009 25139 4443 1 8 . 1 1 116 116 CYS N N 116 120.099 120.099 119.807 0.292 25139 4444 1 8 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.090 0.241 25139 4445 1 8 . 1 1 116 116 CYS C C 116 176.609 176.609 172.524 4.085 25139 4446 1 8 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.097 -2.148 25139 4447 1 8 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.938 11.446 25139 4448 1 8 . 1 1 116 116 CYS H H 116 8.298 8.298 7.839 0.459 25139 4449 1 8 . 1 1 117 117 PHE N N 117 126.406 126.406 125.415 0.991 25139 4450 1 8 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.198 0.001 25139 4451 1 8 . 1 1 117 117 PHE C C 117 173.385 173.385 174.106 -0.721 25139 4452 1 8 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.075 0.179 25139 4453 1 8 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.194 0.487 25139 4454 1 8 . 1 1 117 117 PHE H H 117 9.712 9.712 9.034 0.678 25139 4455 1 8 . 1 1 118 118 LEU N N 118 122.119 122.119 124.701 -2.582 25139 4456 1 8 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.430 -0.264 25139 4457 1 8 . 1 1 118 118 LEU C C 118 175.097 175.097 176.414 -1.317 25139 4458 1 8 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.544 -0.640 25139 4459 1 8 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.459 -1.161 25139 4460 1 8 . 1 1 118 118 LEU H H 118 8.719 8.719 9.357 -0.638 25139 4461 1 8 . 1 1 119 119 ILE N N 119 125.324 125.324 123.228 2.096 25139 4462 1 8 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.902 -0.025 25139 4463 1 8 . 1 1 119 119 ILE C C 119 173.825 173.825 175.540 -1.715 25139 4464 1 8 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.909 -0.802 25139 4465 1 8 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.177 -0.667 25139 4466 1 8 . 1 1 119 119 ILE H H 119 8.986 8.986 9.049 -0.063 25139 4467 1 8 . 1 1 120 120 ASN N N 120 121.534 121.534 124.745 -3.211 25139 4468 1 8 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.719 0.671 25139 4469 1 8 . 1 1 120 120 ASN C C 120 176.098 176.098 176.057 0.041 25139 4470 1 8 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.485 -4.028 25139 4471 1 8 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.905 1.013 25139 4472 1 8 . 1 1 120 120 ASN H H 120 8.694 8.694 9.030 -0.336 25139 4473 1 8 . 1 1 121 121 CYS N N 121 122.779 122.779 116.294 6.485 25139 4474 1 8 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.076 0.407 25139 4475 1 8 . 1 1 121 121 CYS C C 121 173.195 173.195 173.427 -0.232 25139 4476 1 8 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.876 -4.112 25139 4477 1 8 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.390 16.317 25139 4478 1 8 . 1 1 121 121 CYS H H 121 10.668 10.668 8.578 2.090 25139 4479 1 8 . 1 1 122 122 LEU N N 122 121.063 121.063 117.462 3.601 25139 4480 1 8 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.437 -0.072 25139 4481 1 8 . 1 1 122 122 LEU C C 122 176.743 176.743 175.774 0.969 25139 4482 1 8 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.069 0.596 25139 4483 1 8 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.343 -1.109 25139 4484 1 8 . 1 1 122 122 LEU H H 122 8.256 8.256 7.672 0.584 25139 4485 1 8 . 1 1 123 123 TYR N N 123 123.081 123.081 123.548 -0.467 25139 4486 1 8 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.771 -0.728 25139 4487 1 8 . 1 1 123 123 TYR C C 123 173.633 173.633 175.104 -1.471 25139 4488 1 8 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.157 -0.269 25139 4489 1 8 . 1 1 123 123 TYR CB C 123 41.081 41.081 42.091 -1.010 25139 4490 1 8 . 1 1 123 123 TYR H H 123 8.990 8.990 8.977 0.013 25139 4491 1 8 . 1 1 124 124 GLU N N 124 128.742 128.742 126.829 1.913 25139 4492 1 8 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.708 -0.158 25139 4493 1 8 . 1 1 124 124 GLU C C 124 174.835 174.835 175.427 -0.592 25139 4494 1 8 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.362 0.270 25139 4495 1 8 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.930 -1.034 25139 4496 1 8 . 1 1 124 124 GLU H H 124 9.135 9.135 8.703 0.432 25139 4497 1 8 . 1 1 125 125 GLN N N 125 108.066 108.066 109.268 -1.202 25139 4498 1 8 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.889 -0.168 25139 4499 1 8 . 1 1 125 125 GLN C C 125 174.627 174.627 174.684 -0.057 25139 4500 1 8 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.819 0.220 25139 4501 1 8 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.735 -0.407 25139 4502 1 8 . 1 1 125 125 GLN H H 125 8.390 8.390 8.397 -0.007 25139 4503 1 8 . 1 1 126 126 ASN N N 126 118.528 118.528 117.575 0.953 25139 4504 1 8 . 1 1 126 126 ASN C C 126 173.713 173.713 174.731 -1.018 25139 4505 1 8 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.876 -0.687 25139 4506 1 8 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.645 1.155 25139 4507 1 8 . 1 1 126 126 ASN H H 126 8.092 8.092 7.967 0.125 25139 4508 1 8 . 1 1 127 127 PHE N N 127 124.680 124.680 121.943 2.737 25139 4509 1 8 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.783 0.254 25139 4510 1 8 . 1 1 127 127 PHE C C 127 177.125 177.125 176.578 0.547 25139 4511 1 8 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.210 1.203 25139 4512 1 8 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.071 1.173 25139 4513 1 8 . 1 1 127 127 PHE H H 127 9.026 9.026 8.845 0.181 25139 4514 1 8 . 1 1 128 128 VAL N N 128 119.455 119.455 117.631 1.824 25139 4515 1 8 . 1 1 128 128 VAL C C 128 175.886 175.886 176.086 -0.200 25139 4516 1 8 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.845 -0.926 25139 4517 1 8 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.214 1.980 25139 4518 1 8 . 1 1 128 128 VAL H H 128 8.364 8.364 7.627 0.737 25139 4519 1 8 . 1 1 129 129 CYS N N 129 116.130 116.130 120.628 -4.498 25139 4520 1 8 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.908 -0.431 25139 4521 1 8 . 1 1 129 129 CYS C C 129 170.569 170.569 173.971 -3.402 25139 4522 1 8 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.762 -3.612 25139 4523 1 8 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.973 18.644 25139 4524 1 8 . 1 1 129 129 CYS H H 129 5.390 5.390 7.184 -1.794 25139 4525 1 8 . 1 1 130 130 LYS N N 130 120.071 120.071 124.871 -4.800 25139 4526 1 8 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.156 0.405 25139 4527 1 8 . 1 1 130 130 LYS C C 130 176.853 176.853 174.595 2.258 25139 4528 1 8 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.651 -0.764 25139 4529 1 8 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.207 1.435 25139 4530 1 8 . 1 1 130 130 LYS H H 130 8.066 8.066 7.763 0.303 25139 4531 1 8 . 1 1 131 131 PHE N N 131 118.415 118.415 120.018 -1.603 25139 4532 1 8 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.434 -0.827 25139 4533 1 8 . 1 1 131 131 PHE C C 131 174.013 174.013 175.261 -1.248 25139 4534 1 8 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.275 1.436 25139 4535 1 8 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.287 0.793 25139 4536 1 8 . 1 1 131 131 PHE H H 131 8.714 8.714 8.252 0.462 25139 4537 1 8 . 1 1 132 132 ALA N N 132 124.209 124.209 122.974 1.235 25139 4538 1 8 . 1 1 132 132 ALA HA H 132 4.617 4.617 4.988 -0.371 25139 4539 1 8 . 1 1 132 132 ALA C C 132 174.352 174.352 174.292 0.060 25139 4540 1 8 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.659 1.782 25139 4541 1 8 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.828 -0.364 25139 4542 1 8 . 1 1 132 132 ALA H H 132 9.295 9.295 8.983 0.312 25139 4543 1 8 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.432 -0.549 25139 4544 1 8 . 1 1 133 133 PRO C C 133 173.923 173.923 176.451 -2.528 25139 4545 1 8 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.756 0.315 25139 4546 1 8 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.346 -0.743 25139 4547 1 8 . 1 1 134 134 ARG N N 134 126.071 126.071 123.034 3.037 25139 4548 1 8 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.696 -0.441 25139 4549 1 8 . 1 1 134 134 ARG C C 134 177.065 177.065 174.617 2.448 25139 4550 1 8 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.543 1.621 25139 4551 1 8 . 1 1 134 134 ARG CB C 134 32.183 32.183 34.505 -2.322 25139 4552 1 8 . 1 1 134 134 ARG H H 134 8.672 8.672 8.843 -0.171 25139 4553 1 8 . 1 1 135 135 GLU N N 135 125.683 125.683 122.859 2.824 25139 4554 1 8 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.602 -0.249 25139 4555 1 8 . 1 1 135 135 GLU C C 135 178.081 178.081 176.482 1.599 25139 4556 1 8 . 1 1 135 135 GLU CA C 135 57.651 57.651 56.567 1.084 25139 4557 1 8 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.912 -0.916 25139 4558 1 8 . 1 1 135 135 GLU H H 135 8.603 8.603 8.756 -0.153 25139 4559 1 8 . 1 1 136 136 GLY N N 136 110.031 110.031 111.530 -1.499 25139 4560 1 8 . 1 1 136 136 GLY C C 136 173.079 173.079 173.170 -0.091 25139 4561 1 8 . 1 1 136 136 GLY CA C 136 45.778 45.778 45.291 0.487 25139 4562 1 8 . 1 1 136 136 GLY H H 136 9.036 9.036 8.948 0.088 25139 4563 1 8 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.625 0.050 25139 4564 1 8 . 1 1 137 137 PHE C C 137 174.936 174.936 174.320 0.616 25139 4565 1 8 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.352 -0.268 25139 4566 1 8 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.848 1.848 25139 4567 1 8 . 1 1 138 138 ILE N N 138 117.417 117.417 115.152 2.265 25139 4568 1 8 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.687 -0.180 25139 4569 1 8 . 1 1 138 138 ILE C C 138 173.858 173.858 173.174 0.684 25139 4570 1 8 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.727 0.893 25139 4571 1 8 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.355 1.242 25139 4572 1 8 . 1 1 138 138 ILE H H 138 8.777 8.777 8.338 0.439 25139 4573 1 8 . 1 1 139 139 ASN N N 139 117.201 117.201 117.042 0.159 25139 4574 1 8 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.498 0.561 25139 4575 1 8 . 1 1 139 139 ASN C C 139 173.721 173.721 174.203 -0.482 25139 4576 1 8 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.829 -1.599 25139 4577 1 8 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.396 1.465 25139 4578 1 8 . 1 1 139 139 ASN H H 139 8.872 8.872 8.281 0.591 25139 4579 1 8 . 1 1 140 140 TYR N N 140 123.991 123.991 120.339 3.652 25139 4580 1 8 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.766 0.412 25139 4581 1 8 . 1 1 140 140 TYR C C 140 174.791 174.791 175.260 -0.469 25139 4582 1 8 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.737 -1.665 25139 4583 1 8 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.636 2.034 25139 4584 1 8 . 1 1 140 140 TYR H H 140 9.526 9.526 8.908 0.618 25139 4585 1 8 . 1 1 141 141 LEU N N 141 122.779 122.779 120.307 2.472 25139 4586 1 8 . 1 1 141 141 LEU C C 141 175.404 175.404 177.586 -2.182 25139 4587 1 8 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.778 2.325 25139 4588 1 8 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.128 -0.967 25139 4589 1 8 . 1 1 141 141 LEU H H 141 9.010 9.010 9.050 -0.040 25139 4590 1 8 . 1 1 142 142 THR N N 142 113.189 113.189 112.926 0.263 25139 4591 1 8 . 1 1 142 142 THR HA H 142 4.061 4.061 4.067 -0.006 25139 4592 1 8 . 1 1 142 142 THR C C 142 175.940 175.940 176.303 -0.363 25139 4593 1 8 . 1 1 142 142 THR CA C 142 61.389 61.389 60.673 0.716 25139 4594 1 8 . 1 1 142 142 THR CB C 142 69.779 69.779 70.034 -0.255 25139 4595 1 8 . 1 1 142 142 THR H H 142 7.737 7.737 8.173 -0.436 25139 4596 1 8 . 1 1 143 143 ARG N N 143 120.975 120.975 120.346 0.629 25139 4597 1 8 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.048 -0.110 25139 4598 1 8 . 1 1 143 143 ARG C C 143 178.690 178.690 177.139 1.551 25139 4599 1 8 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.235 1.513 25139 4600 1 8 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.513 0.632 25139 4601 1 8 . 1 1 143 143 ARG H H 143 8.149 8.149 8.344 -0.195 25139 4602 1 8 . 1 1 144 144 GLU N N 144 116.997 116.997 117.666 -0.669 25139 4603 1 8 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.341 -0.232 25139 4604 1 8 . 1 1 144 144 GLU C C 144 178.442 178.442 177.587 0.855 25139 4605 1 8 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.210 1.653 25139 4606 1 8 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.910 -0.328 25139 4607 1 8 . 1 1 144 144 GLU H H 144 8.622 8.622 7.595 1.027 25139 4608 1 8 . 1 1 145 145 VAL N N 145 111.213 111.213 119.424 -8.211 25139 4609 1 8 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.950 0.461 25139 4610 1 8 . 1 1 145 145 VAL C C 145 176.965 176.965 176.592 0.373 25139 4611 1 8 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.259 -0.665 25139 4612 1 8 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.843 -0.761 25139 4613 1 8 . 1 1 145 145 VAL H H 145 7.227 7.227 7.603 -0.376 25139 4614 1 8 . 1 1 146 146 TYR N N 146 123.512 123.512 121.669 1.843 25139 4615 1 8 . 1 1 146 146 TYR HA H 146 3.880 3.880 3.990 -0.110 25139 4616 1 8 . 1 1 146 146 TYR C C 146 176.377 176.377 177.078 -0.701 25139 4617 1 8 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.404 0.133 25139 4618 1 8 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.501 -0.162 25139 4619 1 8 . 1 1 146 146 TYR H H 146 8.492 8.492 8.848 -0.356 25139 4620 1 8 . 1 1 147 147 ARG N N 147 116.680 116.680 116.898 -0.218 25139 4621 1 8 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.813 0.001 25139 4622 1 8 . 1 1 147 147 ARG C C 147 178.858 178.858 177.997 0.861 25139 4623 1 8 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.707 -0.011 25139 4624 1 8 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.667 -0.002 25139 4625 1 8 . 1 1 147 147 ARG H H 147 8.053 8.053 8.755 -0.702 25139 4626 1 8 . 1 1 148 148 SER N N 148 115.306 115.306 113.949 1.357 25139 4627 1 8 . 1 1 148 148 SER HA H 148 3.998 3.998 4.131 -0.133 25139 4628 1 8 . 1 1 148 148 SER C C 148 175.786 175.786 175.947 -0.161 25139 4629 1 8 . 1 1 148 148 SER CA C 148 62.006 62.006 59.938 2.068 25139 4630 1 8 . 1 1 148 148 SER H H 148 7.139 7.139 7.450 -0.311 25139 4631 1 8 . 1 1 149 149 TYR N N 149 123.207 123.207 122.286 0.921 25139 4632 1 8 . 1 1 149 149 TYR C C 149 175.831 175.831 177.911 -2.080 25139 4633 1 8 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.372 -0.772 25139 4634 1 8 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.340 0.440 25139 4635 1 8 . 1 1 149 149 TYR H H 149 7.253 7.253 7.571 -0.318 25139 4636 1 8 . 1 1 150 150 ARG N N 150 118.708 118.708 117.788 0.920 25139 4637 1 8 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.930 -0.584 25139 4638 1 8 . 1 1 150 150 ARG C C 150 177.644 177.644 177.856 -0.212 25139 4639 1 8 . 1 1 150 150 ARG CA C 150 57.323 57.323 58.208 -0.885 25139 4640 1 8 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.466 -0.612 25139 4641 1 8 . 1 1 150 150 ARG H H 150 8.441 8.441 7.603 0.838 25139 4642 1 8 . 1 1 151 151 GLN N N 151 116.551 116.551 114.794 1.757 25139 4643 1 8 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.085 -0.128 25139 4644 1 8 . 1 1 151 151 GLN C C 151 177.987 177.987 176.986 1.001 25139 4645 1 8 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.570 0.771 25139 4646 1 8 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.232 0.232 25139 4647 1 8 . 1 1 151 151 GLN H H 151 7.332 7.332 7.634 -0.302 25139 4648 1 8 . 1 1 152 152 LEU N N 152 118.877 118.877 113.140 5.737 25139 4649 1 8 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.607 -0.428 25139 4650 1 8 . 1 1 152 152 LEU C C 152 179.070 179.070 177.386 1.684 25139 4651 1 8 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.733 1.349 25139 4652 1 8 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.320 -0.632 25139 4653 1 8 . 1 1 152 152 LEU H H 152 7.106 7.106 7.240 -0.134 25139 4654 1 8 . 1 1 153 153 VAL N N 153 119.076 119.076 113.069 6.007 25139 4655 1 8 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.999 -1.139 25139 4656 1 8 . 1 1 153 153 VAL C C 153 177.421 177.421 175.717 1.704 25139 4657 1 8 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.779 2.804 25139 4658 1 8 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.217 -1.699 25139 4659 1 8 . 1 1 153 153 VAL H H 153 7.427 7.427 7.128 0.299 25139 4660 1 8 . 1 1 154 154 ASP N N 154 119.888 119.888 123.788 -3.900 25139 4661 1 8 . 1 1 154 154 ASP C C 154 177.422 177.422 175.710 1.712 25139 4662 1 8 . 1 1 154 154 ASP CA C 154 56.071 56.071 53.986 2.085 25139 4663 1 8 . 1 1 154 154 ASP CB C 154 40.349 40.349 38.847 1.502 25139 4664 1 8 . 1 1 154 154 ASP H H 154 7.930 7.930 7.738 0.192 25139 4665 1 8 . 1 1 155 155 HIS N N 155 117.821 117.821 121.167 -3.346 25139 4666 1 8 . 1 1 155 155 HIS CA C 155 57.756 57.756 56.170 1.586 25139 4667 1 8 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.372 -0.192 25139 4668 1 8 . 1 1 155 155 HIS H H 155 7.680 7.680 7.890 -0.210 25139 4669 1 8 . 1 1 156 156 HIS N N 156 119.180 119.180 120.907 -1.727 25139 4670 1 8 . 1 1 156 156 HIS CA C 156 57.931 57.931 57.141 0.790 25139 4671 1 8 . 1 1 156 156 HIS CB C 156 30.300 30.300 29.897 0.403 25139 4672 1 8 . 1 1 156 156 HIS H H 156 7.868 7.868 8.710 -0.842 25139 4673 1 9 . 1 1 48 48 ALA CA C 48 52.904 52.904 54.503 -1.599 25139 4674 1 9 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.952 0.270 25139 4675 1 9 . 1 1 49 49 ASP N N 49 119.661 119.661 118.947 0.714 25139 4676 1 9 . 1 1 49 49 ASP CA C 49 54.277 54.277 55.372 -1.095 25139 4677 1 9 . 1 1 49 49 ASP CB C 49 41.062 41.062 40.514 0.548 25139 4678 1 9 . 1 1 49 49 ASP H H 49 8.462 8.462 8.588 -0.126 25139 4679 1 9 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.184 -0.132 25139 4680 1 9 . 1 1 51 51 LEU C C 51 178.514 178.514 177.612 0.902 25139 4681 1 9 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.985 1.064 25139 4682 1 9 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.497 -0.304 25139 4683 1 9 . 1 1 52 52 ASN N N 52 113.819 113.819 114.202 -0.383 25139 4684 1 9 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.834 0.001 25139 4685 1 9 . 1 1 52 52 ASN C C 52 175.964 175.964 175.602 0.362 25139 4686 1 9 . 1 1 52 52 ASN CA C 52 54.096 54.096 54.045 0.051 25139 4687 1 9 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.450 -0.567 25139 4688 1 9 . 1 1 52 52 ASN H H 52 7.853 7.853 7.755 0.098 25139 4689 1 9 . 1 1 53 53 SER N N 53 114.357 114.357 115.726 -1.369 25139 4690 1 9 . 1 1 53 53 SER CA C 53 59.908 59.908 60.005 -0.097 25139 4691 1 9 . 1 1 53 53 SER CB C 53 64.395 64.395 63.974 0.421 25139 4692 1 9 . 1 1 53 53 SER H H 53 8.023 8.023 7.785 0.238 25139 4693 1 9 . 1 1 54 54 PHE N N 54 121.037 121.037 121.183 -0.146 25139 4694 1 9 . 1 1 54 54 PHE C C 54 175.522 175.522 176.095 -0.573 25139 4695 1 9 . 1 1 54 54 PHE CA C 54 58.064 58.064 59.538 -1.474 25139 4696 1 9 . 1 1 54 54 PHE CB C 54 43.053 43.053 40.402 2.651 25139 4697 1 9 . 1 1 54 54 PHE H H 54 7.731 7.731 8.147 -0.416 25139 4698 1 9 . 1 1 55 55 THR N N 55 116.535 116.535 119.099 -2.564 25139 4699 1 9 . 1 1 55 55 THR HA H 55 4.654 4.654 4.672 -0.018 25139 4700 1 9 . 1 1 55 55 THR C C 55 173.301 173.301 173.265 0.036 25139 4701 1 9 . 1 1 55 55 THR CA C 55 61.420 61.420 61.013 0.407 25139 4702 1 9 . 1 1 55 55 THR CB C 55 71.388 71.388 71.165 0.223 25139 4703 1 9 . 1 1 55 55 THR H H 55 8.929 8.929 9.203 -0.274 25139 4704 1 9 . 1 1 56 56 ALA N N 56 129.359 129.359 129.476 -0.117 25139 4705 1 9 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.082 0.233 25139 4706 1 9 . 1 1 56 56 ALA C C 56 178.305 178.305 177.245 1.060 25139 4707 1 9 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.738 1.133 25139 4708 1 9 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.185 0.139 25139 4709 1 9 . 1 1 56 56 ALA H H 56 8.907 8.907 8.707 0.200 25139 4710 1 9 . 1 1 57 57 GLY N N 57 106.331 106.331 109.691 -3.360 25139 4711 1 9 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.939 0.672 25139 4712 1 9 . 1 1 57 57 GLY H H 57 7.978 7.978 8.202 -0.224 25139 4713 1 9 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.357 -0.033 25139 4714 1 9 . 1 1 59 59 PRO C C 59 177.466 177.466 177.392 0.074 25139 4715 1 9 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.132 1.352 25139 4716 1 9 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.042 -0.307 25139 4717 1 9 . 1 1 60 60 GLY N N 60 109.688 109.688 108.628 1.060 25139 4718 1 9 . 1 1 60 60 GLY C C 60 173.555 173.555 173.138 0.417 25139 4719 1 9 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.844 0.696 25139 4720 1 9 . 1 1 60 60 GLY H H 60 8.402 8.402 8.763 -0.361 25139 4721 1 9 . 1 1 61 61 PHE N N 61 122.491 122.491 121.401 1.090 25139 4722 1 9 . 1 1 61 61 PHE C C 61 175.146 175.146 174.318 0.828 25139 4723 1 9 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.913 1.369 25139 4724 1 9 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.383 -2.684 25139 4725 1 9 . 1 1 61 61 PHE H H 61 7.957 7.957 7.310 0.647 25139 4726 1 9 . 1 1 62 62 VAL N N 62 121.128 121.128 116.092 5.036 25139 4727 1 9 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.354 -0.269 25139 4728 1 9 . 1 1 62 62 VAL C C 62 174.937 174.937 174.856 0.081 25139 4729 1 9 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.328 0.380 25139 4730 1 9 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.853 0.579 25139 4731 1 9 . 1 1 62 62 VAL H H 62 7.994 7.994 9.185 -1.191 25139 4732 1 9 . 1 1 63 63 LEU N N 63 124.386 124.386 122.423 1.963 25139 4733 1 9 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.714 -1.398 25139 4734 1 9 . 1 1 63 63 LEU C C 63 175.278 175.278 176.335 -1.057 25139 4735 1 9 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.577 0.711 25139 4736 1 9 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.303 1.815 25139 4737 1 9 . 1 1 63 63 LEU H H 63 7.572 7.572 8.834 -1.262 25139 4738 1 9 . 1 1 64 64 ASP N N 64 126.746 126.746 128.010 -1.264 25139 4739 1 9 . 1 1 64 64 ASP C C 64 177.801 177.801 176.008 1.793 25139 4740 1 9 . 1 1 64 64 ASP CA C 64 51.721 51.721 53.778 -2.057 25139 4741 1 9 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.833 -0.435 25139 4742 1 9 . 1 1 64 64 ASP H H 64 8.552 8.552 8.349 0.203 25139 4743 1 9 . 1 1 65 65 THR C C 65 175.002 175.002 175.516 -0.514 25139 4744 1 9 . 1 1 65 65 THR CB C 65 67.919 67.919 68.610 -0.691 25139 4745 1 9 . 1 1 66 66 GLN N N 66 120.804 120.804 119.165 1.639 25139 4746 1 9 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.178 -0.301 25139 4747 1 9 . 1 1 66 66 GLN C C 66 178.901 178.901 175.893 3.008 25139 4748 1 9 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.839 1.577 25139 4749 1 9 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.703 0.221 25139 4750 1 9 . 1 1 66 66 GLN H H 66 8.447 8.447 8.308 0.139 25139 4751 1 9 . 1 1 67 67 ALA N N 67 121.267 121.267 121.279 -0.012 25139 4752 1 9 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.335 -0.378 25139 4753 1 9 . 1 1 67 67 ALA C C 67 176.777 176.777 178.654 -1.877 25139 4754 1 9 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.597 0.727 25139 4755 1 9 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.588 -0.968 25139 4756 1 9 . 1 1 67 67 ALA H H 67 7.791 7.791 7.366 0.425 25139 4757 1 9 . 1 1 68 68 SER N N 68 113.339 113.339 114.435 -1.096 25139 4758 1 9 . 1 1 68 68 SER HA H 68 4.061 4.061 4.157 -0.096 25139 4759 1 9 . 1 1 68 68 SER C C 68 175.875 175.875 176.346 -0.471 25139 4760 1 9 . 1 1 68 68 SER CA C 68 62.970 62.970 61.923 1.047 25139 4761 1 9 . 1 1 68 68 SER CB C 68 61.330 61.330 63.789 -2.459 25139 4762 1 9 . 1 1 68 68 SER H H 68 7.785 7.785 7.860 -0.075 25139 4763 1 9 . 1 1 69 69 VAL N N 69 125.140 125.140 117.234 7.906 25139 4764 1 9 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.129 -0.053 25139 4765 1 9 . 1 1 69 69 VAL C C 69 176.384 176.384 176.602 -0.218 25139 4766 1 9 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.365 1.366 25139 4767 1 9 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.684 -0.195 25139 4768 1 9 . 1 1 69 69 VAL H H 69 8.572 8.572 8.012 0.560 25139 4769 1 9 . 1 1 70 70 SER N N 70 116.704 116.704 112.931 3.773 25139 4770 1 9 . 1 1 70 70 SER HA H 70 4.229 4.229 4.229 -0.000 25139 4771 1 9 . 1 1 70 70 SER C C 70 174.101 174.101 175.165 -1.064 25139 4772 1 9 . 1 1 70 70 SER CA C 70 61.627 61.627 59.233 2.394 25139 4773 1 9 . 1 1 70 70 SER H H 70 7.951 7.951 7.973 -0.022 25139 4774 1 9 . 1 1 71 71 ASN N N 71 117.576 117.576 117.083 0.493 25139 4775 1 9 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.661 0.141 25139 4776 1 9 . 1 1 71 71 ASN C C 71 174.332 174.332 174.798 -0.466 25139 4777 1 9 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.845 -0.406 25139 4778 1 9 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.844 0.623 25139 4779 1 9 . 1 1 71 71 ASN H H 71 7.131 7.131 7.477 -0.346 25139 4780 1 9 . 1 1 72 72 GLY N N 72 103.925 103.925 105.407 -1.482 25139 4781 1 9 . 1 1 72 72 GLY C C 72 174.710 174.710 173.497 1.213 25139 4782 1 9 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.466 0.083 25139 4783 1 9 . 1 1 72 72 GLY H H 72 7.338 7.338 7.343 -0.005 25139 4784 1 9 . 1 1 73 73 ALA N N 73 124.942 124.942 123.081 1.861 25139 4785 1 9 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.537 -0.365 25139 4786 1 9 . 1 1 73 73 ALA C C 73 175.896 175.896 176.231 -0.335 25139 4787 1 9 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.845 0.828 25139 4788 1 9 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.118 -0.062 25139 4789 1 9 . 1 1 73 73 ALA H H 73 8.032 8.032 7.841 0.191 25139 4790 1 9 . 1 1 74 74 THR N N 74 113.423 113.423 115.982 -2.559 25139 4791 1 9 . 1 1 74 74 THR HA H 74 4.678 4.678 4.562 0.116 25139 4792 1 9 . 1 1 74 74 THR C C 74 173.339 173.339 173.061 0.278 25139 4793 1 9 . 1 1 74 74 THR CA C 74 61.545 61.545 61.586 -0.041 25139 4794 1 9 . 1 1 74 74 THR CB C 74 71.319 71.319 71.473 -0.154 25139 4795 1 9 . 1 1 74 74 THR H H 74 8.530 8.530 8.289 0.241 25139 4796 1 9 . 1 1 75 75 PHE N N 75 128.180 128.180 129.969 -1.789 25139 4797 1 9 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.838 -0.234 25139 4798 1 9 . 1 1 75 75 PHE C C 75 174.623 174.623 175.018 -0.395 25139 4799 1 9 . 1 1 75 75 PHE CA C 75 57.616 57.616 56.538 1.078 25139 4800 1 9 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.629 0.046 25139 4801 1 9 . 1 1 75 75 PHE H H 75 9.146 9.146 9.134 0.012 25139 4802 1 9 . 1 1 76 76 LEU N N 76 127.849 127.849 126.147 1.702 25139 4803 1 9 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.622 -0.271 25139 4804 1 9 . 1 1 76 76 LEU C C 76 176.339 176.339 176.388 -0.049 25139 4805 1 9 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.394 0.589 25139 4806 1 9 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.611 -0.281 25139 4807 1 9 . 1 1 76 76 LEU H H 76 8.635 8.635 8.352 0.283 25139 4808 1 9 . 1 1 77 77 GLU N N 77 115.131 115.131 120.381 -5.250 25139 4809 1 9 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.499 -0.091 25139 4810 1 9 . 1 1 77 77 GLU C C 77 174.734 174.734 174.742 -0.008 25139 4811 1 9 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.206 1.147 25139 4812 1 9 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.845 0.362 25139 4813 1 9 . 1 1 77 77 GLU H H 77 7.252 7.252 7.720 -0.468 25139 4814 1 9 . 1 1 78 78 SER N N 78 118.016 118.016 119.275 -1.259 25139 4815 1 9 . 1 1 78 78 SER HA H 78 5.561 5.561 5.188 0.373 25139 4816 1 9 . 1 1 78 78 SER C C 78 171.968 171.968 172.699 -0.731 25139 4817 1 9 . 1 1 78 78 SER CA C 78 54.061 54.061 55.201 -1.140 25139 4818 1 9 . 1 1 78 78 SER CB C 78 64.074 64.074 63.282 0.792 25139 4819 1 9 . 1 1 78 78 SER H H 78 9.033 9.033 8.593 0.440 25139 4820 1 9 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.028 -0.428 25139 4821 1 9 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.250 0.160 25139 4822 1 9 . 1 1 80 80 THR N N 80 118.079 118.079 114.901 3.178 25139 4823 1 9 . 1 1 80 80 THR HA H 80 4.342 4.342 4.284 0.058 25139 4824 1 9 . 1 1 80 80 THR C C 80 174.494 174.494 174.323 0.171 25139 4825 1 9 . 1 1 80 80 THR CA C 80 61.453 61.453 60.354 1.099 25139 4826 1 9 . 1 1 80 80 THR CB C 80 67.797 67.797 68.242 -0.445 25139 4827 1 9 . 1 1 80 80 THR H H 80 8.670 8.670 8.218 0.452 25139 4828 1 9 . 1 1 81 81 VAL N N 81 117.395 117.395 116.934 0.461 25139 4829 1 9 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.964 0.643 25139 4830 1 9 . 1 1 81 81 VAL C C 81 175.518 175.518 175.279 0.239 25139 4831 1 9 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.166 -3.052 25139 4832 1 9 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.871 1.724 25139 4833 1 9 . 1 1 81 81 VAL H H 81 7.448 7.448 7.334 0.114 25139 4834 1 9 . 1 1 82 82 ARG N N 82 117.852 117.852 118.907 -1.055 25139 4835 1 9 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.867 -0.346 25139 4836 1 9 . 1 1 82 82 ARG C C 82 176.992 176.992 175.369 1.623 25139 4837 1 9 . 1 1 82 82 ARG CA C 82 56.385 56.385 54.650 1.735 25139 4838 1 9 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.450 1.152 25139 4839 1 9 . 1 1 82 82 ARG H H 82 8.710 8.710 8.723 -0.013 25139 4840 1 9 . 1 1 83 83 ARG N N 83 117.035 117.035 118.531 -1.496 25139 4841 1 9 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.788 0.534 25139 4842 1 9 . 1 1 83 83 ARG C C 83 177.379 177.379 176.223 1.156 25139 4843 1 9 . 1 1 83 83 ARG CA C 83 53.684 53.684 55.032 -1.348 25139 4844 1 9 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.288 -1.247 25139 4845 1 9 . 1 1 83 83 ARG H H 83 7.292 7.292 7.691 -0.399 25139 4846 1 9 . 1 1 84 84 GLY N N 84 114.911 114.911 110.440 4.471 25139 4847 1 9 . 1 1 84 84 GLY C C 84 176.940 176.940 175.075 1.865 25139 4848 1 9 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.783 1.889 25139 4849 1 9 . 1 1 84 84 GLY H H 84 9.255 9.255 8.409 0.846 25139 4850 1 9 . 1 1 85 85 TRP N N 85 121.810 121.810 119.827 1.983 25139 4851 1 9 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.253 -0.086 25139 4852 1 9 . 1 1 85 85 TRP C C 85 178.272 178.272 177.524 0.748 25139 4853 1 9 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.975 1.070 25139 4854 1 9 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.199 0.018 25139 4855 1 9 . 1 1 85 85 TRP H H 85 9.963 9.963 8.074 1.889 25139 4856 1 9 . 1 1 86 86 ASP N N 86 116.400 116.400 120.127 -3.727 25139 4857 1 9 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.502 -0.109 25139 4858 1 9 . 1 1 86 86 ASP C C 86 178.803 178.803 178.023 0.780 25139 4859 1 9 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.794 0.261 25139 4860 1 9 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.346 0.387 25139 4861 1 9 . 1 1 86 86 ASP H H 86 6.934 6.934 7.649 -0.715 25139 4862 1 9 . 1 1 87 87 CYS N N 87 122.454 122.454 119.471 2.983 25139 4863 1 9 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.193 0.057 25139 4864 1 9 . 1 1 87 87 CYS C C 87 174.956 174.956 176.445 -1.489 25139 4865 1 9 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.115 -3.968 25139 4866 1 9 . 1 1 87 87 CYS CB C 87 37.485 37.485 25.913 11.572 25139 4867 1 9 . 1 1 87 87 CYS H H 87 7.603 7.603 7.442 0.161 25139 4868 1 9 . 1 1 88 88 VAL N N 88 119.192 119.192 120.845 -1.653 25139 4869 1 9 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.147 -0.689 25139 4870 1 9 . 1 1 88 88 VAL C C 88 177.413 177.413 177.803 -0.390 25139 4871 1 9 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.378 0.598 25139 4872 1 9 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.119 -0.877 25139 4873 1 9 . 1 1 88 88 VAL H H 88 7.192 7.192 7.403 -0.211 25139 4874 1 9 . 1 1 89 89 ARG N N 89 118.185 118.185 118.110 0.075 25139 4875 1 9 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.956 -0.276 25139 4876 1 9 . 1 1 89 89 ARG C C 89 178.677 178.677 177.337 1.340 25139 4877 1 9 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.832 1.123 25139 4878 1 9 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.547 0.244 25139 4879 1 9 . 1 1 89 89 ARG H H 89 7.971 7.971 8.008 -0.037 25139 4880 1 9 . 1 1 90 90 ALA N N 90 120.815 120.815 121.486 -0.671 25139 4881 1 9 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.176 -0.101 25139 4882 1 9 . 1 1 90 90 ALA C C 90 177.416 177.416 178.624 -1.208 25139 4883 1 9 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.289 -0.035 25139 4884 1 9 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.886 -1.450 25139 4885 1 9 . 1 1 90 90 ALA H H 90 7.453 7.453 7.349 0.104 25139 4886 1 9 . 1 1 91 91 CYS N N 91 120.380 120.380 116.451 3.929 25139 4887 1 9 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.218 0.153 25139 4888 1 9 . 1 1 91 91 CYS C C 91 176.654 176.654 175.814 0.840 25139 4889 1 9 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.881 -4.186 25139 4890 1 9 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.207 12.497 25139 4891 1 9 . 1 1 91 91 CYS H H 91 7.944 7.944 7.573 0.371 25139 4892 1 9 . 1 1 92 92 CYS N N 92 116.270 116.270 116.457 -0.187 25139 4893 1 9 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.474 -0.070 25139 4894 1 9 . 1 1 92 92 CYS C C 92 175.628 175.628 176.288 -0.660 25139 4895 1 9 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.111 -1.405 25139 4896 1 9 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.597 15.552 25139 4897 1 9 . 1 1 92 92 CYS H H 92 8.315 8.315 7.621 0.694 25139 4898 1 9 . 1 1 93 93 THR N N 93 107.283 107.283 112.543 -5.260 25139 4899 1 9 . 1 1 93 93 THR HA H 93 4.481 4.481 4.398 0.083 25139 4900 1 9 . 1 1 93 93 THR C C 93 173.606 173.606 175.143 -1.537 25139 4901 1 9 . 1 1 93 93 THR CA C 93 61.402 61.402 63.124 -1.722 25139 4902 1 9 . 1 1 93 93 THR CB C 93 69.046 69.046 70.028 -0.982 25139 4903 1 9 . 1 1 93 93 THR H H 93 7.445 7.445 7.736 -0.291 25139 4904 1 9 . 1 1 94 94 THR N N 94 121.432 121.432 121.820 -0.388 25139 4905 1 9 . 1 1 94 94 THR HA H 94 4.398 4.398 4.438 -0.040 25139 4906 1 9 . 1 1 94 94 THR C C 94 173.493 173.493 175.003 -1.510 25139 4907 1 9 . 1 1 94 94 THR CA C 94 62.726 62.726 63.081 -0.355 25139 4908 1 9 . 1 1 94 94 THR CB C 94 69.704 69.704 68.460 1.244 25139 4909 1 9 . 1 1 94 94 THR H H 94 7.553 7.553 7.988 -0.435 25139 4910 1 9 . 1 1 95 95 GLN N N 95 129.410 129.410 128.007 1.403 25139 4911 1 9 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.999 -0.055 25139 4912 1 9 . 1 1 95 95 GLN C C 95 176.293 176.293 176.330 -0.037 25139 4913 1 9 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.644 -0.604 25139 4914 1 9 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.932 -0.676 25139 4915 1 9 . 1 1 95 95 GLN H H 95 8.812 8.812 8.983 -0.171 25139 4916 1 9 . 1 1 96 96 ASN N N 96 115.015 115.015 114.555 0.460 25139 4917 1 9 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.845 -0.646 25139 4918 1 9 . 1 1 96 96 ASN C C 96 172.260 172.260 173.686 -1.426 25139 4919 1 9 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.029 2.538 25139 4920 1 9 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.831 -1.994 25139 4921 1 9 . 1 1 96 96 ASN H H 96 8.791 8.791 8.164 0.627 25139 4922 1 9 . 1 1 97 97 CYS N N 97 115.830 115.830 121.087 -5.257 25139 4923 1 9 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.427 -0.326 25139 4924 1 9 . 1 1 97 97 CYS C C 97 175.025 175.025 173.815 1.210 25139 4925 1 9 . 1 1 97 97 CYS CA C 97 58.148 58.148 60.019 -1.871 25139 4926 1 9 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.137 16.097 25139 4927 1 9 . 1 1 97 97 CYS H H 97 7.651 7.651 7.815 -0.164 25139 4928 1 9 . 1 1 98 98 ASN N N 98 125.148 125.148 124.849 0.299 25139 4929 1 9 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.061 0.072 25139 4930 1 9 . 1 1 98 98 ASN C C 98 171.892 171.892 174.640 -2.748 25139 4931 1 9 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.943 -0.749 25139 4932 1 9 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.733 -1.785 25139 4933 1 9 . 1 1 98 98 ASN H H 98 8.736 8.736 8.336 0.400 25139 4934 1 9 . 1 1 99 99 LEU N N 99 120.898 120.898 121.137 -0.239 25139 4935 1 9 . 1 1 99 99 LEU C C 99 173.084 173.084 173.872 -0.788 25139 4936 1 9 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.511 2.609 25139 4937 1 9 . 1 1 99 99 LEU CB C 99 44.328 44.328 46.078 -1.750 25139 4938 1 9 . 1 1 99 99 LEU H H 99 8.200 8.200 8.291 -0.091 25139 4939 1 9 . 1 1 100 100 ALA N N 100 128.085 128.085 129.016 -0.931 25139 4940 1 9 . 1 1 100 100 ALA C C 100 174.938 174.938 175.280 -0.342 25139 4941 1 9 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.375 -0.628 25139 4942 1 9 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.406 0.308 25139 4943 1 9 . 1 1 100 100 ALA H H 100 9.156 9.156 9.292 -0.136 25139 4944 1 9 . 1 1 101 101 LEU N N 101 128.723 128.723 128.196 0.527 25139 4945 1 9 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.423 -0.281 25139 4946 1 9 . 1 1 101 101 LEU C C 101 174.379 174.379 175.398 -1.019 25139 4947 1 9 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.361 -0.508 25139 4948 1 9 . 1 1 101 101 LEU CB C 101 45.307 45.307 45.012 0.295 25139 4949 1 9 . 1 1 101 101 LEU H H 101 9.578 9.578 8.896 0.682 25139 4950 1 9 . 1 1 102 102 VAL N N 102 119.417 119.417 120.077 -0.660 25139 4951 1 9 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.228 0.300 25139 4952 1 9 . 1 1 102 102 VAL C C 102 173.660 173.660 174.134 -0.474 25139 4953 1 9 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.902 -0.282 25139 4954 1 9 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.583 -1.310 25139 4955 1 9 . 1 1 102 102 VAL H H 102 9.297 9.297 9.407 -0.110 25139 4956 1 9 . 1 1 103 103 GLU N N 103 124.427 124.427 123.924 0.503 25139 4957 1 9 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.313 -0.448 25139 4958 1 9 . 1 1 103 103 GLU C C 103 176.319 176.319 175.391 0.928 25139 4959 1 9 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.517 -0.416 25139 4960 1 9 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.610 0.591 25139 4961 1 9 . 1 1 103 103 GLU H H 103 7.749 7.749 8.362 -0.613 25139 4962 1 9 . 1 1 104 104 LEU N N 104 127.294 127.294 126.012 1.282 25139 4963 1 9 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.427 -0.107 25139 4964 1 9 . 1 1 104 104 LEU C C 104 176.593 176.593 177.715 -1.122 25139 4965 1 9 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.013 3.071 25139 4966 1 9 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.719 -0.328 25139 4967 1 9 . 1 1 104 104 LEU H H 104 8.323 8.323 8.303 0.020 25139 4968 1 9 . 1 1 105 105 GLN N N 105 121.361 121.361 116.526 4.835 25139 4969 1 9 . 1 1 105 105 GLN C C 105 172.868 172.868 174.588 -1.720 25139 4970 1 9 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.339 -2.933 25139 4971 1 9 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.898 1.831 25139 4972 1 9 . 1 1 105 105 GLN H H 105 8.095 8.095 8.384 -0.289 25139 4973 1 9 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.365 0.044 25139 4974 1 9 . 1 1 106 106 PRO C C 106 177.770 177.770 176.799 0.971 25139 4975 1 9 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.969 -0.484 25139 4976 1 9 . 1 1 106 106 PRO CB C 106 31.768 31.768 31.953 -0.185 25139 4977 1 9 . 1 1 107 107 ASP N N 107 116.484 116.484 114.372 2.112 25139 4978 1 9 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.608 -0.168 25139 4979 1 9 . 1 1 107 107 ASP C C 107 176.749 176.749 176.485 0.264 25139 4980 1 9 . 1 1 107 107 ASP CA C 107 55.455 55.455 54.841 0.614 25139 4981 1 9 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.131 -1.243 25139 4982 1 9 . 1 1 107 107 ASP H H 107 8.638 8.638 8.510 0.128 25139 4983 1 9 . 1 1 108 108 ARG N N 108 117.895 117.895 120.711 -2.816 25139 4984 1 9 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.670 -0.180 25139 4985 1 9 . 1 1 108 108 ARG C C 108 176.111 176.111 177.351 -1.240 25139 4986 1 9 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.183 0.082 25139 4987 1 9 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.682 0.394 25139 4988 1 9 . 1 1 108 108 ARG H H 108 7.905 7.905 8.084 -0.179 25139 4989 1 9 . 1 1 109 109 GLY N N 109 108.307 108.307 107.842 0.465 25139 4990 1 9 . 1 1 109 109 GLY C C 109 173.949 173.949 173.874 0.075 25139 4991 1 9 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.448 -0.897 25139 4992 1 9 . 1 1 109 109 GLY H H 109 7.753 7.753 8.450 -0.697 25139 4993 1 9 . 1 1 110 110 GLU N N 110 120.035 120.035 122.918 -2.883 25139 4994 1 9 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.546 -0.455 25139 4995 1 9 . 1 1 110 110 GLU C C 110 177.045 177.045 177.147 -0.102 25139 4996 1 9 . 1 1 110 110 GLU CA C 110 58.282 58.282 55.997 2.285 25139 4997 1 9 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.457 -1.784 25139 4998 1 9 . 1 1 110 110 GLU H H 110 8.509 8.509 8.456 0.053 25139 4999 1 9 . 1 1 111 111 ASP N N 111 121.160 121.160 121.780 -0.620 25139 5000 1 9 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.477 0.093 25139 5001 1 9 . 1 1 111 111 ASP C C 111 175.089 175.089 175.911 -0.822 25139 5002 1 9 . 1 1 111 111 ASP CA C 111 54.591 54.591 57.068 -2.477 25139 5003 1 9 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.127 1.305 25139 5004 1 9 . 1 1 111 111 ASP H H 111 8.916 8.916 8.772 0.144 25139 5005 1 9 . 1 1 112 112 ALA N N 112 122.130 122.130 119.436 2.694 25139 5006 1 9 . 1 1 112 112 ALA C C 112 178.120 178.120 175.891 2.229 25139 5007 1 9 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.507 2.752 25139 5008 1 9 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.313 -1.543 25139 5009 1 9 . 1 1 112 112 ALA H H 112 7.361 7.361 7.548 -0.187 25139 5010 1 9 . 1 1 113 113 ILE N N 113 113.780 113.780 115.046 -1.266 25139 5011 1 9 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.693 0.193 25139 5012 1 9 . 1 1 113 113 ILE C C 113 174.258 174.258 174.896 -0.638 25139 5013 1 9 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.341 0.171 25139 5014 1 9 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.791 0.057 25139 5015 1 9 . 1 1 113 113 ILE H H 113 7.667 7.667 8.110 -0.443 25139 5016 1 9 . 1 1 114 114 ALA N N 114 122.673 122.673 125.158 -2.485 25139 5017 1 9 . 1 1 114 114 ALA C C 114 176.984 176.984 176.698 0.286 25139 5018 1 9 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.170 -1.606 25139 5019 1 9 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.596 0.986 25139 5020 1 9 . 1 1 114 114 ALA H H 114 8.904 8.904 8.843 0.061 25139 5021 1 9 . 1 1 115 115 ALA N N 115 116.486 116.486 116.178 0.308 25139 5022 1 9 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.475 -0.120 25139 5023 1 9 . 1 1 115 115 ALA C C 115 174.138 174.138 174.249 -0.111 25139 5024 1 9 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.683 1.637 25139 5025 1 9 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.411 1.572 25139 5026 1 9 . 1 1 115 115 ALA H H 115 7.182 7.182 7.218 -0.036 25139 5027 1 9 . 1 1 116 116 CYS N N 116 120.099 120.099 119.442 0.657 25139 5028 1 9 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.243 0.088 25139 5029 1 9 . 1 1 116 116 CYS C C 116 176.609 176.609 172.493 4.116 25139 5030 1 9 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.234 -2.285 25139 5031 1 9 . 1 1 116 116 CYS CB C 116 40.384 40.384 29.097 11.287 25139 5032 1 9 . 1 1 116 116 CYS H H 116 8.298 8.298 7.883 0.415 25139 5033 1 9 . 1 1 117 117 PHE N N 117 126.406 126.406 125.500 0.906 25139 5034 1 9 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.143 0.056 25139 5035 1 9 . 1 1 117 117 PHE C C 117 173.385 173.385 174.380 -0.995 25139 5036 1 9 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.091 0.163 25139 5037 1 9 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.340 0.341 25139 5038 1 9 . 1 1 117 117 PHE H H 117 9.712 9.712 9.118 0.594 25139 5039 1 9 . 1 1 118 118 LEU N N 118 122.119 122.119 124.118 -1.999 25139 5040 1 9 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.400 -0.234 25139 5041 1 9 . 1 1 118 118 LEU C C 118 175.097 175.097 176.120 -1.023 25139 5042 1 9 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.218 -0.314 25139 5043 1 9 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.373 -1.075 25139 5044 1 9 . 1 1 118 118 LEU H H 118 8.719 8.719 9.308 -0.589 25139 5045 1 9 . 1 1 119 119 ILE N N 119 125.324 125.324 122.558 2.766 25139 5046 1 9 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.989 -0.112 25139 5047 1 9 . 1 1 119 119 ILE C C 119 173.825 173.825 175.507 -1.682 25139 5048 1 9 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.952 -0.845 25139 5049 1 9 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.208 -0.698 25139 5050 1 9 . 1 1 119 119 ILE H H 119 8.986 8.986 9.147 -0.161 25139 5051 1 9 . 1 1 120 120 ASN N N 120 121.534 121.534 124.654 -3.120 25139 5052 1 9 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.778 0.612 25139 5053 1 9 . 1 1 120 120 ASN C C 120 176.098 176.098 176.061 0.037 25139 5054 1 9 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.045 -3.588 25139 5055 1 9 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.847 1.071 25139 5056 1 9 . 1 1 120 120 ASN H H 120 8.694 8.694 9.114 -0.420 25139 5057 1 9 . 1 1 121 121 CYS N N 121 122.779 122.779 117.415 5.364 25139 5058 1 9 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.126 0.357 25139 5059 1 9 . 1 1 121 121 CYS C C 121 173.195 173.195 173.435 -0.240 25139 5060 1 9 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.609 -3.845 25139 5061 1 9 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.698 16.009 25139 5062 1 9 . 1 1 121 121 CYS H H 121 10.668 10.668 8.574 2.094 25139 5063 1 9 . 1 1 122 122 LEU N N 122 121.063 121.063 117.434 3.629 25139 5064 1 9 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.604 -0.239 25139 5065 1 9 . 1 1 122 122 LEU C C 122 176.743 176.743 175.638 1.105 25139 5066 1 9 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.952 0.712 25139 5067 1 9 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.722 -1.488 25139 5068 1 9 . 1 1 122 122 LEU H H 122 8.256 8.256 7.425 0.831 25139 5069 1 9 . 1 1 123 123 TYR N N 123 123.081 123.081 122.911 0.170 25139 5070 1 9 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.761 -0.718 25139 5071 1 9 . 1 1 123 123 TYR C C 123 173.633 173.633 174.771 -1.138 25139 5072 1 9 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.368 -0.480 25139 5073 1 9 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.906 -0.824 25139 5074 1 9 . 1 1 123 123 TYR H H 123 8.990 8.990 9.002 -0.012 25139 5075 1 9 . 1 1 124 124 GLU N N 124 128.742 128.742 126.427 2.315 25139 5076 1 9 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.714 -0.164 25139 5077 1 9 . 1 1 124 124 GLU C C 124 174.835 174.835 175.444 -0.609 25139 5078 1 9 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.472 0.160 25139 5079 1 9 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.912 -1.017 25139 5080 1 9 . 1 1 124 124 GLU H H 124 9.135 9.135 8.776 0.359 25139 5081 1 9 . 1 1 125 125 GLN N N 125 108.066 108.066 109.494 -1.428 25139 5082 1 9 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.885 -0.164 25139 5083 1 9 . 1 1 125 125 GLN C C 125 174.627 174.627 174.488 0.139 25139 5084 1 9 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.704 0.335 25139 5085 1 9 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.737 -0.409 25139 5086 1 9 . 1 1 125 125 GLN H H 125 8.390 8.390 8.393 -0.003 25139 5087 1 9 . 1 1 126 126 ASN N N 126 118.528 118.528 117.227 1.301 25139 5088 1 9 . 1 1 126 126 ASN C C 126 173.713 173.713 174.499 -0.786 25139 5089 1 9 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.501 -0.312 25139 5090 1 9 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.938 0.863 25139 5091 1 9 . 1 1 126 126 ASN H H 126 8.092 8.092 7.997 0.095 25139 5092 1 9 . 1 1 127 127 PHE N N 127 124.680 124.680 122.379 2.301 25139 5093 1 9 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.825 0.212 25139 5094 1 9 . 1 1 127 127 PHE C C 127 177.125 177.125 176.685 0.440 25139 5095 1 9 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.984 1.429 25139 5096 1 9 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.030 1.214 25139 5097 1 9 . 1 1 127 127 PHE H H 127 9.026 9.026 8.919 0.107 25139 5098 1 9 . 1 1 128 128 VAL N N 128 119.455 119.455 117.822 1.633 25139 5099 1 9 . 1 1 128 128 VAL C C 128 175.886 175.886 175.760 0.126 25139 5100 1 9 . 1 1 128 128 VAL CA C 128 60.919 60.919 62.133 -1.214 25139 5101 1 9 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.162 2.033 25139 5102 1 9 . 1 1 128 128 VAL H H 128 8.364 8.364 7.578 0.786 25139 5103 1 9 . 1 1 129 129 CYS N N 129 116.130 116.130 120.078 -3.948 25139 5104 1 9 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.758 -0.281 25139 5105 1 9 . 1 1 129 129 CYS C C 129 170.569 170.569 174.471 -3.902 25139 5106 1 9 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.590 -3.441 25139 5107 1 9 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.627 18.990 25139 5108 1 9 . 1 1 129 129 CYS H H 129 5.390 5.390 7.255 -1.865 25139 5109 1 9 . 1 1 130 130 LYS N N 130 120.071 120.071 126.644 -6.573 25139 5110 1 9 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.318 0.243 25139 5111 1 9 . 1 1 130 130 LYS C C 130 176.853 176.853 174.602 2.251 25139 5112 1 9 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.982 -0.095 25139 5113 1 9 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.270 1.372 25139 5114 1 9 . 1 1 130 130 LYS H H 130 8.066 8.066 8.603 -0.537 25139 5115 1 9 . 1 1 131 131 PHE N N 131 118.415 118.415 119.813 -1.398 25139 5116 1 9 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.516 -0.909 25139 5117 1 9 . 1 1 131 131 PHE C C 131 174.013 174.013 175.169 -1.156 25139 5118 1 9 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.239 1.472 25139 5119 1 9 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.577 0.503 25139 5120 1 9 . 1 1 131 131 PHE H H 131 8.714 8.714 8.282 0.432 25139 5121 1 9 . 1 1 132 132 ALA N N 132 124.209 124.209 122.941 1.268 25139 5122 1 9 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.056 -0.439 25139 5123 1 9 . 1 1 132 132 ALA C C 132 174.352 174.352 174.396 -0.044 25139 5124 1 9 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.309 2.132 25139 5125 1 9 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.944 -0.480 25139 5126 1 9 . 1 1 132 132 ALA H H 132 9.295 9.295 9.124 0.171 25139 5127 1 9 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.322 -0.439 25139 5128 1 9 . 1 1 133 133 PRO C C 133 173.923 173.923 176.454 -2.531 25139 5129 1 9 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.643 0.428 25139 5130 1 9 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.422 -0.819 25139 5131 1 9 . 1 1 134 134 ARG N N 134 126.071 126.071 122.206 3.865 25139 5132 1 9 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.640 -0.385 25139 5133 1 9 . 1 1 134 134 ARG C C 134 177.065 177.065 176.463 0.602 25139 5134 1 9 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.212 1.952 25139 5135 1 9 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.482 -1.299 25139 5136 1 9 . 1 1 134 134 ARG H H 134 8.672 8.672 8.549 0.123 25139 5137 1 9 . 1 1 135 135 GLU N N 135 125.683 125.683 122.501 3.182 25139 5138 1 9 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.496 -0.143 25139 5139 1 9 . 1 1 135 135 GLU C C 135 178.081 178.081 177.132 0.949 25139 5140 1 9 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.524 0.127 25139 5141 1 9 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.847 0.149 25139 5142 1 9 . 1 1 135 135 GLU H H 135 8.603 8.603 8.906 -0.303 25139 5143 1 9 . 1 1 136 136 GLY N N 136 110.031 110.031 107.886 2.145 25139 5144 1 9 . 1 1 136 136 GLY C C 136 173.079 173.079 172.339 0.740 25139 5145 1 9 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.629 1.149 25139 5146 1 9 . 1 1 136 136 GLY H H 136 9.036 9.036 8.332 0.704 25139 5147 1 9 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.643 0.032 25139 5148 1 9 . 1 1 137 137 PHE C C 137 174.936 174.936 174.149 0.787 25139 5149 1 9 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.309 -0.224 25139 5150 1 9 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.956 1.740 25139 5151 1 9 . 1 1 138 138 ILE N N 138 117.417 117.417 114.616 2.801 25139 5152 1 9 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.715 -0.208 25139 5153 1 9 . 1 1 138 138 ILE C C 138 173.858 173.858 173.450 0.408 25139 5154 1 9 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.675 0.945 25139 5155 1 9 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.432 1.165 25139 5156 1 9 . 1 1 138 138 ILE H H 138 8.777 8.777 8.590 0.187 25139 5157 1 9 . 1 1 139 139 ASN N N 139 117.201 117.201 116.782 0.419 25139 5158 1 9 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.604 0.455 25139 5159 1 9 . 1 1 139 139 ASN C C 139 173.721 173.721 174.121 -0.400 25139 5160 1 9 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.790 -1.560 25139 5161 1 9 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.459 1.402 25139 5162 1 9 . 1 1 139 139 ASN H H 139 8.872 8.872 8.446 0.426 25139 5163 1 9 . 1 1 140 140 TYR N N 140 123.991 123.991 120.024 3.967 25139 5164 1 9 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.873 0.305 25139 5165 1 9 . 1 1 140 140 TYR C C 140 174.791 174.791 175.241 -0.450 25139 5166 1 9 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.323 -1.251 25139 5167 1 9 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.901 1.770 25139 5168 1 9 . 1 1 140 140 TYR H H 140 9.526 9.526 8.956 0.570 25139 5169 1 9 . 1 1 141 141 LEU N N 141 122.779 122.779 120.146 2.633 25139 5170 1 9 . 1 1 141 141 LEU C C 141 175.404 175.404 177.494 -2.090 25139 5171 1 9 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.806 2.297 25139 5172 1 9 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.389 -1.228 25139 5173 1 9 . 1 1 141 141 LEU H H 141 9.010 9.010 9.003 0.007 25139 5174 1 9 . 1 1 142 142 THR N N 142 113.189 113.189 111.484 1.705 25139 5175 1 9 . 1 1 142 142 THR HA H 142 4.061 4.061 3.740 0.321 25139 5176 1 9 . 1 1 142 142 THR C C 142 175.940 175.940 175.895 0.045 25139 5177 1 9 . 1 1 142 142 THR CA C 142 61.389 61.389 61.052 0.337 25139 5178 1 9 . 1 1 142 142 THR CB C 142 69.779 69.779 69.609 0.170 25139 5179 1 9 . 1 1 142 142 THR H H 142 7.737 7.737 8.113 -0.376 25139 5180 1 9 . 1 1 143 143 ARG N N 143 120.975 120.975 119.707 1.268 25139 5181 1 9 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.999 -0.061 25139 5182 1 9 . 1 1 143 143 ARG C C 143 178.690 178.690 177.091 1.599 25139 5183 1 9 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.988 0.760 25139 5184 1 9 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.564 0.581 25139 5185 1 9 . 1 1 143 143 ARG H H 143 8.149 8.149 8.737 -0.588 25139 5186 1 9 . 1 1 144 144 GLU N N 144 116.997 116.997 119.559 -2.562 25139 5187 1 9 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.343 -0.234 25139 5188 1 9 . 1 1 144 144 GLU C C 144 178.442 178.442 178.084 0.358 25139 5189 1 9 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.024 1.839 25139 5190 1 9 . 1 1 144 144 GLU CB C 144 29.582 29.582 31.084 -1.502 25139 5191 1 9 . 1 1 144 144 GLU H H 144 8.622 8.622 7.512 1.110 25139 5192 1 9 . 1 1 145 145 VAL N N 145 111.213 111.213 120.643 -9.430 25139 5193 1 9 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.879 0.532 25139 5194 1 9 . 1 1 145 145 VAL C C 145 176.965 176.965 177.003 -0.038 25139 5195 1 9 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.681 -1.087 25139 5196 1 9 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.234 -0.152 25139 5197 1 9 . 1 1 145 145 VAL H H 145 7.227 7.227 8.154 -0.927 25139 5198 1 9 . 1 1 146 146 TYR N N 146 123.512 123.512 121.062 2.450 25139 5199 1 9 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.041 -0.161 25139 5200 1 9 . 1 1 146 146 TYR C C 146 176.377 176.377 176.863 -0.486 25139 5201 1 9 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.782 0.755 25139 5202 1 9 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.399 -0.060 25139 5203 1 9 . 1 1 146 146 TYR H H 146 8.492 8.492 8.660 -0.168 25139 5204 1 9 . 1 1 147 147 ARG N N 147 116.680 116.680 115.572 1.108 25139 5205 1 9 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.946 -0.132 25139 5206 1 9 . 1 1 147 147 ARG C C 147 178.858 178.858 178.373 0.485 25139 5207 1 9 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.515 1.181 25139 5208 1 9 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.238 0.427 25139 5209 1 9 . 1 1 147 147 ARG H H 147 8.053 8.053 8.043 0.010 25139 5210 1 9 . 1 1 148 148 SER N N 148 115.306 115.306 114.223 1.083 25139 5211 1 9 . 1 1 148 148 SER HA H 148 3.998 3.998 4.195 -0.197 25139 5212 1 9 . 1 1 148 148 SER C C 148 175.786 175.786 175.929 -0.143 25139 5213 1 9 . 1 1 148 148 SER CA C 148 62.006 62.006 60.075 1.931 25139 5214 1 9 . 1 1 148 148 SER H H 148 7.139 7.139 7.554 -0.415 25139 5215 1 9 . 1 1 149 149 TYR N N 149 123.207 123.207 122.277 0.930 25139 5216 1 9 . 1 1 149 149 TYR C C 149 175.831 175.831 177.630 -1.799 25139 5217 1 9 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.125 -0.525 25139 5218 1 9 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.440 0.341 25139 5219 1 9 . 1 1 149 149 TYR H H 149 7.253 7.253 7.420 -0.167 25139 5220 1 9 . 1 1 150 150 ARG N N 150 118.708 118.708 116.924 1.784 25139 5221 1 9 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.997 -0.651 25139 5222 1 9 . 1 1 150 150 ARG C C 150 177.644 177.644 177.786 -0.142 25139 5223 1 9 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.120 0.203 25139 5224 1 9 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.232 -0.378 25139 5225 1 9 . 1 1 150 150 ARG H H 150 8.441 8.441 7.575 0.866 25139 5226 1 9 . 1 1 151 151 GLN N N 151 116.551 116.551 115.363 1.188 25139 5227 1 9 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.158 -0.201 25139 5228 1 9 . 1 1 151 151 GLN C C 151 177.987 177.987 177.016 0.971 25139 5229 1 9 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.535 0.806 25139 5230 1 9 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.347 0.117 25139 5231 1 9 . 1 1 151 151 GLN H H 151 7.332 7.332 7.564 -0.232 25139 5232 1 9 . 1 1 152 152 LEU N N 152 118.877 118.877 112.112 6.765 25139 5233 1 9 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.614 -0.435 25139 5234 1 9 . 1 1 152 152 LEU C C 152 179.070 179.070 177.193 1.877 25139 5235 1 9 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.511 1.571 25139 5236 1 9 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.379 -0.691 25139 5237 1 9 . 1 1 152 152 LEU H H 152 7.106 7.106 7.243 -0.137 25139 5238 1 9 . 1 1 153 153 VAL N N 153 119.076 119.076 112.769 6.307 25139 5239 1 9 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.079 -1.219 25139 5240 1 9 . 1 1 153 153 VAL C C 153 177.421 177.421 176.141 1.280 25139 5241 1 9 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.904 2.679 25139 5242 1 9 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.422 -1.904 25139 5243 1 9 . 1 1 153 153 VAL H H 153 7.427 7.427 7.145 0.282 25139 5244 1 9 . 1 1 154 154 ASP N N 154 119.888 119.888 122.926 -3.038 25139 5245 1 9 . 1 1 154 154 ASP C C 154 177.422 177.422 176.041 1.381 25139 5246 1 9 . 1 1 154 154 ASP CA C 154 56.071 56.071 53.965 2.106 25139 5247 1 9 . 1 1 154 154 ASP CB C 154 40.349 40.349 40.379 -0.030 25139 5248 1 9 . 1 1 154 154 ASP H H 154 7.930 7.930 7.898 0.032 25139 5249 1 9 . 1 1 155 155 HIS N N 155 117.821 117.821 122.824 -5.003 25139 5250 1 9 . 1 1 155 155 HIS CA C 155 57.756 57.756 57.195 0.561 25139 5251 1 9 . 1 1 155 155 HIS CB C 155 30.180 30.180 29.913 0.267 25139 5252 1 9 . 1 1 155 155 HIS H H 155 7.680 7.680 8.642 -0.962 25139 5253 1 9 . 1 1 156 156 HIS N N 156 119.180 119.180 115.483 3.697 25139 5254 1 9 . 1 1 156 156 HIS CA C 156 57.931 57.931 54.849 3.082 25139 5255 1 9 . 1 1 156 156 HIS CB C 156 30.300 30.300 31.155 -0.855 25139 5256 1 9 . 1 1 156 156 HIS H H 156 7.868 7.868 7.444 0.423 25139 5257 1 10 . 1 1 48 48 ALA CA C 48 52.904 52.904 53.352 -0.448 25139 5258 1 10 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.117 1.105 25139 5259 1 10 . 1 1 49 49 ASP N N 49 119.661 119.661 115.840 3.821 25139 5260 1 10 . 1 1 49 49 ASP CA C 49 54.277 54.277 53.114 1.163 25139 5261 1 10 . 1 1 49 49 ASP CB C 49 41.062 41.062 42.365 -1.303 25139 5262 1 10 . 1 1 49 49 ASP H H 49 8.462 8.462 7.942 0.520 25139 5263 1 10 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.159 -0.107 25139 5264 1 10 . 1 1 51 51 LEU C C 51 178.514 178.514 177.315 1.199 25139 5265 1 10 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.182 1.867 25139 5266 1 10 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.248 -0.055 25139 5267 1 10 . 1 1 52 52 ASN N N 52 113.819 113.819 115.161 -1.342 25139 5268 1 10 . 1 1 52 52 ASN HA H 52 4.835 4.835 5.035 -0.200 25139 5269 1 10 . 1 1 52 52 ASN C C 52 175.964 175.964 175.505 0.459 25139 5270 1 10 . 1 1 52 52 ASN CA C 52 54.096 54.096 53.566 0.530 25139 5271 1 10 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.641 -0.758 25139 5272 1 10 . 1 1 52 52 ASN H H 52 7.853 7.853 8.127 -0.274 25139 5273 1 10 . 1 1 53 53 SER N N 53 114.357 114.357 115.970 -1.613 25139 5274 1 10 . 1 1 53 53 SER CA C 53 59.908 59.908 59.221 0.687 25139 5275 1 10 . 1 1 53 53 SER CB C 53 64.395 64.395 63.907 0.488 25139 5276 1 10 . 1 1 53 53 SER H H 53 8.023 8.023 8.174 -0.151 25139 5277 1 10 . 1 1 54 54 PHE N N 54 121.037 121.037 119.340 1.697 25139 5278 1 10 . 1 1 54 54 PHE C C 54 175.522 175.522 173.574 1.948 25139 5279 1 10 . 1 1 54 54 PHE CA C 54 58.064 58.064 55.292 2.772 25139 5280 1 10 . 1 1 54 54 PHE CB C 54 43.053 43.053 42.659 0.394 25139 5281 1 10 . 1 1 54 54 PHE H H 54 7.731 7.731 7.660 0.071 25139 5282 1 10 . 1 1 55 55 THR N N 55 116.535 116.535 115.478 1.057 25139 5283 1 10 . 1 1 55 55 THR HA H 55 4.654 4.654 3.948 0.706 25139 5284 1 10 . 1 1 55 55 THR C C 55 173.301 173.301 172.727 0.574 25139 5285 1 10 . 1 1 55 55 THR CA C 55 61.420 61.420 60.465 0.955 25139 5286 1 10 . 1 1 55 55 THR CB C 55 71.388 71.388 71.543 -0.155 25139 5287 1 10 . 1 1 55 55 THR H H 55 8.929 8.929 8.737 0.192 25139 5288 1 10 . 1 1 56 56 ALA N N 56 129.359 129.359 127.732 1.627 25139 5289 1 10 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.266 0.049 25139 5290 1 10 . 1 1 56 56 ALA C C 56 178.305 178.305 177.409 0.896 25139 5291 1 10 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.198 0.673 25139 5292 1 10 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.138 0.186 25139 5293 1 10 . 1 1 56 56 ALA H H 56 8.907 8.907 8.141 0.766 25139 5294 1 10 . 1 1 57 57 GLY N N 57 106.331 106.331 109.329 -2.998 25139 5295 1 10 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.680 0.931 25139 5296 1 10 . 1 1 57 57 GLY H H 57 7.978 7.978 7.916 0.062 25139 5297 1 10 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.323 0.001 25139 5298 1 10 . 1 1 59 59 PRO C C 59 177.466 177.466 177.669 -0.203 25139 5299 1 10 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.755 1.729 25139 5300 1 10 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.029 -0.294 25139 5301 1 10 . 1 1 60 60 GLY N N 60 109.688 109.688 107.568 2.120 25139 5302 1 10 . 1 1 60 60 GLY C C 60 173.555 173.555 173.325 0.230 25139 5303 1 10 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.160 0.382 25139 5304 1 10 . 1 1 60 60 GLY H H 60 8.402 8.402 8.728 -0.326 25139 5305 1 10 . 1 1 61 61 PHE N N 61 122.491 122.491 122.112 0.379 25139 5306 1 10 . 1 1 61 61 PHE C C 61 175.146 175.146 175.013 0.133 25139 5307 1 10 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.494 1.788 25139 5308 1 10 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.282 -1.583 25139 5309 1 10 . 1 1 61 61 PHE H H 61 7.957 7.957 7.056 0.901 25139 5310 1 10 . 1 1 62 62 VAL N N 62 121.128 121.128 116.246 4.882 25139 5311 1 10 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.244 -0.159 25139 5312 1 10 . 1 1 62 62 VAL C C 62 174.937 174.937 174.680 0.257 25139 5313 1 10 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.266 0.442 25139 5314 1 10 . 1 1 62 62 VAL CB C 62 36.432 36.432 36.048 0.384 25139 5315 1 10 . 1 1 62 62 VAL H H 62 7.994 7.994 8.932 -0.938 25139 5316 1 10 . 1 1 63 63 LEU N N 63 124.386 124.386 123.618 0.768 25139 5317 1 10 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.805 -1.489 25139 5318 1 10 . 1 1 63 63 LEU C C 63 175.278 175.278 177.205 -1.927 25139 5319 1 10 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.547 0.741 25139 5320 1 10 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.907 1.211 25139 5321 1 10 . 1 1 63 63 LEU H H 63 7.572 7.572 9.031 -1.459 25139 5322 1 10 . 1 1 64 64 ASP N N 64 126.746 126.746 123.474 3.272 25139 5323 1 10 . 1 1 64 64 ASP C C 64 177.801 177.801 177.319 0.482 25139 5324 1 10 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.689 -2.968 25139 5325 1 10 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.026 -0.628 25139 5326 1 10 . 1 1 64 64 ASP H H 64 8.552 8.552 8.420 0.132 25139 5327 1 10 . 1 1 65 65 THR C C 65 175.002 175.002 175.132 -0.130 25139 5328 1 10 . 1 1 65 65 THR CB C 65 67.919 67.919 67.102 0.817 25139 5329 1 10 . 1 1 66 66 GLN N N 66 120.804 120.804 120.502 0.302 25139 5330 1 10 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.985 -0.108 25139 5331 1 10 . 1 1 66 66 GLN C C 66 178.901 178.901 177.658 1.243 25139 5332 1 10 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.511 0.905 25139 5333 1 10 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.328 -0.405 25139 5334 1 10 . 1 1 66 66 GLN H H 66 8.447 8.447 8.281 0.166 25139 5335 1 10 . 1 1 67 67 ALA N N 67 121.267 121.267 121.669 -0.402 25139 5336 1 10 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.118 -0.161 25139 5337 1 10 . 1 1 67 67 ALA C C 67 176.777 176.777 178.417 -1.640 25139 5338 1 10 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.568 -0.244 25139 5339 1 10 . 1 1 67 67 ALA CB C 67 18.620 18.620 17.891 0.729 25139 5340 1 10 . 1 1 67 67 ALA H H 67 7.791 7.791 7.826 -0.035 25139 5341 1 10 . 1 1 68 68 SER N N 68 113.339 113.339 112.354 0.985 25139 5342 1 10 . 1 1 68 68 SER HA H 68 4.061 4.061 4.155 -0.094 25139 5343 1 10 . 1 1 68 68 SER C C 68 175.875 175.875 176.611 -0.736 25139 5344 1 10 . 1 1 68 68 SER CA C 68 62.970 62.970 60.151 2.819 25139 5345 1 10 . 1 1 68 68 SER CB C 68 61.330 61.330 63.048 -1.718 25139 5346 1 10 . 1 1 68 68 SER H H 68 7.785 7.785 7.839 -0.054 25139 5347 1 10 . 1 1 69 69 VAL N N 69 125.140 125.140 117.620 7.520 25139 5348 1 10 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.199 -0.123 25139 5349 1 10 . 1 1 69 69 VAL C C 69 176.384 176.384 176.975 -0.591 25139 5350 1 10 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.877 0.854 25139 5351 1 10 . 1 1 69 69 VAL CB C 69 31.489 31.489 30.776 0.713 25139 5352 1 10 . 1 1 69 69 VAL H H 69 8.572 8.572 7.991 0.581 25139 5353 1 10 . 1 1 70 70 SER N N 70 116.704 116.704 114.173 2.531 25139 5354 1 10 . 1 1 70 70 SER HA H 70 4.229 4.229 4.272 -0.043 25139 5355 1 10 . 1 1 70 70 SER C C 70 174.101 174.101 175.515 -1.414 25139 5356 1 10 . 1 1 70 70 SER CA C 70 61.627 61.627 59.106 2.521 25139 5357 1 10 . 1 1 70 70 SER H H 70 7.951 7.951 7.628 0.323 25139 5358 1 10 . 1 1 71 71 ASN N N 71 117.576 117.576 116.995 0.581 25139 5359 1 10 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.675 0.127 25139 5360 1 10 . 1 1 71 71 ASN C C 71 174.332 174.332 174.900 -0.568 25139 5361 1 10 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.943 -0.504 25139 5362 1 10 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.977 0.490 25139 5363 1 10 . 1 1 71 71 ASN H H 71 7.131 7.131 7.529 -0.398 25139 5364 1 10 . 1 1 72 72 GLY N N 72 103.925 103.925 105.523 -1.598 25139 5365 1 10 . 1 1 72 72 GLY C C 72 174.710 174.710 173.487 1.223 25139 5366 1 10 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.532 0.017 25139 5367 1 10 . 1 1 72 72 GLY H H 72 7.338 7.338 7.445 -0.107 25139 5368 1 10 . 1 1 73 73 ALA N N 73 124.942 124.942 123.256 1.686 25139 5369 1 10 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.499 -0.327 25139 5370 1 10 . 1 1 73 73 ALA C C 73 175.896 175.896 176.139 -0.243 25139 5371 1 10 . 1 1 73 73 ALA CA C 73 52.673 52.673 52.124 0.549 25139 5372 1 10 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.157 -0.101 25139 5373 1 10 . 1 1 73 73 ALA H H 73 8.032 8.032 7.734 0.298 25139 5374 1 10 . 1 1 74 74 THR N N 74 113.423 113.423 116.043 -2.620 25139 5375 1 10 . 1 1 74 74 THR HA H 74 4.678 4.678 4.565 0.113 25139 5376 1 10 . 1 1 74 74 THR C C 74 173.339 173.339 173.303 0.036 25139 5377 1 10 . 1 1 74 74 THR CA C 74 61.545 61.545 61.469 0.076 25139 5378 1 10 . 1 1 74 74 THR CB C 74 71.319 71.319 71.499 -0.180 25139 5379 1 10 . 1 1 74 74 THR H H 74 8.530 8.530 8.273 0.257 25139 5380 1 10 . 1 1 75 75 PHE N N 75 128.180 128.180 130.308 -2.128 25139 5381 1 10 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.897 -0.293 25139 5382 1 10 . 1 1 75 75 PHE C C 75 174.623 174.623 175.126 -0.503 25139 5383 1 10 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.293 2.323 25139 5384 1 10 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.687 0.988 25139 5385 1 10 . 1 1 75 75 PHE H H 75 9.146 9.146 9.079 0.067 25139 5386 1 10 . 1 1 76 76 LEU N N 76 127.849 127.849 124.816 3.033 25139 5387 1 10 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.453 -0.102 25139 5388 1 10 . 1 1 76 76 LEU C C 76 176.339 176.339 176.794 -0.455 25139 5389 1 10 . 1 1 76 76 LEU CA C 76 55.983 55.983 56.022 -0.039 25139 5390 1 10 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.194 0.136 25139 5391 1 10 . 1 1 76 76 LEU H H 76 8.635 8.635 8.060 0.575 25139 5392 1 10 . 1 1 77 77 GLU N N 77 115.131 115.131 119.760 -4.629 25139 5393 1 10 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.553 -0.145 25139 5394 1 10 . 1 1 77 77 GLU C C 77 174.734 174.734 174.532 0.202 25139 5395 1 10 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.180 1.173 25139 5396 1 10 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.056 0.151 25139 5397 1 10 . 1 1 77 77 GLU H H 77 7.252 7.252 7.780 -0.528 25139 5398 1 10 . 1 1 78 78 SER N N 78 118.016 118.016 118.899 -0.883 25139 5399 1 10 . 1 1 78 78 SER HA H 78 5.561 5.561 5.301 0.260 25139 5400 1 10 . 1 1 78 78 SER C C 78 171.968 171.968 172.854 -0.886 25139 5401 1 10 . 1 1 78 78 SER CA C 78 54.061 54.061 54.946 -0.885 25139 5402 1 10 . 1 1 78 78 SER CB C 78 64.074 64.074 63.732 0.342 25139 5403 1 10 . 1 1 78 78 SER H H 78 9.033 9.033 8.597 0.436 25139 5404 1 10 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.893 -0.293 25139 5405 1 10 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.200 0.210 25139 5406 1 10 . 1 1 80 80 THR N N 80 118.079 118.079 117.044 1.035 25139 5407 1 10 . 1 1 80 80 THR HA H 80 4.342 4.342 4.281 0.061 25139 5408 1 10 . 1 1 80 80 THR C C 80 174.494 174.494 174.489 0.005 25139 5409 1 10 . 1 1 80 80 THR CA C 80 61.453 61.453 60.854 0.599 25139 5410 1 10 . 1 1 80 80 THR CB C 80 67.797 67.797 68.266 -0.469 25139 5411 1 10 . 1 1 80 80 THR H H 80 8.670 8.670 8.415 0.255 25139 5412 1 10 . 1 1 81 81 VAL N N 81 117.395 117.395 115.669 1.726 25139 5413 1 10 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.984 0.623 25139 5414 1 10 . 1 1 81 81 VAL C C 81 175.518 175.518 175.992 -0.474 25139 5415 1 10 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.954 -2.840 25139 5416 1 10 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.035 2.560 25139 5417 1 10 . 1 1 81 81 VAL H H 81 7.448 7.448 7.379 0.069 25139 5418 1 10 . 1 1 82 82 ARG N N 82 117.852 117.852 118.329 -0.477 25139 5419 1 10 . 1 1 82 82 ARG HA H 82 4.521 4.521 5.010 -0.489 25139 5420 1 10 . 1 1 82 82 ARG C C 82 176.992 176.992 175.872 1.120 25139 5421 1 10 . 1 1 82 82 ARG CA C 82 56.385 56.385 54.755 1.630 25139 5422 1 10 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.705 0.897 25139 5423 1 10 . 1 1 82 82 ARG H H 82 8.710 8.710 8.627 0.083 25139 5424 1 10 . 1 1 83 83 ARG N N 83 117.035 117.035 118.549 -1.514 25139 5425 1 10 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.809 0.513 25139 5426 1 10 . 1 1 83 83 ARG C C 83 177.379 177.379 176.345 1.034 25139 5427 1 10 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.764 -1.080 25139 5428 1 10 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.926 -0.885 25139 5429 1 10 . 1 1 83 83 ARG H H 83 7.292 7.292 7.790 -0.498 25139 5430 1 10 . 1 1 84 84 GLY N N 84 114.911 114.911 110.228 4.683 25139 5431 1 10 . 1 1 84 84 GLY C C 84 176.940 176.940 175.163 1.777 25139 5432 1 10 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.899 1.773 25139 5433 1 10 . 1 1 84 84 GLY H H 84 9.255 9.255 8.403 0.852 25139 5434 1 10 . 1 1 85 85 TRP N N 85 121.810 121.810 120.322 1.488 25139 5435 1 10 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.207 -0.040 25139 5436 1 10 . 1 1 85 85 TRP C C 85 178.272 178.272 178.249 0.023 25139 5437 1 10 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.888 1.157 25139 5438 1 10 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.269 -0.052 25139 5439 1 10 . 1 1 85 85 TRP H H 85 9.963 9.963 8.262 1.701 25139 5440 1 10 . 1 1 86 86 ASP N N 86 116.400 116.400 120.118 -3.718 25139 5441 1 10 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.533 -0.140 25139 5442 1 10 . 1 1 86 86 ASP C C 86 178.803 178.803 177.899 0.904 25139 5443 1 10 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.597 0.457 25139 5444 1 10 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.318 0.415 25139 5445 1 10 . 1 1 86 86 ASP H H 86 6.934 6.934 7.765 -0.831 25139 5446 1 10 . 1 1 87 87 CYS N N 87 122.454 122.454 119.254 3.200 25139 5447 1 10 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.279 -0.029 25139 5448 1 10 . 1 1 87 87 CYS C C 87 174.956 174.956 176.678 -1.722 25139 5449 1 10 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.882 -3.735 25139 5450 1 10 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.495 10.989 25139 5451 1 10 . 1 1 87 87 CYS H H 87 7.603 7.603 7.510 0.093 25139 5452 1 10 . 1 1 88 88 VAL N N 88 119.192 119.192 118.555 0.637 25139 5453 1 10 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.561 -1.103 25139 5454 1 10 . 1 1 88 88 VAL C C 88 177.413 177.413 177.226 0.187 25139 5455 1 10 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.451 1.525 25139 5456 1 10 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.999 -0.757 25139 5457 1 10 . 1 1 88 88 VAL H H 88 7.192 7.192 7.476 -0.284 25139 5458 1 10 . 1 1 89 89 ARG N N 89 118.185 118.185 118.739 -0.554 25139 5459 1 10 . 1 1 89 89 ARG HA H 89 3.680 3.680 4.052 -0.372 25139 5460 1 10 . 1 1 89 89 ARG C C 89 178.677 178.677 177.716 0.961 25139 5461 1 10 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.741 1.214 25139 5462 1 10 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.528 0.263 25139 5463 1 10 . 1 1 89 89 ARG H H 89 7.971 7.971 7.614 0.357 25139 5464 1 10 . 1 1 90 90 ALA N N 90 120.815 120.815 122.279 -1.464 25139 5465 1 10 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.181 -0.106 25139 5466 1 10 . 1 1 90 90 ALA C C 90 177.416 177.416 178.972 -1.556 25139 5467 1 10 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.531 -0.277 25139 5468 1 10 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.142 -0.706 25139 5469 1 10 . 1 1 90 90 ALA H H 90 7.453 7.453 7.347 0.106 25139 5470 1 10 . 1 1 91 91 CYS N N 91 120.380 120.380 115.981 4.399 25139 5471 1 10 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.262 0.109 25139 5472 1 10 . 1 1 91 91 CYS C C 91 176.654 176.654 175.918 0.736 25139 5473 1 10 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.628 -3.933 25139 5474 1 10 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.630 12.074 25139 5475 1 10 . 1 1 91 91 CYS H H 91 7.944 7.944 7.629 0.315 25139 5476 1 10 . 1 1 92 92 CYS N N 92 116.270 116.270 115.682 0.588 25139 5477 1 10 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.424 -0.020 25139 5478 1 10 . 1 1 92 92 CYS C C 92 175.628 175.628 176.516 -0.888 25139 5479 1 10 . 1 1 92 92 CYS CA C 92 58.706 58.706 59.989 -1.283 25139 5480 1 10 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.655 15.494 25139 5481 1 10 . 1 1 92 92 CYS H H 92 8.315 8.315 7.677 0.638 25139 5482 1 10 . 1 1 93 93 THR N N 93 107.283 107.283 111.901 -4.618 25139 5483 1 10 . 1 1 93 93 THR HA H 93 4.481 4.481 4.311 0.170 25139 5484 1 10 . 1 1 93 93 THR C C 93 173.606 173.606 175.093 -1.487 25139 5485 1 10 . 1 1 93 93 THR CA C 93 61.402 61.402 63.444 -2.042 25139 5486 1 10 . 1 1 93 93 THR CB C 93 69.046 69.046 69.734 -0.688 25139 5487 1 10 . 1 1 93 93 THR H H 93 7.445 7.445 7.625 -0.180 25139 5488 1 10 . 1 1 94 94 THR N N 94 121.432 121.432 121.746 -0.314 25139 5489 1 10 . 1 1 94 94 THR HA H 94 4.398 4.398 4.394 0.004 25139 5490 1 10 . 1 1 94 94 THR C C 94 173.493 173.493 174.777 -1.284 25139 5491 1 10 . 1 1 94 94 THR CA C 94 62.726 62.726 62.805 -0.079 25139 5492 1 10 . 1 1 94 94 THR CB C 94 69.704 69.704 68.818 0.886 25139 5493 1 10 . 1 1 94 94 THR H H 94 7.553 7.553 8.104 -0.551 25139 5494 1 10 . 1 1 95 95 GLN N N 95 129.410 129.410 128.753 0.657 25139 5495 1 10 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.016 -0.072 25139 5496 1 10 . 1 1 95 95 GLN C C 95 176.293 176.293 176.519 -0.226 25139 5497 1 10 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.772 -0.732 25139 5498 1 10 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.729 -0.473 25139 5499 1 10 . 1 1 95 95 GLN H H 95 8.812 8.812 9.027 -0.215 25139 5500 1 10 . 1 1 96 96 ASN N N 96 115.015 115.015 114.096 0.919 25139 5501 1 10 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.736 -0.537 25139 5502 1 10 . 1 1 96 96 ASN C C 96 172.260 172.260 173.765 -1.505 25139 5503 1 10 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.128 2.439 25139 5504 1 10 . 1 1 96 96 ASN CB C 96 36.837 36.837 39.024 -2.187 25139 5505 1 10 . 1 1 96 96 ASN H H 96 8.791 8.791 8.078 0.713 25139 5506 1 10 . 1 1 97 97 CYS N N 97 115.830 115.830 120.145 -4.315 25139 5507 1 10 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.506 -0.405 25139 5508 1 10 . 1 1 97 97 CYS C C 97 175.025 175.025 174.237 0.788 25139 5509 1 10 . 1 1 97 97 CYS CA C 97 58.148 58.148 60.047 -1.899 25139 5510 1 10 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.927 16.307 25139 5511 1 10 . 1 1 97 97 CYS H H 97 7.651 7.651 7.741 -0.090 25139 5512 1 10 . 1 1 98 98 ASN N N 98 125.148 125.148 125.634 -0.486 25139 5513 1 10 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.988 0.145 25139 5514 1 10 . 1 1 98 98 ASN C C 98 171.892 171.892 174.228 -2.336 25139 5515 1 10 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.903 -0.709 25139 5516 1 10 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.555 -1.607 25139 5517 1 10 . 1 1 98 98 ASN H H 98 8.736 8.736 8.366 0.370 25139 5518 1 10 . 1 1 99 99 LEU N N 99 120.898 120.898 120.104 0.794 25139 5519 1 10 . 1 1 99 99 LEU C C 99 173.084 173.084 174.047 -0.963 25139 5520 1 10 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.346 2.773 25139 5521 1 10 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.881 -1.553 25139 5522 1 10 . 1 1 99 99 LEU H H 99 8.200 8.200 8.086 0.114 25139 5523 1 10 . 1 1 100 100 ALA N N 100 128.085 128.085 129.050 -0.965 25139 5524 1 10 . 1 1 100 100 ALA C C 100 174.938 174.938 175.535 -0.597 25139 5525 1 10 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.429 -0.682 25139 5526 1 10 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.401 0.313 25139 5527 1 10 . 1 1 100 100 ALA H H 100 9.156 9.156 9.229 -0.073 25139 5528 1 10 . 1 1 101 101 LEU N N 101 128.723 128.723 127.748 0.975 25139 5529 1 10 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.242 -0.100 25139 5530 1 10 . 1 1 101 101 LEU C C 101 174.379 174.379 175.425 -1.046 25139 5531 1 10 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.336 -0.483 25139 5532 1 10 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.418 0.889 25139 5533 1 10 . 1 1 101 101 LEU H H 101 9.578 9.578 9.168 0.410 25139 5534 1 10 . 1 1 102 102 VAL N N 102 119.417 119.417 119.225 0.192 25139 5535 1 10 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.078 0.450 25139 5536 1 10 . 1 1 102 102 VAL C C 102 173.660 173.660 174.032 -0.372 25139 5537 1 10 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.916 -0.296 25139 5538 1 10 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.132 -0.859 25139 5539 1 10 . 1 1 102 102 VAL H H 102 9.297 9.297 9.425 -0.128 25139 5540 1 10 . 1 1 103 103 GLU N N 103 124.427 124.427 125.924 -1.497 25139 5541 1 10 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.800 -0.935 25139 5542 1 10 . 1 1 103 103 GLU C C 103 176.319 176.319 175.546 0.773 25139 5543 1 10 . 1 1 103 103 GLU CA C 103 54.101 54.101 55.429 -1.328 25139 5544 1 10 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.709 0.492 25139 5545 1 10 . 1 1 103 103 GLU H H 103 7.749 7.749 8.299 -0.550 25139 5546 1 10 . 1 1 104 104 LEU N N 104 127.294 127.294 125.954 1.340 25139 5547 1 10 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.631 -0.311 25139 5548 1 10 . 1 1 104 104 LEU C C 104 176.593 176.593 177.735 -1.142 25139 5549 1 10 . 1 1 104 104 LEU CA C 104 56.084 56.084 52.814 3.270 25139 5550 1 10 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.999 -0.609 25139 5551 1 10 . 1 1 104 104 LEU H H 104 8.323 8.323 8.195 0.128 25139 5552 1 10 . 1 1 105 105 GLN N N 105 121.361 121.361 117.662 3.699 25139 5553 1 10 . 1 1 105 105 GLN C C 105 172.868 172.868 174.794 -1.926 25139 5554 1 10 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.555 -3.149 25139 5555 1 10 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.994 1.736 25139 5556 1 10 . 1 1 105 105 GLN H H 105 8.095 8.095 8.455 -0.360 25139 5557 1 10 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.561 -0.152 25139 5558 1 10 . 1 1 106 106 PRO C C 106 177.770 177.770 176.861 0.909 25139 5559 1 10 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.544 -0.059 25139 5560 1 10 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.164 -0.396 25139 5561 1 10 . 1 1 107 107 ASP N N 107 116.484 116.484 116.186 0.298 25139 5562 1 10 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.605 -0.165 25139 5563 1 10 . 1 1 107 107 ASP C C 107 176.749 176.749 175.745 1.004 25139 5564 1 10 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.449 0.006 25139 5565 1 10 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.358 -1.470 25139 5566 1 10 . 1 1 107 107 ASP H H 107 8.638 8.638 8.550 0.088 25139 5567 1 10 . 1 1 108 108 ARG N N 108 117.895 117.895 120.029 -2.134 25139 5568 1 10 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.734 -0.244 25139 5569 1 10 . 1 1 108 108 ARG C C 108 176.111 176.111 176.751 -0.640 25139 5570 1 10 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.449 -0.184 25139 5571 1 10 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.437 -0.361 25139 5572 1 10 . 1 1 108 108 ARG H H 108 7.905 7.905 8.355 -0.450 25139 5573 1 10 . 1 1 109 109 GLY N N 109 108.307 108.307 109.349 -1.042 25139 5574 1 10 . 1 1 109 109 GLY C C 109 173.949 173.949 174.130 -0.181 25139 5575 1 10 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.894 -1.343 25139 5576 1 10 . 1 1 109 109 GLY H H 109 7.753 7.753 8.283 -0.530 25139 5577 1 10 . 1 1 110 110 GLU N N 110 120.035 120.035 122.469 -2.434 25139 5578 1 10 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.518 -0.427 25139 5579 1 10 . 1 1 110 110 GLU C C 110 177.045 177.045 176.278 0.767 25139 5580 1 10 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.168 2.114 25139 5581 1 10 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.442 -1.769 25139 5582 1 10 . 1 1 110 110 GLU H H 110 8.509 8.509 8.301 0.208 25139 5583 1 10 . 1 1 111 111 ASP N N 111 121.160 121.160 121.507 -0.347 25139 5584 1 10 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.488 0.082 25139 5585 1 10 . 1 1 111 111 ASP C C 111 175.089 175.089 175.526 -0.437 25139 5586 1 10 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.911 -1.320 25139 5587 1 10 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.137 1.295 25139 5588 1 10 . 1 1 111 111 ASP H H 111 8.916 8.916 8.642 0.274 25139 5589 1 10 . 1 1 112 112 ALA N N 112 122.130 122.130 118.634 3.496 25139 5590 1 10 . 1 1 112 112 ALA C C 112 178.120 178.120 175.938 2.182 25139 5591 1 10 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.495 2.764 25139 5592 1 10 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.215 -1.446 25139 5593 1 10 . 1 1 112 112 ALA H H 112 7.361 7.361 7.579 -0.218 25139 5594 1 10 . 1 1 113 113 ILE N N 113 113.780 113.780 114.510 -0.730 25139 5595 1 10 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.863 0.023 25139 5596 1 10 . 1 1 113 113 ILE C C 113 174.258 174.258 175.154 -0.896 25139 5597 1 10 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.264 0.248 25139 5598 1 10 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.837 0.011 25139 5599 1 10 . 1 1 113 113 ILE H H 113 7.667 7.667 7.754 -0.087 25139 5600 1 10 . 1 1 114 114 ALA N N 114 122.673 122.673 125.121 -2.448 25139 5601 1 10 . 1 1 114 114 ALA C C 114 176.984 176.984 176.724 0.260 25139 5602 1 10 . 1 1 114 114 ALA CA C 114 51.564 51.564 52.967 -1.403 25139 5603 1 10 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.760 0.822 25139 5604 1 10 . 1 1 114 114 ALA H H 114 8.904 8.904 8.912 -0.008 25139 5605 1 10 . 1 1 115 115 ALA N N 115 116.486 116.486 116.328 0.158 25139 5606 1 10 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.486 -0.131 25139 5607 1 10 . 1 1 115 115 ALA C C 115 174.138 174.138 174.255 -0.117 25139 5608 1 10 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.644 1.676 25139 5609 1 10 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.364 1.619 25139 5610 1 10 . 1 1 115 115 ALA H H 115 7.182 7.182 7.232 -0.050 25139 5611 1 10 . 1 1 116 116 CYS N N 116 120.099 120.099 119.499 0.600 25139 5612 1 10 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.236 0.095 25139 5613 1 10 . 1 1 116 116 CYS C C 116 176.609 176.609 172.547 4.062 25139 5614 1 10 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.289 -2.340 25139 5615 1 10 . 1 1 116 116 CYS CB C 116 40.384 40.384 29.069 11.315 25139 5616 1 10 . 1 1 116 116 CYS H H 116 8.298 8.298 7.937 0.361 25139 5617 1 10 . 1 1 117 117 PHE N N 117 126.406 126.406 125.844 0.562 25139 5618 1 10 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.141 0.057 25139 5619 1 10 . 1 1 117 117 PHE C C 117 173.385 173.385 174.501 -1.116 25139 5620 1 10 . 1 1 117 117 PHE CA C 117 56.254 56.254 55.888 0.366 25139 5621 1 10 . 1 1 117 117 PHE CB C 117 41.681 41.681 40.811 0.870 25139 5622 1 10 . 1 1 117 117 PHE H H 117 9.712 9.712 8.945 0.767 25139 5623 1 10 . 1 1 118 118 LEU N N 118 122.119 122.119 124.331 -2.212 25139 5624 1 10 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.393 -0.227 25139 5625 1 10 . 1 1 118 118 LEU C C 118 175.097 175.097 176.487 -1.390 25139 5626 1 10 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.327 -0.423 25139 5627 1 10 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.268 -0.970 25139 5628 1 10 . 1 1 118 118 LEU H H 118 8.719 8.719 9.278 -0.559 25139 5629 1 10 . 1 1 119 119 ILE N N 119 125.324 125.324 122.435 2.889 25139 5630 1 10 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.857 0.020 25139 5631 1 10 . 1 1 119 119 ILE C C 119 173.825 173.825 175.234 -1.409 25139 5632 1 10 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.810 -0.703 25139 5633 1 10 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.004 -0.494 25139 5634 1 10 . 1 1 119 119 ILE H H 119 8.986 8.986 9.073 -0.087 25139 5635 1 10 . 1 1 120 120 ASN N N 120 121.534 121.534 125.319 -3.785 25139 5636 1 10 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.761 0.629 25139 5637 1 10 . 1 1 120 120 ASN C C 120 176.098 176.098 175.892 0.206 25139 5638 1 10 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.468 -4.011 25139 5639 1 10 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.076 0.842 25139 5640 1 10 . 1 1 120 120 ASN H H 120 8.694 8.694 8.963 -0.269 25139 5641 1 10 . 1 1 121 121 CYS N N 121 122.779 122.779 114.611 8.168 25139 5642 1 10 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.139 0.344 25139 5643 1 10 . 1 1 121 121 CYS C C 121 173.195 173.195 173.257 -0.062 25139 5644 1 10 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.511 -3.747 25139 5645 1 10 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.564 16.143 25139 5646 1 10 . 1 1 121 121 CYS H H 121 10.668 10.668 8.542 2.126 25139 5647 1 10 . 1 1 122 122 LEU N N 122 121.063 121.063 115.894 5.169 25139 5648 1 10 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.536 -0.171 25139 5649 1 10 . 1 1 122 122 LEU C C 122 176.743 176.743 175.416 1.327 25139 5650 1 10 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.906 0.758 25139 5651 1 10 . 1 1 122 122 LEU CB C 122 44.234 44.234 46.031 -1.797 25139 5652 1 10 . 1 1 122 122 LEU H H 122 8.256 8.256 7.393 0.863 25139 5653 1 10 . 1 1 123 123 TYR N N 123 123.081 123.081 122.668 0.413 25139 5654 1 10 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.753 -0.710 25139 5655 1 10 . 1 1 123 123 TYR C C 123 173.633 173.633 174.650 -1.017 25139 5656 1 10 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.207 -0.319 25139 5657 1 10 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.494 -0.413 25139 5658 1 10 . 1 1 123 123 TYR H H 123 8.990 8.990 8.985 0.005 25139 5659 1 10 . 1 1 124 124 GLU N N 124 128.742 128.742 126.633 2.109 25139 5660 1 10 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.714 -0.164 25139 5661 1 10 . 1 1 124 124 GLU C C 124 174.835 174.835 175.497 -0.662 25139 5662 1 10 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.393 0.239 25139 5663 1 10 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.224 -0.329 25139 5664 1 10 . 1 1 124 124 GLU H H 124 9.135 9.135 8.821 0.314 25139 5665 1 10 . 1 1 125 125 GLN N N 125 108.066 108.066 109.022 -0.956 25139 5666 1 10 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.845 -0.124 25139 5667 1 10 . 1 1 125 125 GLN C C 125 174.627 174.627 174.536 0.091 25139 5668 1 10 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.636 0.403 25139 5669 1 10 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.634 -0.306 25139 5670 1 10 . 1 1 125 125 GLN H H 125 8.390 8.390 8.478 -0.088 25139 5671 1 10 . 1 1 126 126 ASN N N 126 118.528 118.528 117.227 1.301 25139 5672 1 10 . 1 1 126 126 ASN C C 126 173.713 173.713 174.572 -0.859 25139 5673 1 10 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.557 -0.368 25139 5674 1 10 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.888 0.913 25139 5675 1 10 . 1 1 126 126 ASN H H 126 8.092 8.092 7.907 0.185 25139 5676 1 10 . 1 1 127 127 PHE N N 127 124.680 124.680 122.553 2.127 25139 5677 1 10 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.761 0.276 25139 5678 1 10 . 1 1 127 127 PHE C C 127 177.125 177.125 176.373 0.752 25139 5679 1 10 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.966 1.447 25139 5680 1 10 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.014 1.230 25139 5681 1 10 . 1 1 127 127 PHE H H 127 9.026 9.026 8.870 0.156 25139 5682 1 10 . 1 1 128 128 VAL N N 128 119.455 119.455 119.081 0.374 25139 5683 1 10 . 1 1 128 128 VAL C C 128 175.886 175.886 175.868 0.018 25139 5684 1 10 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.755 -0.836 25139 5685 1 10 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.957 2.237 25139 5686 1 10 . 1 1 128 128 VAL H H 128 8.364 8.364 7.649 0.715 25139 5687 1 10 . 1 1 129 129 CYS N N 129 116.130 116.130 120.851 -4.721 25139 5688 1 10 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.935 -0.458 25139 5689 1 10 . 1 1 129 129 CYS C C 129 170.569 170.569 173.680 -3.111 25139 5690 1 10 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.799 -3.649 25139 5691 1 10 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.928 18.689 25139 5692 1 10 . 1 1 129 129 CYS H H 129 5.390 5.390 7.113 -1.723 25139 5693 1 10 . 1 1 130 130 LYS N N 130 120.071 120.071 124.971 -4.900 25139 5694 1 10 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.095 0.466 25139 5695 1 10 . 1 1 130 130 LYS C C 130 176.853 176.853 174.420 2.433 25139 5696 1 10 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.556 -0.669 25139 5697 1 10 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.395 1.247 25139 5698 1 10 . 1 1 130 130 LYS H H 130 8.066 8.066 7.696 0.370 25139 5699 1 10 . 1 1 131 131 PHE N N 131 118.415 118.415 119.896 -1.481 25139 5700 1 10 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.432 -0.825 25139 5701 1 10 . 1 1 131 131 PHE C C 131 174.013 174.013 175.202 -1.189 25139 5702 1 10 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.196 1.516 25139 5703 1 10 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.262 0.818 25139 5704 1 10 . 1 1 131 131 PHE H H 131 8.714 8.714 8.170 0.544 25139 5705 1 10 . 1 1 132 132 ALA N N 132 124.209 124.209 122.856 1.353 25139 5706 1 10 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.029 -0.412 25139 5707 1 10 . 1 1 132 132 ALA C C 132 174.352 174.352 174.358 -0.006 25139 5708 1 10 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.658 1.783 25139 5709 1 10 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.847 -0.383 25139 5710 1 10 . 1 1 132 132 ALA H H 132 9.295 9.295 9.210 0.085 25139 5711 1 10 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.441 -0.557 25139 5712 1 10 . 1 1 133 133 PRO C C 133 173.923 173.923 176.484 -2.561 25139 5713 1 10 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.527 0.544 25139 5714 1 10 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.671 -1.068 25139 5715 1 10 . 1 1 134 134 ARG N N 134 126.071 126.071 123.711 2.360 25139 5716 1 10 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.464 -0.209 25139 5717 1 10 . 1 1 134 134 ARG C C 134 177.065 177.065 175.972 1.093 25139 5718 1 10 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.442 2.722 25139 5719 1 10 . 1 1 134 134 ARG CB C 134 32.183 32.183 31.591 0.592 25139 5720 1 10 . 1 1 134 134 ARG H H 134 8.672 8.672 8.096 0.576 25139 5721 1 10 . 1 1 135 135 GLU N N 135 125.683 125.683 120.166 5.517 25139 5722 1 10 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.352 0.001 25139 5723 1 10 . 1 1 135 135 GLU C C 135 178.081 178.081 177.100 0.981 25139 5724 1 10 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.225 0.426 25139 5725 1 10 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.318 -0.322 25139 5726 1 10 . 1 1 135 135 GLU H H 135 8.603 8.603 8.608 -0.005 25139 5727 1 10 . 1 1 136 136 GLY N N 136 110.031 110.031 106.910 3.121 25139 5728 1 10 . 1 1 136 136 GLY C C 136 173.079 173.079 172.519 0.560 25139 5729 1 10 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.975 0.803 25139 5730 1 10 . 1 1 136 136 GLY H H 136 9.036 9.036 8.172 0.864 25139 5731 1 10 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.534 0.141 25139 5732 1 10 . 1 1 137 137 PHE C C 137 174.936 174.936 173.109 1.827 25139 5733 1 10 . 1 1 137 137 PHE CA C 137 56.084 56.084 54.837 1.247 25139 5734 1 10 . 1 1 137 137 PHE CB C 137 44.696 44.696 41.276 3.421 25139 5735 1 10 . 1 1 138 138 ILE N N 138 117.417 117.417 115.878 1.539 25139 5736 1 10 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.582 -0.075 25139 5737 1 10 . 1 1 138 138 ILE C C 138 173.858 173.858 173.731 0.127 25139 5738 1 10 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.280 1.340 25139 5739 1 10 . 1 1 138 138 ILE CB C 138 42.597 42.597 40.963 1.634 25139 5740 1 10 . 1 1 138 138 ILE H H 138 8.777 8.777 8.954 -0.177 25139 5741 1 10 . 1 1 139 139 ASN N N 139 117.201 117.201 116.619 0.582 25139 5742 1 10 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.352 0.707 25139 5743 1 10 . 1 1 139 139 ASN C C 139 173.721 173.721 173.961 -0.240 25139 5744 1 10 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.648 -1.418 25139 5745 1 10 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.352 1.509 25139 5746 1 10 . 1 1 139 139 ASN H H 139 8.872 8.872 8.305 0.567 25139 5747 1 10 . 1 1 140 140 TYR N N 140 123.991 123.991 119.465 4.526 25139 5748 1 10 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.687 0.491 25139 5749 1 10 . 1 1 140 140 TYR C C 140 174.791 174.791 175.131 -0.340 25139 5750 1 10 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.288 -1.216 25139 5751 1 10 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.048 1.622 25139 5752 1 10 . 1 1 140 140 TYR H H 140 9.526 9.526 8.997 0.529 25139 5753 1 10 . 1 1 141 141 LEU N N 141 122.779 122.779 120.478 2.301 25139 5754 1 10 . 1 1 141 141 LEU C C 141 175.404 175.404 177.185 -1.781 25139 5755 1 10 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.861 2.243 25139 5756 1 10 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.127 -0.966 25139 5757 1 10 . 1 1 141 141 LEU H H 141 9.010 9.010 9.139 -0.129 25139 5758 1 10 . 1 1 142 142 THR N N 142 113.189 113.189 112.659 0.530 25139 5759 1 10 . 1 1 142 142 THR HA H 142 4.061 4.061 5.059 -0.998 25139 5760 1 10 . 1 1 142 142 THR C C 142 175.940 175.940 176.220 -0.280 25139 5761 1 10 . 1 1 142 142 THR CA C 142 61.389 61.389 60.311 1.078 25139 5762 1 10 . 1 1 142 142 THR CB C 142 69.779 69.779 71.493 -1.714 25139 5763 1 10 . 1 1 142 142 THR H H 142 7.737 7.737 8.207 -0.470 25139 5764 1 10 . 1 1 143 143 ARG N N 143 120.975 120.975 120.191 0.784 25139 5765 1 10 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.109 -0.171 25139 5766 1 10 . 1 1 143 143 ARG C C 143 178.690 178.690 177.271 1.419 25139 5767 1 10 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.100 1.648 25139 5768 1 10 . 1 1 143 143 ARG CB C 143 30.145 30.145 28.943 1.202 25139 5769 1 10 . 1 1 143 143 ARG H H 143 8.149 8.149 8.544 -0.395 25139 5770 1 10 . 1 1 144 144 GLU N N 144 116.997 116.997 118.355 -1.358 25139 5771 1 10 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.324 -0.215 25139 5772 1 10 . 1 1 144 144 GLU C C 144 178.442 178.442 177.675 0.767 25139 5773 1 10 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.264 1.599 25139 5774 1 10 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.745 -1.163 25139 5775 1 10 . 1 1 144 144 GLU H H 144 8.622 8.622 7.800 0.822 25139 5776 1 10 . 1 1 145 145 VAL N N 145 111.213 111.213 114.387 -3.174 25139 5777 1 10 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.123 0.288 25139 5778 1 10 . 1 1 145 145 VAL C C 145 176.965 176.965 176.733 0.232 25139 5779 1 10 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.689 -0.095 25139 5780 1 10 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.392 -0.310 25139 5781 1 10 . 1 1 145 145 VAL H H 145 7.227 7.227 7.631 -0.404 25139 5782 1 10 . 1 1 146 146 TYR N N 146 123.512 123.512 122.270 1.242 25139 5783 1 10 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.021 -0.141 25139 5784 1 10 . 1 1 146 146 TYR C C 146 176.377 176.377 176.768 -0.391 25139 5785 1 10 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.525 0.012 25139 5786 1 10 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.841 -0.502 25139 5787 1 10 . 1 1 146 146 TYR H H 146 8.492 8.492 8.682 -0.190 25139 5788 1 10 . 1 1 147 147 ARG N N 147 116.680 116.680 117.118 -0.438 25139 5789 1 10 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.822 -0.008 25139 5790 1 10 . 1 1 147 147 ARG C C 147 178.858 178.858 178.605 0.253 25139 5791 1 10 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.765 0.931 25139 5792 1 10 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.041 0.624 25139 5793 1 10 . 1 1 147 147 ARG H H 147 8.053 8.053 8.563 -0.510 25139 5794 1 10 . 1 1 148 148 SER N N 148 115.306 115.306 114.516 0.790 25139 5795 1 10 . 1 1 148 148 SER HA H 148 3.998 3.998 4.272 -0.274 25139 5796 1 10 . 1 1 148 148 SER C C 148 175.786 175.786 175.986 -0.200 25139 5797 1 10 . 1 1 148 148 SER CA C 148 62.006 62.006 60.417 1.589 25139 5798 1 10 . 1 1 148 148 SER H H 148 7.139 7.139 7.472 -0.333 25139 5799 1 10 . 1 1 149 149 TYR N N 149 123.207 123.207 122.181 1.026 25139 5800 1 10 . 1 1 149 149 TYR C C 149 175.831 175.831 178.123 -2.292 25139 5801 1 10 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.601 -1.001 25139 5802 1 10 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.478 0.303 25139 5803 1 10 . 1 1 149 149 TYR H H 149 7.253 7.253 7.909 -0.656 25139 5804 1 10 . 1 1 150 150 ARG N N 150 118.708 118.708 118.221 0.487 25139 5805 1 10 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.888 -0.542 25139 5806 1 10 . 1 1 150 150 ARG C C 150 177.644 177.644 177.913 -0.269 25139 5807 1 10 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.622 -0.299 25139 5808 1 10 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.211 -0.357 25139 5809 1 10 . 1 1 150 150 ARG H H 150 8.441 8.441 7.869 0.572 25139 5810 1 10 . 1 1 151 151 GLN N N 151 116.551 116.551 117.115 -0.564 25139 5811 1 10 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.051 -0.094 25139 5812 1 10 . 1 1 151 151 GLN C C 151 177.987 177.987 176.844 1.143 25139 5813 1 10 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.088 0.253 25139 5814 1 10 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.397 0.067 25139 5815 1 10 . 1 1 151 151 GLN H H 151 7.332 7.332 7.502 -0.170 25139 5816 1 10 . 1 1 152 152 LEU N N 152 118.877 118.877 114.580 4.297 25139 5817 1 10 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.604 -0.425 25139 5818 1 10 . 1 1 152 152 LEU C C 152 179.070 179.070 177.163 1.907 25139 5819 1 10 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.381 1.701 25139 5820 1 10 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.623 -0.936 25139 5821 1 10 . 1 1 152 152 LEU H H 152 7.106 7.106 7.257 -0.151 25139 5822 1 10 . 1 1 153 153 VAL N N 153 119.076 119.076 112.552 6.524 25139 5823 1 10 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.142 -1.282 25139 5824 1 10 . 1 1 153 153 VAL C C 153 177.421 177.421 175.891 1.530 25139 5825 1 10 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.458 3.125 25139 5826 1 10 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.214 -1.696 25139 5827 1 10 . 1 1 153 153 VAL H H 153 7.427 7.427 7.143 0.284 25139 5828 1 10 . 1 1 154 154 ASP N N 154 119.888 119.888 120.617 -0.729 25139 5829 1 10 . 1 1 154 154 ASP C C 154 177.422 177.422 175.205 2.217 25139 5830 1 10 . 1 1 154 154 ASP CA C 154 56.071 56.071 52.850 3.221 25139 5831 1 10 . 1 1 154 154 ASP CB C 154 40.349 40.349 43.916 -3.567 25139 5832 1 10 . 1 1 154 154 ASP H H 154 7.930 7.930 7.467 0.463 25139 5833 1 10 . 1 1 155 155 HIS N N 155 117.821 117.821 118.397 -0.576 25139 5834 1 10 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.381 2.375 25139 5835 1 10 . 1 1 155 155 HIS CB C 155 30.180 30.180 29.928 0.252 25139 5836 1 10 . 1 1 155 155 HIS H H 155 7.680 7.680 8.586 -0.906 25139 5837 1 10 . 1 1 156 156 HIS N N 156 119.180 119.180 120.038 -0.858 25139 5838 1 10 . 1 1 156 156 HIS CA C 156 57.931 57.931 57.377 0.554 25139 5839 1 10 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.058 0.242 25139 5840 1 10 . 1 1 156 156 HIS H H 156 7.868 7.868 8.079 -0.211 25139 5841 1 11 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.054 0.850 25139 5842 1 11 . 1 1 48 48 ALA CB C 48 19.222 19.222 17.848 1.374 25139 5843 1 11 . 1 1 49 49 ASP N N 49 119.661 119.661 120.294 -0.633 25139 5844 1 11 . 1 1 49 49 ASP CA C 49 54.277 54.277 53.183 1.094 25139 5845 1 11 . 1 1 49 49 ASP CB C 49 41.062 41.062 44.052 -2.990 25139 5846 1 11 . 1 1 49 49 ASP H H 49 8.462 8.462 8.005 0.457 25139 5847 1 11 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.122 -0.070 25139 5848 1 11 . 1 1 51 51 LEU C C 51 178.514 178.514 176.903 1.611 25139 5849 1 11 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.883 1.166 25139 5850 1 11 . 1 1 51 51 LEU CB C 51 41.193 41.193 40.684 0.509 25139 5851 1 11 . 1 1 52 52 ASN N N 52 113.819 113.819 113.849 -0.030 25139 5852 1 11 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.919 -0.084 25139 5853 1 11 . 1 1 52 52 ASN C C 52 175.964 175.964 175.449 0.515 25139 5854 1 11 . 1 1 52 52 ASN CA C 52 54.096 54.096 53.575 0.521 25139 5855 1 11 . 1 1 52 52 ASN CB C 52 38.883 38.883 41.131 -2.248 25139 5856 1 11 . 1 1 52 52 ASN H H 52 7.853 7.853 7.703 0.150 25139 5857 1 11 . 1 1 53 53 SER N N 53 114.357 114.357 114.336 0.021 25139 5858 1 11 . 1 1 53 53 SER CA C 53 59.908 59.908 58.635 1.273 25139 5859 1 11 . 1 1 53 53 SER CB C 53 64.395 64.395 64.008 0.387 25139 5860 1 11 . 1 1 53 53 SER H H 53 8.023 8.023 7.903 0.120 25139 5861 1 11 . 1 1 54 54 PHE N N 54 121.037 121.037 119.013 2.024 25139 5862 1 11 . 1 1 54 54 PHE C C 54 175.522 175.522 174.749 0.773 25139 5863 1 11 . 1 1 54 54 PHE CA C 54 58.064 58.064 55.884 2.180 25139 5864 1 11 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.751 -0.697 25139 5865 1 11 . 1 1 54 54 PHE H H 54 7.731 7.731 8.042 -0.311 25139 5866 1 11 . 1 1 55 55 THR N N 55 116.535 116.535 117.373 -0.838 25139 5867 1 11 . 1 1 55 55 THR HA H 55 4.654 4.654 5.035 -0.381 25139 5868 1 11 . 1 1 55 55 THR C C 55 173.301 173.301 173.266 0.035 25139 5869 1 11 . 1 1 55 55 THR CA C 55 61.420 61.420 61.272 0.148 25139 5870 1 11 . 1 1 55 55 THR CB C 55 71.388 71.388 71.464 -0.076 25139 5871 1 11 . 1 1 55 55 THR H H 55 8.929 8.929 9.177 -0.248 25139 5872 1 11 . 1 1 56 56 ALA N N 56 129.359 129.359 129.305 0.054 25139 5873 1 11 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.320 -0.005 25139 5874 1 11 . 1 1 56 56 ALA C C 56 178.305 178.305 176.992 1.313 25139 5875 1 11 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.167 0.704 25139 5876 1 11 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.380 -0.056 25139 5877 1 11 . 1 1 56 56 ALA H H 56 8.907 8.907 8.437 0.470 25139 5878 1 11 . 1 1 57 57 GLY N N 57 106.331 106.331 109.561 -3.230 25139 5879 1 11 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.435 1.176 25139 5880 1 11 . 1 1 57 57 GLY H H 57 7.978 7.978 8.279 -0.301 25139 5881 1 11 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.358 -0.034 25139 5882 1 11 . 1 1 59 59 PRO C C 59 177.466 177.466 177.874 -0.408 25139 5883 1 11 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.018 1.466 25139 5884 1 11 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.326 -0.591 25139 5885 1 11 . 1 1 60 60 GLY N N 60 109.688 109.688 109.175 0.513 25139 5886 1 11 . 1 1 60 60 GLY C C 60 173.555 173.555 173.230 0.325 25139 5887 1 11 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.243 0.298 25139 5888 1 11 . 1 1 60 60 GLY H H 60 8.402 8.402 8.530 -0.128 25139 5889 1 11 . 1 1 61 61 PHE N N 61 122.491 122.491 121.155 1.336 25139 5890 1 11 . 1 1 61 61 PHE C C 61 175.146 175.146 174.435 0.711 25139 5891 1 11 . 1 1 61 61 PHE CA C 61 58.282 58.282 57.022 1.260 25139 5892 1 11 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.499 -1.800 25139 5893 1 11 . 1 1 61 61 PHE H H 61 7.957 7.957 7.417 0.540 25139 5894 1 11 . 1 1 62 62 VAL N N 62 121.128 121.128 118.889 2.239 25139 5895 1 11 . 1 1 62 62 VAL HA H 62 5.085 5.085 4.994 0.091 25139 5896 1 11 . 1 1 62 62 VAL C C 62 174.937 174.937 174.846 0.091 25139 5897 1 11 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.976 0.732 25139 5898 1 11 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.529 0.903 25139 5899 1 11 . 1 1 62 62 VAL H H 62 7.994 7.994 9.032 -1.038 25139 5900 1 11 . 1 1 63 63 LEU N N 63 124.386 124.386 122.045 2.341 25139 5901 1 11 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.674 -1.358 25139 5902 1 11 . 1 1 63 63 LEU C C 63 175.278 175.278 177.496 -2.218 25139 5903 1 11 . 1 1 63 63 LEU CA C 63 56.288 56.288 56.422 -0.135 25139 5904 1 11 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.308 1.810 25139 5905 1 11 . 1 1 63 63 LEU H H 63 7.572 7.572 8.943 -1.371 25139 5906 1 11 . 1 1 64 64 ASP N N 64 126.746 126.746 125.919 0.827 25139 5907 1 11 . 1 1 64 64 ASP C C 64 177.801 177.801 176.909 0.892 25139 5908 1 11 . 1 1 64 64 ASP CA C 64 51.721 51.721 55.980 -4.259 25139 5909 1 11 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.728 -1.331 25139 5910 1 11 . 1 1 64 64 ASP H H 64 8.552 8.552 8.753 -0.201 25139 5911 1 11 . 1 1 65 65 THR C C 65 175.002 175.002 175.144 -0.142 25139 5912 1 11 . 1 1 65 65 THR CB C 65 67.919 67.919 67.049 0.870 25139 5913 1 11 . 1 1 66 66 GLN N N 66 120.804 120.804 120.328 0.476 25139 5914 1 11 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.940 -0.063 25139 5915 1 11 . 1 1 66 66 GLN C C 66 178.901 178.901 177.463 1.438 25139 5916 1 11 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.501 0.915 25139 5917 1 11 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.277 -0.353 25139 5918 1 11 . 1 1 66 66 GLN H H 66 8.447 8.447 8.170 0.277 25139 5919 1 11 . 1 1 67 67 ALA N N 67 121.267 121.267 121.617 -0.350 25139 5920 1 11 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.078 -0.121 25139 5921 1 11 . 1 1 67 67 ALA C C 67 176.777 176.777 178.701 -1.924 25139 5922 1 11 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.355 -0.031 25139 5923 1 11 . 1 1 67 67 ALA CB C 67 18.620 18.620 17.981 0.639 25139 5924 1 11 . 1 1 67 67 ALA H H 67 7.791 7.791 7.949 -0.158 25139 5925 1 11 . 1 1 68 68 SER N N 68 113.339 113.339 113.498 -0.159 25139 5926 1 11 . 1 1 68 68 SER HA H 68 4.061 4.061 4.159 -0.098 25139 5927 1 11 . 1 1 68 68 SER C C 68 175.875 175.875 176.377 -0.502 25139 5928 1 11 . 1 1 68 68 SER CA C 68 62.970 62.970 61.585 1.385 25139 5929 1 11 . 1 1 68 68 SER CB C 68 61.330 61.330 63.489 -2.159 25139 5930 1 11 . 1 1 68 68 SER H H 68 7.785 7.785 7.381 0.404 25139 5931 1 11 . 1 1 69 69 VAL N N 69 125.140 125.140 117.980 7.160 25139 5932 1 11 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.211 -0.135 25139 5933 1 11 . 1 1 69 69 VAL C C 69 176.384 176.384 176.783 -0.399 25139 5934 1 11 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.207 1.524 25139 5935 1 11 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.267 0.222 25139 5936 1 11 . 1 1 69 69 VAL H H 69 8.572 8.572 7.929 0.643 25139 5937 1 11 . 1 1 70 70 SER N N 70 116.704 116.704 114.129 2.575 25139 5938 1 11 . 1 1 70 70 SER HA H 70 4.229 4.229 4.234 -0.005 25139 5939 1 11 . 1 1 70 70 SER C C 70 174.101 174.101 175.526 -1.425 25139 5940 1 11 . 1 1 70 70 SER CA C 70 61.627 61.627 59.253 2.374 25139 5941 1 11 . 1 1 70 70 SER H H 70 7.951 7.951 7.737 0.214 25139 5942 1 11 . 1 1 71 71 ASN N N 71 117.576 117.576 117.050 0.526 25139 5943 1 11 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.659 0.143 25139 5944 1 11 . 1 1 71 71 ASN C C 71 174.332 174.332 174.813 -0.481 25139 5945 1 11 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.883 -0.444 25139 5946 1 11 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.839 0.628 25139 5947 1 11 . 1 1 71 71 ASN H H 71 7.131 7.131 7.493 -0.362 25139 5948 1 11 . 1 1 72 72 GLY N N 72 103.925 103.925 105.447 -1.522 25139 5949 1 11 . 1 1 72 72 GLY C C 72 174.710 174.710 173.531 1.179 25139 5950 1 11 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.554 -0.005 25139 5951 1 11 . 1 1 72 72 GLY H H 72 7.338 7.338 7.413 -0.075 25139 5952 1 11 . 1 1 73 73 ALA N N 73 124.942 124.942 123.139 1.803 25139 5953 1 11 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.586 -0.414 25139 5954 1 11 . 1 1 73 73 ALA C C 73 175.896 175.896 176.276 -0.380 25139 5955 1 11 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.929 0.744 25139 5956 1 11 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.133 -0.077 25139 5957 1 11 . 1 1 73 73 ALA H H 73 8.032 8.032 7.835 0.197 25139 5958 1 11 . 1 1 74 74 THR N N 74 113.423 113.423 116.385 -2.962 25139 5959 1 11 . 1 1 74 74 THR HA H 74 4.678 4.678 4.581 0.097 25139 5960 1 11 . 1 1 74 74 THR C C 74 173.339 173.339 173.291 0.048 25139 5961 1 11 . 1 1 74 74 THR CA C 74 61.545 61.545 60.612 0.933 25139 5962 1 11 . 1 1 74 74 THR CB C 74 71.319 71.319 71.711 -0.392 25139 5963 1 11 . 1 1 74 74 THR H H 74 8.530 8.530 8.250 0.280 25139 5964 1 11 . 1 1 75 75 PHE N N 75 128.180 128.180 129.357 -1.177 25139 5965 1 11 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.868 -0.264 25139 5966 1 11 . 1 1 75 75 PHE C C 75 174.623 174.623 174.990 -0.367 25139 5967 1 11 . 1 1 75 75 PHE CA C 75 57.616 57.616 57.871 -0.255 25139 5968 1 11 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.998 -0.323 25139 5969 1 11 . 1 1 75 75 PHE H H 75 9.146 9.146 9.128 0.018 25139 5970 1 11 . 1 1 76 76 LEU N N 76 127.849 127.849 125.558 2.291 25139 5971 1 11 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.575 -0.224 25139 5972 1 11 . 1 1 76 76 LEU C C 76 176.339 176.339 176.271 0.068 25139 5973 1 11 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.214 0.769 25139 5974 1 11 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.483 -0.153 25139 5975 1 11 . 1 1 76 76 LEU H H 76 8.635 8.635 8.104 0.531 25139 5976 1 11 . 1 1 77 77 GLU N N 77 115.131 115.131 120.250 -5.119 25139 5977 1 11 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.402 0.006 25139 5978 1 11 . 1 1 77 77 GLU C C 77 174.734 174.734 174.564 0.170 25139 5979 1 11 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.117 1.236 25139 5980 1 11 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.460 0.747 25139 5981 1 11 . 1 1 77 77 GLU H H 77 7.252 7.252 7.465 -0.213 25139 5982 1 11 . 1 1 78 78 SER N N 78 118.016 118.016 118.896 -0.880 25139 5983 1 11 . 1 1 78 78 SER HA H 78 5.561 5.561 5.225 0.336 25139 5984 1 11 . 1 1 78 78 SER C C 78 171.968 171.968 173.293 -1.325 25139 5985 1 11 . 1 1 78 78 SER CA C 78 54.061 54.061 55.666 -1.605 25139 5986 1 11 . 1 1 78 78 SER CB C 78 64.074 64.074 63.311 0.763 25139 5987 1 11 . 1 1 78 78 SER H H 78 9.033 9.033 8.779 0.254 25139 5988 1 11 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.460 -0.860 25139 5989 1 11 . 1 1 79 79 PRO CB C 79 32.410 32.410 31.721 0.689 25139 5990 1 11 . 1 1 80 80 THR N N 80 118.079 118.079 114.568 3.511 25139 5991 1 11 . 1 1 80 80 THR HA H 80 4.342 4.342 3.817 0.525 25139 5992 1 11 . 1 1 80 80 THR C C 80 174.494 174.494 174.362 0.132 25139 5993 1 11 . 1 1 80 80 THR CA C 80 61.453 61.453 62.294 -0.841 25139 5994 1 11 . 1 1 80 80 THR CB C 80 67.797 67.797 68.666 -0.869 25139 5995 1 11 . 1 1 80 80 THR H H 80 8.670 8.670 7.608 1.062 25139 5996 1 11 . 1 1 81 81 VAL N N 81 117.395 117.395 114.163 3.232 25139 5997 1 11 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.870 0.737 25139 5998 1 11 . 1 1 81 81 VAL C C 81 175.518 175.518 176.151 -0.633 25139 5999 1 11 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.865 -3.751 25139 6000 1 11 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.555 2.040 25139 6001 1 11 . 1 1 81 81 VAL H H 81 7.448 7.448 7.481 -0.033 25139 6002 1 11 . 1 1 82 82 ARG N N 82 117.852 117.852 118.437 -0.585 25139 6003 1 11 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.641 -0.120 25139 6004 1 11 . 1 1 82 82 ARG C C 82 176.992 176.992 176.212 0.780 25139 6005 1 11 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.498 0.887 25139 6006 1 11 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.361 1.241 25139 6007 1 11 . 1 1 82 82 ARG H H 82 8.710 8.710 8.622 0.088 25139 6008 1 11 . 1 1 83 83 ARG N N 83 117.035 117.035 118.103 -1.068 25139 6009 1 11 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.748 0.574 25139 6010 1 11 . 1 1 83 83 ARG C C 83 177.379 177.379 176.513 0.866 25139 6011 1 11 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.765 -1.081 25139 6012 1 11 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.006 -0.965 25139 6013 1 11 . 1 1 83 83 ARG H H 83 7.292 7.292 7.726 -0.434 25139 6014 1 11 . 1 1 84 84 GLY N N 84 114.911 114.911 110.017 4.894 25139 6015 1 11 . 1 1 84 84 GLY C C 84 176.940 176.940 175.104 1.836 25139 6016 1 11 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.643 2.029 25139 6017 1 11 . 1 1 84 84 GLY H H 84 9.255 9.255 8.449 0.806 25139 6018 1 11 . 1 1 85 85 TRP N N 85 121.810 121.810 120.396 1.414 25139 6019 1 11 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.169 -0.002 25139 6020 1 11 . 1 1 85 85 TRP C C 85 178.272 178.272 177.957 0.315 25139 6021 1 11 . 1 1 85 85 TRP CA C 85 60.045 60.045 60.165 -0.120 25139 6022 1 11 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.052 0.165 25139 6023 1 11 . 1 1 85 85 TRP H H 85 9.963 9.963 7.403 2.560 25139 6024 1 11 . 1 1 86 86 ASP N N 86 116.400 116.400 119.008 -2.608 25139 6025 1 11 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.427 -0.034 25139 6026 1 11 . 1 1 86 86 ASP C C 86 178.803 178.803 178.029 0.774 25139 6027 1 11 . 1 1 86 86 ASP CA C 86 57.054 57.054 57.058 -0.004 25139 6028 1 11 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.143 0.590 25139 6029 1 11 . 1 1 86 86 ASP H H 86 6.934 6.934 8.075 -1.141 25139 6030 1 11 . 1 1 87 87 CYS N N 87 122.454 122.454 119.738 2.716 25139 6031 1 11 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.268 -0.018 25139 6032 1 11 . 1 1 87 87 CYS C C 87 174.956 174.956 176.512 -1.556 25139 6033 1 11 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.869 -3.722 25139 6034 1 11 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.263 11.222 25139 6035 1 11 . 1 1 87 87 CYS H H 87 7.603 7.603 7.503 0.100 25139 6036 1 11 . 1 1 88 88 VAL N N 88 119.192 119.192 120.951 -1.759 25139 6037 1 11 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.227 -0.769 25139 6038 1 11 . 1 1 88 88 VAL C C 88 177.413 177.413 178.026 -0.613 25139 6039 1 11 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.196 0.780 25139 6040 1 11 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.779 -0.537 25139 6041 1 11 . 1 1 88 88 VAL H H 88 7.192 7.192 7.961 -0.769 25139 6042 1 11 . 1 1 89 89 ARG N N 89 118.185 118.185 118.576 -0.391 25139 6043 1 11 . 1 1 89 89 ARG HA H 89 3.680 3.680 4.018 -0.338 25139 6044 1 11 . 1 1 89 89 ARG C C 89 178.677 178.677 178.425 0.252 25139 6045 1 11 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.173 0.782 25139 6046 1 11 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.167 0.624 25139 6047 1 11 . 1 1 89 89 ARG H H 89 7.971 7.971 8.167 -0.196 25139 6048 1 11 . 1 1 90 90 ALA N N 90 120.815 120.815 123.216 -2.401 25139 6049 1 11 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.125 -0.050 25139 6050 1 11 . 1 1 90 90 ALA C C 90 177.416 177.416 179.087 -1.671 25139 6051 1 11 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.852 -0.598 25139 6052 1 11 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.241 -0.804 25139 6053 1 11 . 1 1 90 90 ALA H H 90 7.453 7.453 7.523 -0.070 25139 6054 1 11 . 1 1 91 91 CYS N N 91 120.380 120.380 115.939 4.441 25139 6055 1 11 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.240 0.131 25139 6056 1 11 . 1 1 91 91 CYS C C 91 176.654 176.654 175.672 0.982 25139 6057 1 11 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.285 -3.590 25139 6058 1 11 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.533 12.171 25139 6059 1 11 . 1 1 91 91 CYS H H 91 7.944 7.944 7.479 0.465 25139 6060 1 11 . 1 1 92 92 CYS N N 92 116.270 116.270 116.100 0.170 25139 6061 1 11 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.499 -0.095 25139 6062 1 11 . 1 1 92 92 CYS C C 92 175.628 175.628 176.212 -0.584 25139 6063 1 11 . 1 1 92 92 CYS CA C 92 58.706 58.706 59.892 -1.186 25139 6064 1 11 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.757 15.392 25139 6065 1 11 . 1 1 92 92 CYS H H 92 8.315 8.315 7.662 0.653 25139 6066 1 11 . 1 1 93 93 THR N N 93 107.283 107.283 110.758 -3.475 25139 6067 1 11 . 1 1 93 93 THR HA H 93 4.481 4.481 4.373 0.108 25139 6068 1 11 . 1 1 93 93 THR C C 93 173.606 173.606 175.099 -1.493 25139 6069 1 11 . 1 1 93 93 THR CA C 93 61.402 61.402 62.650 -1.248 25139 6070 1 11 . 1 1 93 93 THR CB C 93 69.046 69.046 70.132 -1.086 25139 6071 1 11 . 1 1 93 93 THR H H 93 7.445 7.445 7.442 0.003 25139 6072 1 11 . 1 1 94 94 THR N N 94 121.432 121.432 120.954 0.478 25139 6073 1 11 . 1 1 94 94 THR HA H 94 4.398 4.398 4.452 -0.054 25139 6074 1 11 . 1 1 94 94 THR C C 94 173.493 173.493 174.962 -1.469 25139 6075 1 11 . 1 1 94 94 THR CA C 94 62.726 62.726 62.660 0.067 25139 6076 1 11 . 1 1 94 94 THR CB C 94 69.704 69.704 68.638 1.066 25139 6077 1 11 . 1 1 94 94 THR H H 94 7.553 7.553 8.001 -0.448 25139 6078 1 11 . 1 1 95 95 GLN N N 95 129.410 129.410 128.728 0.682 25139 6079 1 11 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.071 -0.127 25139 6080 1 11 . 1 1 95 95 GLN C C 95 176.293 176.293 176.522 -0.229 25139 6081 1 11 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.750 -0.710 25139 6082 1 11 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.741 -0.485 25139 6083 1 11 . 1 1 95 95 GLN H H 95 8.812 8.812 9.007 -0.195 25139 6084 1 11 . 1 1 96 96 ASN N N 96 115.015 115.015 113.998 1.017 25139 6085 1 11 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.746 -0.547 25139 6086 1 11 . 1 1 96 96 ASN C C 96 172.260 172.260 173.736 -1.476 25139 6087 1 11 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.086 2.481 25139 6088 1 11 . 1 1 96 96 ASN CB C 96 36.837 36.837 39.005 -2.168 25139 6089 1 11 . 1 1 96 96 ASN H H 96 8.791 8.791 8.084 0.707 25139 6090 1 11 . 1 1 97 97 CYS N N 97 115.830 115.830 120.846 -5.016 25139 6091 1 11 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.480 -0.379 25139 6092 1 11 . 1 1 97 97 CYS C C 97 175.025 175.025 173.750 1.275 25139 6093 1 11 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.947 -1.799 25139 6094 1 11 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.993 16.241 25139 6095 1 11 . 1 1 97 97 CYS H H 97 7.651 7.651 7.653 -0.002 25139 6096 1 11 . 1 1 98 98 ASN N N 98 125.148 125.148 124.748 0.400 25139 6097 1 11 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.120 0.013 25139 6098 1 11 . 1 1 98 98 ASN C C 98 171.892 171.892 174.259 -2.367 25139 6099 1 11 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.586 -0.392 25139 6100 1 11 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.734 -1.786 25139 6101 1 11 . 1 1 98 98 ASN H H 98 8.736 8.736 8.442 0.294 25139 6102 1 11 . 1 1 99 99 LEU N N 99 120.898 120.898 121.369 -0.471 25139 6103 1 11 . 1 1 99 99 LEU C C 99 173.084 173.084 173.988 -0.904 25139 6104 1 11 . 1 1 99 99 LEU CA C 99 56.120 56.120 54.002 2.118 25139 6105 1 11 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.490 -1.162 25139 6106 1 11 . 1 1 99 99 LEU H H 99 8.200 8.200 8.055 0.145 25139 6107 1 11 . 1 1 100 100 ALA N N 100 128.085 128.085 130.227 -2.142 25139 6108 1 11 . 1 1 100 100 ALA C C 100 174.938 174.938 175.635 -0.697 25139 6109 1 11 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.468 -0.721 25139 6110 1 11 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.389 0.325 25139 6111 1 11 . 1 1 100 100 ALA H H 100 9.156 9.156 8.979 0.177 25139 6112 1 11 . 1 1 101 101 LEU N N 101 128.723 128.723 128.523 0.200 25139 6113 1 11 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.220 -0.078 25139 6114 1 11 . 1 1 101 101 LEU C C 101 174.379 174.379 175.246 -0.867 25139 6115 1 11 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.390 -0.537 25139 6116 1 11 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.987 0.320 25139 6117 1 11 . 1 1 101 101 LEU H H 101 9.578 9.578 8.967 0.611 25139 6118 1 11 . 1 1 102 102 VAL N N 102 119.417 119.417 120.755 -1.338 25139 6119 1 11 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.269 0.259 25139 6120 1 11 . 1 1 102 102 VAL C C 102 173.660 173.660 174.059 -0.399 25139 6121 1 11 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.108 -0.488 25139 6122 1 11 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.050 -1.777 25139 6123 1 11 . 1 1 102 102 VAL H H 102 9.297 9.297 9.122 0.175 25139 6124 1 11 . 1 1 103 103 GLU N N 103 124.427 124.427 123.361 1.066 25139 6125 1 11 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.378 -0.513 25139 6126 1 11 . 1 1 103 103 GLU C C 103 176.319 176.319 174.981 1.338 25139 6127 1 11 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.405 -0.304 25139 6128 1 11 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.796 0.405 25139 6129 1 11 . 1 1 103 103 GLU H H 103 7.749 7.749 8.412 -0.663 25139 6130 1 11 . 1 1 104 104 LEU N N 104 127.294 127.294 125.939 1.355 25139 6131 1 11 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.358 -0.038 25139 6132 1 11 . 1 1 104 104 LEU C C 104 176.593 176.593 176.987 -0.394 25139 6133 1 11 . 1 1 104 104 LEU CA C 104 56.084 56.084 54.465 1.619 25139 6134 1 11 . 1 1 104 104 LEU CB C 104 42.391 42.391 43.106 -0.716 25139 6135 1 11 . 1 1 104 104 LEU H H 104 8.323 8.323 8.134 0.189 25139 6136 1 11 . 1 1 105 105 GLN N N 105 121.361 121.361 115.906 5.455 25139 6137 1 11 . 1 1 105 105 GLN C C 105 172.868 172.868 174.472 -1.604 25139 6138 1 11 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.662 -3.256 25139 6139 1 11 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.471 3.258 25139 6140 1 11 . 1 1 105 105 GLN H H 105 8.095 8.095 8.276 -0.181 25139 6141 1 11 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.512 -0.103 25139 6142 1 11 . 1 1 106 106 PRO C C 106 177.770 177.770 176.929 0.841 25139 6143 1 11 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.413 0.072 25139 6144 1 11 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.118 -0.350 25139 6145 1 11 . 1 1 107 107 ASP N N 107 116.484 116.484 116.561 -0.077 25139 6146 1 11 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.568 -0.128 25139 6147 1 11 . 1 1 107 107 ASP C C 107 176.749 176.749 175.813 0.936 25139 6148 1 11 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.404 0.052 25139 6149 1 11 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.151 -1.263 25139 6150 1 11 . 1 1 107 107 ASP H H 107 8.638 8.638 8.544 0.094 25139 6151 1 11 . 1 1 108 108 ARG N N 108 117.895 117.895 120.483 -2.588 25139 6152 1 11 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.715 -0.225 25139 6153 1 11 . 1 1 108 108 ARG C C 108 176.111 176.111 176.875 -0.764 25139 6154 1 11 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.180 0.085 25139 6155 1 11 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.033 0.043 25139 6156 1 11 . 1 1 108 108 ARG H H 108 7.905 7.905 8.333 -0.428 25139 6157 1 11 . 1 1 109 109 GLY N N 109 108.307 108.307 109.179 -0.872 25139 6158 1 11 . 1 1 109 109 GLY C C 109 173.949 173.949 174.365 -0.416 25139 6159 1 11 . 1 1 109 109 GLY CA C 109 44.551 44.551 46.015 -1.464 25139 6160 1 11 . 1 1 109 109 GLY H H 109 7.753 7.753 8.290 -0.537 25139 6161 1 11 . 1 1 110 110 GLU N N 110 120.035 120.035 122.507 -2.472 25139 6162 1 11 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.406 -0.315 25139 6163 1 11 . 1 1 110 110 GLU C C 110 177.045 177.045 176.517 0.528 25139 6164 1 11 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.175 2.107 25139 6165 1 11 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.478 -1.805 25139 6166 1 11 . 1 1 110 110 GLU H H 110 8.509 8.509 8.102 0.407 25139 6167 1 11 . 1 1 111 111 ASP N N 111 121.160 121.160 121.755 -0.595 25139 6168 1 11 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.324 0.246 25139 6169 1 11 . 1 1 111 111 ASP C C 111 175.089 175.089 175.509 -0.420 25139 6170 1 11 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.839 -2.248 25139 6171 1 11 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.472 0.959 25139 6172 1 11 . 1 1 111 111 ASP H H 111 8.916 8.916 8.514 0.402 25139 6173 1 11 . 1 1 112 112 ALA N N 112 122.130 122.130 119.642 2.488 25139 6174 1 11 . 1 1 112 112 ALA C C 112 178.120 178.120 176.094 2.026 25139 6175 1 11 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.619 2.640 25139 6176 1 11 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.093 -1.323 25139 6177 1 11 . 1 1 112 112 ALA H H 112 7.361 7.361 7.587 -0.226 25139 6178 1 11 . 1 1 113 113 ILE N N 113 113.780 113.780 115.207 -1.427 25139 6179 1 11 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.733 0.153 25139 6180 1 11 . 1 1 113 113 ILE C C 113 174.258 174.258 174.828 -0.570 25139 6181 1 11 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.319 0.193 25139 6182 1 11 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.817 0.031 25139 6183 1 11 . 1 1 113 113 ILE H H 113 7.667 7.667 8.073 -0.406 25139 6184 1 11 . 1 1 114 114 ALA N N 114 122.673 122.673 123.745 -1.072 25139 6185 1 11 . 1 1 114 114 ALA C C 114 176.984 176.984 176.445 0.539 25139 6186 1 11 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.226 -1.662 25139 6187 1 11 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.728 0.854 25139 6188 1 11 . 1 1 114 114 ALA H H 114 8.904 8.904 8.898 0.006 25139 6189 1 11 . 1 1 115 115 ALA N N 115 116.486 116.486 115.505 0.981 25139 6190 1 11 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.447 -0.092 25139 6191 1 11 . 1 1 115 115 ALA C C 115 174.138 174.138 174.039 0.099 25139 6192 1 11 . 1 1 115 115 ALA CA C 115 52.320 52.320 51.120 1.200 25139 6193 1 11 . 1 1 115 115 ALA CB C 115 22.983 22.983 20.926 2.057 25139 6194 1 11 . 1 1 115 115 ALA H H 115 7.182 7.182 7.286 -0.104 25139 6195 1 11 . 1 1 116 116 CYS N N 116 120.099 120.099 120.231 -0.132 25139 6196 1 11 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.398 -0.067 25139 6197 1 11 . 1 1 116 116 CYS C C 116 176.609 176.609 172.340 4.269 25139 6198 1 11 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.640 -2.691 25139 6199 1 11 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.356 12.028 25139 6200 1 11 . 1 1 116 116 CYS H H 116 8.298 8.298 7.889 0.409 25139 6201 1 11 . 1 1 117 117 PHE N N 117 126.406 126.406 125.731 0.675 25139 6202 1 11 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.205 -0.006 25139 6203 1 11 . 1 1 117 117 PHE C C 117 173.385 173.385 174.308 -0.923 25139 6204 1 11 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.096 0.158 25139 6205 1 11 . 1 1 117 117 PHE CB C 117 41.681 41.681 42.383 -0.702 25139 6206 1 11 . 1 1 117 117 PHE H H 117 9.712 9.712 9.185 0.527 25139 6207 1 11 . 1 1 118 118 LEU N N 118 122.119 122.119 122.596 -0.477 25139 6208 1 11 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.510 -0.344 25139 6209 1 11 . 1 1 118 118 LEU C C 118 175.097 175.097 176.106 -1.009 25139 6210 1 11 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.021 -0.117 25139 6211 1 11 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.685 -1.387 25139 6212 1 11 . 1 1 118 118 LEU H H 118 8.719 8.719 9.107 -0.388 25139 6213 1 11 . 1 1 119 119 ILE N N 119 125.324 125.324 122.472 2.852 25139 6214 1 11 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.968 -0.091 25139 6215 1 11 . 1 1 119 119 ILE C C 119 173.825 173.825 175.296 -1.471 25139 6216 1 11 . 1 1 119 119 ILE CA C 119 59.107 59.107 60.080 -0.973 25139 6217 1 11 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.386 -0.876 25139 6218 1 11 . 1 1 119 119 ILE H H 119 8.986 8.986 9.135 -0.149 25139 6219 1 11 . 1 1 120 120 ASN N N 120 121.534 121.534 124.154 -2.620 25139 6220 1 11 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.800 0.590 25139 6221 1 11 . 1 1 120 120 ASN C C 120 176.098 176.098 175.843 0.255 25139 6222 1 11 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.037 -3.580 25139 6223 1 11 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.845 1.073 25139 6224 1 11 . 1 1 120 120 ASN H H 120 8.694 8.694 9.061 -0.367 25139 6225 1 11 . 1 1 121 121 CYS N N 121 122.779 122.779 116.653 6.126 25139 6226 1 11 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.080 0.403 25139 6227 1 11 . 1 1 121 121 CYS C C 121 173.195 173.195 173.279 -0.084 25139 6228 1 11 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.961 -4.197 25139 6229 1 11 . 1 1 121 121 CYS CB C 121 41.707 41.707 26.002 15.705 25139 6230 1 11 . 1 1 121 121 CYS H H 121 10.668 10.668 8.576 2.092 25139 6231 1 11 . 1 1 122 122 LEU N N 122 121.063 121.063 117.431 3.632 25139 6232 1 11 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.458 -0.093 25139 6233 1 11 . 1 1 122 122 LEU C C 122 176.743 176.743 175.753 0.990 25139 6234 1 11 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.958 0.706 25139 6235 1 11 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.273 -1.039 25139 6236 1 11 . 1 1 122 122 LEU H H 122 8.256 8.256 7.413 0.843 25139 6237 1 11 . 1 1 123 123 TYR N N 123 123.081 123.081 123.464 -0.383 25139 6238 1 11 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.744 -0.701 25139 6239 1 11 . 1 1 123 123 TYR C C 123 173.633 173.633 174.971 -1.338 25139 6240 1 11 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.068 -0.180 25139 6241 1 11 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.496 -0.415 25139 6242 1 11 . 1 1 123 123 TYR H H 123 8.990 8.990 8.888 0.102 25139 6243 1 11 . 1 1 124 124 GLU N N 124 128.742 128.742 127.499 1.243 25139 6244 1 11 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.778 -0.228 25139 6245 1 11 . 1 1 124 124 GLU C C 124 174.835 174.835 175.452 -0.617 25139 6246 1 11 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.578 0.054 25139 6247 1 11 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.718 -0.823 25139 6248 1 11 . 1 1 124 124 GLU H H 124 9.135 9.135 8.816 0.319 25139 6249 1 11 . 1 1 125 125 GLN N N 125 108.066 108.066 109.235 -1.169 25139 6250 1 11 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.908 -0.187 25139 6251 1 11 . 1 1 125 125 GLN C C 125 174.627 174.627 174.804 -0.177 25139 6252 1 11 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.559 0.480 25139 6253 1 11 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.079 0.249 25139 6254 1 11 . 1 1 125 125 GLN H H 125 8.390 8.390 8.533 -0.143 25139 6255 1 11 . 1 1 126 126 ASN N N 126 118.528 118.528 118.004 0.524 25139 6256 1 11 . 1 1 126 126 ASN C C 126 173.713 173.713 175.055 -1.342 25139 6257 1 11 . 1 1 126 126 ASN CA C 126 52.189 52.189 53.162 -0.973 25139 6258 1 11 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.544 1.257 25139 6259 1 11 . 1 1 126 126 ASN H H 126 8.092 8.092 8.010 0.082 25139 6260 1 11 . 1 1 127 127 PHE N N 127 124.680 124.680 122.385 2.295 25139 6261 1 11 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.769 0.268 25139 6262 1 11 . 1 1 127 127 PHE C C 127 177.125 177.125 176.393 0.732 25139 6263 1 11 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.886 1.527 25139 6264 1 11 . 1 1 127 127 PHE CB C 127 39.244 39.244 37.934 1.310 25139 6265 1 11 . 1 1 127 127 PHE H H 127 9.026 9.026 8.890 0.136 25139 6266 1 11 . 1 1 128 128 VAL N N 128 119.455 119.455 119.327 0.128 25139 6267 1 11 . 1 1 128 128 VAL C C 128 175.886 175.886 175.386 0.500 25139 6268 1 11 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.895 -0.976 25139 6269 1 11 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.884 2.310 25139 6270 1 11 . 1 1 128 128 VAL H H 128 8.364 8.364 7.643 0.721 25139 6271 1 11 . 1 1 129 129 CYS N N 129 116.130 116.130 119.954 -3.824 25139 6272 1 11 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.807 -0.330 25139 6273 1 11 . 1 1 129 129 CYS C C 129 170.569 170.569 174.222 -3.653 25139 6274 1 11 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.592 -3.442 25139 6275 1 11 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.509 19.108 25139 6276 1 11 . 1 1 129 129 CYS H H 129 5.390 5.390 7.235 -1.845 25139 6277 1 11 . 1 1 130 130 LYS N N 130 120.071 120.071 126.921 -6.850 25139 6278 1 11 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.194 0.367 25139 6279 1 11 . 1 1 130 130 LYS C C 130 176.853 176.853 174.543 2.310 25139 6280 1 11 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.903 -0.016 25139 6281 1 11 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.438 1.204 25139 6282 1 11 . 1 1 130 130 LYS H H 130 8.066 8.066 8.519 -0.453 25139 6283 1 11 . 1 1 131 131 PHE N N 131 118.415 118.415 120.169 -1.754 25139 6284 1 11 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.442 -0.835 25139 6285 1 11 . 1 1 131 131 PHE C C 131 174.013 174.013 175.083 -1.070 25139 6286 1 11 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.177 1.534 25139 6287 1 11 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.385 0.695 25139 6288 1 11 . 1 1 131 131 PHE H H 131 8.714 8.714 8.252 0.462 25139 6289 1 11 . 1 1 132 132 ALA N N 132 124.209 124.209 122.588 1.621 25139 6290 1 11 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.017 -0.400 25139 6291 1 11 . 1 1 132 132 ALA C C 132 174.352 174.352 174.280 0.072 25139 6292 1 11 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.657 1.784 25139 6293 1 11 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.866 -0.402 25139 6294 1 11 . 1 1 132 132 ALA H H 132 9.295 9.295 9.100 0.195 25139 6295 1 11 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.197 -0.314 25139 6296 1 11 . 1 1 133 133 PRO C C 133 173.923 173.923 176.228 -2.305 25139 6297 1 11 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.452 0.619 25139 6298 1 11 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.490 -0.887 25139 6299 1 11 . 1 1 134 134 ARG N N 134 126.071 126.071 120.826 5.245 25139 6300 1 11 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.516 -0.261 25139 6301 1 11 . 1 1 134 134 ARG C C 134 177.065 177.065 176.922 0.143 25139 6302 1 11 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.617 2.547 25139 6303 1 11 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.096 -0.913 25139 6304 1 11 . 1 1 134 134 ARG H H 134 8.672 8.672 8.436 0.236 25139 6305 1 11 . 1 1 135 135 GLU N N 135 125.683 125.683 121.542 4.141 25139 6306 1 11 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.354 -0.001 25139 6307 1 11 . 1 1 135 135 GLU C C 135 178.081 178.081 176.895 1.186 25139 6308 1 11 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.497 0.154 25139 6309 1 11 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.770 0.226 25139 6310 1 11 . 1 1 135 135 GLU H H 135 8.603 8.603 8.910 -0.307 25139 6311 1 11 . 1 1 136 136 GLY N N 136 110.031 110.031 105.524 4.507 25139 6312 1 11 . 1 1 136 136 GLY C C 136 173.079 173.079 173.976 -0.897 25139 6313 1 11 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.759 1.019 25139 6314 1 11 . 1 1 136 136 GLY H H 136 9.036 9.036 8.078 0.958 25139 6315 1 11 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.373 1.302 25139 6316 1 11 . 1 1 137 137 PHE C C 137 174.936 174.936 175.516 -0.580 25139 6317 1 11 . 1 1 137 137 PHE CA C 137 56.084 56.084 58.847 -2.763 25139 6318 1 11 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.506 5.190 25139 6319 1 11 . 1 1 138 138 ILE N N 138 117.417 117.417 114.998 2.419 25139 6320 1 11 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.623 -0.116 25139 6321 1 11 . 1 1 138 138 ILE C C 138 173.858 173.858 173.902 -0.044 25139 6322 1 11 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.514 1.105 25139 6323 1 11 . 1 1 138 138 ILE CB C 138 42.597 42.597 40.830 1.767 25139 6324 1 11 . 1 1 138 138 ILE H H 138 8.777 8.777 7.847 0.930 25139 6325 1 11 . 1 1 139 139 ASN N N 139 117.201 117.201 116.265 0.936 25139 6326 1 11 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.551 0.508 25139 6327 1 11 . 1 1 139 139 ASN C C 139 173.721 173.721 173.652 0.069 25139 6328 1 11 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.510 -1.280 25139 6329 1 11 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.073 1.788 25139 6330 1 11 . 1 1 139 139 ASN H H 139 8.872 8.872 8.171 0.701 25139 6331 1 11 . 1 1 140 140 TYR N N 140 123.991 123.991 117.842 6.149 25139 6332 1 11 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.734 0.444 25139 6333 1 11 . 1 1 140 140 TYR C C 140 174.791 174.791 175.239 -0.448 25139 6334 1 11 . 1 1 140 140 TYR CA C 140 57.072 57.072 57.788 -0.716 25139 6335 1 11 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.211 1.459 25139 6336 1 11 . 1 1 140 140 TYR H H 140 9.526 9.526 8.578 0.948 25139 6337 1 11 . 1 1 141 141 LEU N N 141 122.779 122.779 121.773 1.006 25139 6338 1 11 . 1 1 141 141 LEU C C 141 175.404 175.404 177.437 -2.033 25139 6339 1 11 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.842 2.261 25139 6340 1 11 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.073 -0.912 25139 6341 1 11 . 1 1 141 141 LEU H H 141 9.010 9.010 9.038 -0.028 25139 6342 1 11 . 1 1 142 142 THR N N 142 113.189 113.189 111.474 1.715 25139 6343 1 11 . 1 1 142 142 THR HA H 142 4.061 4.061 4.053 0.008 25139 6344 1 11 . 1 1 142 142 THR C C 142 175.940 175.940 176.447 -0.507 25139 6345 1 11 . 1 1 142 142 THR CA C 142 61.389 61.389 60.795 0.594 25139 6346 1 11 . 1 1 142 142 THR CB C 142 69.779 69.779 70.114 -0.335 25139 6347 1 11 . 1 1 142 142 THR H H 142 7.737 7.737 7.967 -0.230 25139 6348 1 11 . 1 1 143 143 ARG N N 143 120.975 120.975 119.444 1.531 25139 6349 1 11 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.963 -0.025 25139 6350 1 11 . 1 1 143 143 ARG C C 143 178.690 178.690 177.441 1.249 25139 6351 1 11 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.068 0.680 25139 6352 1 11 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.668 0.477 25139 6353 1 11 . 1 1 143 143 ARG H H 143 8.149 8.149 8.183 -0.034 25139 6354 1 11 . 1 1 144 144 GLU N N 144 116.997 116.997 118.117 -1.120 25139 6355 1 11 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.285 -0.176 25139 6356 1 11 . 1 1 144 144 GLU C C 144 178.442 178.442 178.321 0.121 25139 6357 1 11 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.757 1.106 25139 6358 1 11 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.246 -0.664 25139 6359 1 11 . 1 1 144 144 GLU H H 144 8.622 8.622 7.698 0.924 25139 6360 1 11 . 1 1 145 145 VAL N N 145 111.213 111.213 116.603 -5.390 25139 6361 1 11 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.867 0.544 25139 6362 1 11 . 1 1 145 145 VAL C C 145 176.965 176.965 176.997 -0.032 25139 6363 1 11 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.499 -0.905 25139 6364 1 11 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.290 0.793 25139 6365 1 11 . 1 1 145 145 VAL H H 145 7.227 7.227 7.854 -0.627 25139 6366 1 11 . 1 1 146 146 TYR N N 146 123.512 123.512 121.862 1.650 25139 6367 1 11 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.032 -0.152 25139 6368 1 11 . 1 1 146 146 TYR C C 146 176.377 176.377 176.845 -0.468 25139 6369 1 11 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.222 0.315 25139 6370 1 11 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.725 -0.386 25139 6371 1 11 . 1 1 146 146 TYR H H 146 8.492 8.492 8.466 0.026 25139 6372 1 11 . 1 1 147 147 ARG N N 147 116.680 116.680 117.015 -0.335 25139 6373 1 11 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.862 -0.048 25139 6374 1 11 . 1 1 147 147 ARG C C 147 178.858 178.858 178.515 0.343 25139 6375 1 11 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.407 0.289 25139 6376 1 11 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.817 -0.152 25139 6377 1 11 . 1 1 147 147 ARG H H 147 8.053 8.053 8.342 -0.289 25139 6378 1 11 . 1 1 148 148 SER N N 148 115.306 115.306 115.395 -0.089 25139 6379 1 11 . 1 1 148 148 SER HA H 148 3.998 3.998 4.176 -0.178 25139 6380 1 11 . 1 1 148 148 SER C C 148 175.786 175.786 175.872 -0.086 25139 6381 1 11 . 1 1 148 148 SER CA C 148 62.006 62.006 60.352 1.654 25139 6382 1 11 . 1 1 148 148 SER H H 148 7.139 7.139 7.522 -0.383 25139 6383 1 11 . 1 1 149 149 TYR N N 149 123.207 123.207 122.156 1.051 25139 6384 1 11 . 1 1 149 149 TYR C C 149 175.831 175.831 177.169 -1.338 25139 6385 1 11 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.371 -0.771 25139 6386 1 11 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.550 0.231 25139 6387 1 11 . 1 1 149 149 TYR H H 149 7.253 7.253 7.615 -0.362 25139 6388 1 11 . 1 1 150 150 ARG N N 150 118.708 118.708 116.352 2.356 25139 6389 1 11 . 1 1 150 150 ARG HA H 150 3.346 3.346 4.047 -0.701 25139 6390 1 11 . 1 1 150 150 ARG C C 150 177.644 177.644 177.691 -0.047 25139 6391 1 11 . 1 1 150 150 ARG CA C 150 57.323 57.323 56.862 0.461 25139 6392 1 11 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.413 -0.558 25139 6393 1 11 . 1 1 150 150 ARG H H 150 8.441 8.441 7.459 0.982 25139 6394 1 11 . 1 1 151 151 GLN N N 151 116.551 116.551 116.711 -0.160 25139 6395 1 11 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.078 -0.121 25139 6396 1 11 . 1 1 151 151 GLN C C 151 177.987 177.987 177.006 0.981 25139 6397 1 11 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.306 0.035 25139 6398 1 11 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.677 -0.213 25139 6399 1 11 . 1 1 151 151 GLN H H 151 7.332 7.332 7.652 -0.320 25139 6400 1 11 . 1 1 152 152 LEU N N 152 118.877 118.877 113.468 5.409 25139 6401 1 11 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.565 -0.386 25139 6402 1 11 . 1 1 152 152 LEU C C 152 179.070 179.070 177.049 2.021 25139 6403 1 11 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.085 0.997 25139 6404 1 11 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.410 -0.722 25139 6405 1 11 . 1 1 152 152 LEU H H 152 7.106 7.106 7.522 -0.416 25139 6406 1 11 . 1 1 153 153 VAL N N 153 119.076 119.076 114.255 4.821 25139 6407 1 11 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.117 -1.257 25139 6408 1 11 . 1 1 153 153 VAL C C 153 177.421 177.421 176.391 1.030 25139 6409 1 11 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.403 2.180 25139 6410 1 11 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.387 -1.869 25139 6411 1 11 . 1 1 153 153 VAL H H 153 7.427 7.427 7.228 0.199 25139 6412 1 11 . 1 1 154 154 ASP N N 154 119.888 119.888 123.008 -3.120 25139 6413 1 11 . 1 1 154 154 ASP C C 154 177.422 177.422 176.403 1.019 25139 6414 1 11 . 1 1 154 154 ASP CA C 154 56.071 56.071 54.098 1.973 25139 6415 1 11 . 1 1 154 154 ASP CB C 154 40.349 40.349 38.871 1.478 25139 6416 1 11 . 1 1 154 154 ASP H H 154 7.930 7.930 8.016 -0.086 25139 6417 1 11 . 1 1 155 155 HIS N N 155 117.821 117.821 118.885 -1.064 25139 6418 1 11 . 1 1 155 155 HIS CA C 155 57.756 57.756 56.824 0.932 25139 6419 1 11 . 1 1 155 155 HIS CB C 155 30.180 30.180 29.947 0.233 25139 6420 1 11 . 1 1 155 155 HIS H H 155 7.680 7.680 7.664 0.016 25139 6421 1 11 . 1 1 156 156 HIS N N 156 119.180 119.180 118.601 0.579 25139 6422 1 11 . 1 1 156 156 HIS CA C 156 57.931 57.931 55.264 2.667 25139 6423 1 11 . 1 1 156 156 HIS CB C 156 30.300 30.300 31.178 -0.878 25139 6424 1 11 . 1 1 156 156 HIS H H 156 7.868 7.868 7.402 0.466 25139 6425 1 12 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.912 -0.008 25139 6426 1 12 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.687 0.535 25139 6427 1 12 . 1 1 49 49 ASP N N 49 119.661 119.661 119.806 -0.145 25139 6428 1 12 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.106 0.171 25139 6429 1 12 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.241 -0.179 25139 6430 1 12 . 1 1 49 49 ASP H H 49 8.462 8.462 8.182 0.280 25139 6431 1 12 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.376 -0.324 25139 6432 1 12 . 1 1 51 51 LEU C C 51 178.514 178.514 177.845 0.669 25139 6433 1 12 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.949 1.100 25139 6434 1 12 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.643 -0.450 25139 6435 1 12 . 1 1 52 52 ASN N N 52 113.819 113.819 116.078 -2.259 25139 6436 1 12 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.817 0.018 25139 6437 1 12 . 1 1 52 52 ASN C C 52 175.964 175.964 175.250 0.714 25139 6438 1 12 . 1 1 52 52 ASN CA C 52 54.096 54.096 53.911 0.185 25139 6439 1 12 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.249 0.634 25139 6440 1 12 . 1 1 52 52 ASN H H 52 7.853 7.853 7.670 0.183 25139 6441 1 12 . 1 1 53 53 SER N N 53 114.357 114.357 114.636 -0.279 25139 6442 1 12 . 1 1 53 53 SER CA C 53 59.908 59.908 58.248 1.660 25139 6443 1 12 . 1 1 53 53 SER CB C 53 64.395 64.395 63.956 0.439 25139 6444 1 12 . 1 1 53 53 SER H H 53 8.023 8.023 7.654 0.369 25139 6445 1 12 . 1 1 54 54 PHE N N 54 121.037 121.037 118.613 2.424 25139 6446 1 12 . 1 1 54 54 PHE C C 54 175.522 175.522 175.832 -0.310 25139 6447 1 12 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.720 1.344 25139 6448 1 12 . 1 1 54 54 PHE CB C 54 43.053 43.053 42.784 0.269 25139 6449 1 12 . 1 1 54 54 PHE H H 54 7.731 7.731 7.561 0.170 25139 6450 1 12 . 1 1 55 55 THR N N 55 116.535 116.535 117.735 -1.200 25139 6451 1 12 . 1 1 55 55 THR HA H 55 4.654 4.654 4.621 0.033 25139 6452 1 12 . 1 1 55 55 THR C C 55 173.301 173.301 174.257 -0.956 25139 6453 1 12 . 1 1 55 55 THR CA C 55 61.420 61.420 60.710 0.710 25139 6454 1 12 . 1 1 55 55 THR CB C 55 71.388 71.388 70.436 0.952 25139 6455 1 12 . 1 1 55 55 THR H H 55 8.929 8.929 8.989 -0.060 25139 6456 1 12 . 1 1 56 56 ALA N N 56 129.359 129.359 128.662 0.697 25139 6457 1 12 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.580 0.735 25139 6458 1 12 . 1 1 56 56 ALA C C 56 178.305 178.305 177.846 0.459 25139 6459 1 12 . 1 1 56 56 ALA CA C 56 52.871 52.871 53.043 -0.172 25139 6460 1 12 . 1 1 56 56 ALA CB C 56 19.324 19.324 18.466 0.858 25139 6461 1 12 . 1 1 56 56 ALA H H 56 8.907 8.907 8.749 0.158 25139 6462 1 12 . 1 1 57 57 GLY N N 57 106.331 106.331 103.821 2.510 25139 6463 1 12 . 1 1 57 57 GLY CA C 57 44.611 44.611 44.957 -0.346 25139 6464 1 12 . 1 1 57 57 GLY H H 57 7.978 7.978 8.134 -0.156 25139 6465 1 12 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.458 -0.134 25139 6466 1 12 . 1 1 59 59 PRO C C 59 177.466 177.466 177.737 -0.271 25139 6467 1 12 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.947 1.536 25139 6468 1 12 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.285 -0.549 25139 6469 1 12 . 1 1 60 60 GLY N N 60 109.688 109.688 107.938 1.750 25139 6470 1 12 . 1 1 60 60 GLY C C 60 173.555 173.555 173.284 0.271 25139 6471 1 12 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.968 0.573 25139 6472 1 12 . 1 1 60 60 GLY H H 60 8.402 8.402 8.761 -0.359 25139 6473 1 12 . 1 1 61 61 PHE N N 61 122.491 122.491 121.847 0.644 25139 6474 1 12 . 1 1 61 61 PHE C C 61 175.146 175.146 174.128 1.018 25139 6475 1 12 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.753 1.529 25139 6476 1 12 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.097 -2.398 25139 6477 1 12 . 1 1 61 61 PHE H H 61 7.957 7.957 7.237 0.720 25139 6478 1 12 . 1 1 62 62 VAL N N 62 121.128 121.128 116.865 4.263 25139 6479 1 12 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.247 -0.162 25139 6480 1 12 . 1 1 62 62 VAL C C 62 174.937 174.937 174.712 0.225 25139 6481 1 12 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.440 0.269 25139 6482 1 12 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.511 0.921 25139 6483 1 12 . 1 1 62 62 VAL H H 62 7.994 7.994 9.103 -1.109 25139 6484 1 12 . 1 1 63 63 LEU N N 63 124.386 124.386 122.743 1.643 25139 6485 1 12 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.623 -1.307 25139 6486 1 12 . 1 1 63 63 LEU C C 63 175.278 175.278 177.064 -1.786 25139 6487 1 12 . 1 1 63 63 LEU CA C 63 56.288 56.288 56.064 0.224 25139 6488 1 12 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.917 1.201 25139 6489 1 12 . 1 1 63 63 LEU H H 63 7.572 7.572 9.071 -1.499 25139 6490 1 12 . 1 1 64 64 ASP N N 64 126.746 126.746 122.495 4.251 25139 6491 1 12 . 1 1 64 64 ASP C C 64 177.801 177.801 177.473 0.328 25139 6492 1 12 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.800 -3.079 25139 6493 1 12 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.743 -1.345 25139 6494 1 12 . 1 1 64 64 ASP H H 64 8.552 8.552 8.364 0.188 25139 6495 1 12 . 1 1 65 65 THR C C 65 175.002 175.002 175.042 -0.040 25139 6496 1 12 . 1 1 65 65 THR CB C 65 67.919 67.919 67.194 0.725 25139 6497 1 12 . 1 1 66 66 GLN N N 66 120.804 120.804 120.303 0.501 25139 6498 1 12 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.030 -0.153 25139 6499 1 12 . 1 1 66 66 GLN C C 66 178.901 178.901 177.551 1.350 25139 6500 1 12 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.290 1.126 25139 6501 1 12 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.358 -0.434 25139 6502 1 12 . 1 1 66 66 GLN H H 66 8.447 8.447 8.315 0.132 25139 6503 1 12 . 1 1 67 67 ALA N N 67 121.267 121.267 122.144 -0.877 25139 6504 1 12 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.181 -0.224 25139 6505 1 12 . 1 1 67 67 ALA C C 67 176.777 176.777 179.137 -2.360 25139 6506 1 12 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.006 0.318 25139 6507 1 12 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.362 0.258 25139 6508 1 12 . 1 1 67 67 ALA H H 67 7.791 7.791 7.726 0.065 25139 6509 1 12 . 1 1 68 68 SER N N 68 113.339 113.339 114.894 -1.555 25139 6510 1 12 . 1 1 68 68 SER HA H 68 4.061 4.061 4.068 -0.007 25139 6511 1 12 . 1 1 68 68 SER C C 68 175.875 175.875 176.469 -0.594 25139 6512 1 12 . 1 1 68 68 SER CA C 68 62.970 62.970 62.065 0.905 25139 6513 1 12 . 1 1 68 68 SER CB C 68 61.330 61.330 63.287 -1.957 25139 6514 1 12 . 1 1 68 68 SER H H 68 7.785 7.785 7.689 0.096 25139 6515 1 12 . 1 1 69 69 VAL N N 69 125.140 125.140 116.646 8.494 25139 6516 1 12 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.169 -0.093 25139 6517 1 12 . 1 1 69 69 VAL C C 69 176.384 176.384 176.707 -0.323 25139 6518 1 12 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.311 1.420 25139 6519 1 12 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.299 0.190 25139 6520 1 12 . 1 1 69 69 VAL H H 69 8.572 8.572 7.990 0.582 25139 6521 1 12 . 1 1 70 70 SER N N 70 116.704 116.704 113.948 2.756 25139 6522 1 12 . 1 1 70 70 SER HA H 70 4.229 4.229 4.244 -0.015 25139 6523 1 12 . 1 1 70 70 SER C C 70 174.101 174.101 175.485 -1.384 25139 6524 1 12 . 1 1 70 70 SER CA C 70 61.627 61.627 59.188 2.439 25139 6525 1 12 . 1 1 70 70 SER H H 70 7.951 7.951 7.662 0.289 25139 6526 1 12 . 1 1 71 71 ASN N N 71 117.576 117.576 117.161 0.415 25139 6527 1 12 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.649 0.153 25139 6528 1 12 . 1 1 71 71 ASN C C 71 174.332 174.332 174.830 -0.498 25139 6529 1 12 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.857 -0.418 25139 6530 1 12 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.795 0.672 25139 6531 1 12 . 1 1 71 71 ASN H H 71 7.131 7.131 7.477 -0.346 25139 6532 1 12 . 1 1 72 72 GLY N N 72 103.925 103.925 105.367 -1.442 25139 6533 1 12 . 1 1 72 72 GLY C C 72 174.710 174.710 173.499 1.211 25139 6534 1 12 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.547 0.002 25139 6535 1 12 . 1 1 72 72 GLY H H 72 7.338 7.338 7.346 -0.008 25139 6536 1 12 . 1 1 73 73 ALA N N 73 124.942 124.942 123.101 1.841 25139 6537 1 12 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.540 -0.368 25139 6538 1 12 . 1 1 73 73 ALA C C 73 175.896 175.896 176.094 -0.198 25139 6539 1 12 . 1 1 73 73 ALA CA C 73 52.673 52.673 52.139 0.534 25139 6540 1 12 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.158 -0.102 25139 6541 1 12 . 1 1 73 73 ALA H H 73 8.032 8.032 7.726 0.306 25139 6542 1 12 . 1 1 74 74 THR N N 74 113.423 113.423 116.128 -2.705 25139 6543 1 12 . 1 1 74 74 THR HA H 74 4.678 4.678 4.587 0.091 25139 6544 1 12 . 1 1 74 74 THR C C 74 173.339 173.339 173.188 0.151 25139 6545 1 12 . 1 1 74 74 THR CA C 74 61.545 61.545 61.420 0.125 25139 6546 1 12 . 1 1 74 74 THR CB C 74 71.319 71.319 71.747 -0.428 25139 6547 1 12 . 1 1 74 74 THR H H 74 8.530 8.530 8.197 0.333 25139 6548 1 12 . 1 1 75 75 PHE N N 75 128.180 128.180 129.449 -1.269 25139 6549 1 12 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.870 -0.266 25139 6550 1 12 . 1 1 75 75 PHE C C 75 174.623 174.623 174.896 -0.273 25139 6551 1 12 . 1 1 75 75 PHE CA C 75 57.616 57.616 57.949 -0.333 25139 6552 1 12 . 1 1 75 75 PHE CB C 75 38.675 38.675 39.272 -0.597 25139 6553 1 12 . 1 1 75 75 PHE H H 75 9.146 9.146 9.055 0.091 25139 6554 1 12 . 1 1 76 76 LEU N N 76 127.849 127.849 125.751 2.098 25139 6555 1 12 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.494 -0.143 25139 6556 1 12 . 1 1 76 76 LEU C C 76 176.339 176.339 176.236 0.103 25139 6557 1 12 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.259 0.724 25139 6558 1 12 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.358 -0.028 25139 6559 1 12 . 1 1 76 76 LEU H H 76 8.635 8.635 8.015 0.620 25139 6560 1 12 . 1 1 77 77 GLU N N 77 115.131 115.131 120.069 -4.938 25139 6561 1 12 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.395 0.013 25139 6562 1 12 . 1 1 77 77 GLU C C 77 174.734 174.734 174.525 0.209 25139 6563 1 12 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.162 1.191 25139 6564 1 12 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.306 0.901 25139 6565 1 12 . 1 1 77 77 GLU H H 77 7.252 7.252 7.456 -0.204 25139 6566 1 12 . 1 1 78 78 SER N N 78 118.016 118.016 119.986 -1.970 25139 6567 1 12 . 1 1 78 78 SER HA H 78 5.561 5.561 5.183 0.378 25139 6568 1 12 . 1 1 78 78 SER C C 78 171.968 171.968 173.329 -1.361 25139 6569 1 12 . 1 1 78 78 SER CA C 78 54.061 54.061 55.393 -1.332 25139 6570 1 12 . 1 1 78 78 SER CB C 78 64.074 64.074 63.106 0.968 25139 6571 1 12 . 1 1 78 78 SER H H 78 9.033 9.033 8.736 0.297 25139 6572 1 12 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.652 -1.052 25139 6573 1 12 . 1 1 79 79 PRO CB C 79 32.410 32.410 31.854 0.556 25139 6574 1 12 . 1 1 80 80 THR N N 80 118.079 118.079 114.272 3.807 25139 6575 1 12 . 1 1 80 80 THR HA H 80 4.342 4.342 3.722 0.620 25139 6576 1 12 . 1 1 80 80 THR C C 80 174.494 174.494 173.728 0.766 25139 6577 1 12 . 1 1 80 80 THR CA C 80 61.453 61.453 62.895 -1.442 25139 6578 1 12 . 1 1 80 80 THR CB C 80 67.797 67.797 68.248 -0.451 25139 6579 1 12 . 1 1 80 80 THR H H 80 8.670 8.670 7.639 1.031 25139 6580 1 12 . 1 1 81 81 VAL N N 81 117.395 117.395 112.007 5.388 25139 6581 1 12 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.865 0.742 25139 6582 1 12 . 1 1 81 81 VAL C C 81 175.518 175.518 176.066 -0.548 25139 6583 1 12 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.062 -2.948 25139 6584 1 12 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.420 2.175 25139 6585 1 12 . 1 1 81 81 VAL H H 81 7.448 7.448 7.521 -0.073 25139 6586 1 12 . 1 1 82 82 ARG N N 82 117.852 117.852 118.545 -0.693 25139 6587 1 12 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.596 -0.075 25139 6588 1 12 . 1 1 82 82 ARG C C 82 176.992 176.992 176.135 0.857 25139 6589 1 12 . 1 1 82 82 ARG CA C 82 56.385 56.385 56.236 0.149 25139 6590 1 12 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.702 0.900 25139 6591 1 12 . 1 1 82 82 ARG H H 82 8.710 8.710 8.666 0.044 25139 6592 1 12 . 1 1 83 83 ARG N N 83 117.035 117.035 117.562 -0.527 25139 6593 1 12 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.815 0.507 25139 6594 1 12 . 1 1 83 83 ARG C C 83 177.379 177.379 176.568 0.811 25139 6595 1 12 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.717 -1.033 25139 6596 1 12 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.449 -0.408 25139 6597 1 12 . 1 1 83 83 ARG H H 83 7.292 7.292 7.727 -0.435 25139 6598 1 12 . 1 1 84 84 GLY N N 84 114.911 114.911 110.333 4.578 25139 6599 1 12 . 1 1 84 84 GLY C C 84 176.940 176.940 175.092 1.848 25139 6600 1 12 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.765 1.907 25139 6601 1 12 . 1 1 84 84 GLY H H 84 9.255 9.255 8.360 0.895 25139 6602 1 12 . 1 1 85 85 TRP N N 85 121.810 121.810 120.315 1.495 25139 6603 1 12 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.157 0.010 25139 6604 1 12 . 1 1 85 85 TRP C C 85 178.272 178.272 177.861 0.411 25139 6605 1 12 . 1 1 85 85 TRP CA C 85 60.045 60.045 60.353 -0.308 25139 6606 1 12 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.073 0.144 25139 6607 1 12 . 1 1 85 85 TRP H H 85 9.963 9.963 7.841 2.122 25139 6608 1 12 . 1 1 86 86 ASP N N 86 116.400 116.400 118.940 -2.540 25139 6609 1 12 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.429 -0.036 25139 6610 1 12 . 1 1 86 86 ASP C C 86 178.803 178.803 177.920 0.883 25139 6611 1 12 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.999 0.055 25139 6612 1 12 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.209 0.524 25139 6613 1 12 . 1 1 86 86 ASP H H 86 6.934 6.934 8.061 -1.127 25139 6614 1 12 . 1 1 87 87 CYS N N 87 122.454 122.454 119.430 3.024 25139 6615 1 12 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.237 0.013 25139 6616 1 12 . 1 1 87 87 CYS C C 87 174.956 174.956 176.566 -1.610 25139 6617 1 12 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.162 -4.015 25139 6618 1 12 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.088 11.397 25139 6619 1 12 . 1 1 87 87 CYS H H 87 7.603 7.603 7.470 0.133 25139 6620 1 12 . 1 1 88 88 VAL N N 88 119.192 119.192 120.594 -1.402 25139 6621 1 12 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.118 -0.660 25139 6622 1 12 . 1 1 88 88 VAL C C 88 177.413 177.413 177.663 -0.250 25139 6623 1 12 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.254 0.722 25139 6624 1 12 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.978 -0.736 25139 6625 1 12 . 1 1 88 88 VAL H H 88 7.192 7.192 7.581 -0.389 25139 6626 1 12 . 1 1 89 89 ARG N N 89 118.185 118.185 119.332 -1.147 25139 6627 1 12 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.992 -0.312 25139 6628 1 12 . 1 1 89 89 ARG C C 89 178.677 178.677 178.062 0.615 25139 6629 1 12 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.120 0.835 25139 6630 1 12 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.443 0.348 25139 6631 1 12 . 1 1 89 89 ARG H H 89 7.971 7.971 8.104 -0.133 25139 6632 1 12 . 1 1 90 90 ALA N N 90 120.815 120.815 122.542 -1.727 25139 6633 1 12 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.100 -0.025 25139 6634 1 12 . 1 1 90 90 ALA C C 90 177.416 177.416 178.932 -1.516 25139 6635 1 12 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.756 -0.502 25139 6636 1 12 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.167 -0.731 25139 6637 1 12 . 1 1 90 90 ALA H H 90 7.453 7.453 7.378 0.075 25139 6638 1 12 . 1 1 91 91 CYS N N 91 120.380 120.380 116.009 4.371 25139 6639 1 12 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.177 0.194 25139 6640 1 12 . 1 1 91 91 CYS C C 91 176.654 176.654 175.967 0.687 25139 6641 1 12 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.695 -4.000 25139 6642 1 12 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.197 12.507 25139 6643 1 12 . 1 1 91 91 CYS H H 91 7.944 7.944 7.484 0.460 25139 6644 1 12 . 1 1 92 92 CYS N N 92 116.270 116.270 117.083 -0.813 25139 6645 1 12 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.505 -0.101 25139 6646 1 12 . 1 1 92 92 CYS C C 92 175.628 175.628 176.536 -0.908 25139 6647 1 12 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.671 -1.965 25139 6648 1 12 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.789 15.360 25139 6649 1 12 . 1 1 92 92 CYS H H 92 8.315 8.315 7.695 0.620 25139 6650 1 12 . 1 1 93 93 THR N N 93 107.283 107.283 111.292 -4.009 25139 6651 1 12 . 1 1 93 93 THR HA H 93 4.481 4.481 4.375 0.106 25139 6652 1 12 . 1 1 93 93 THR C C 93 173.606 173.606 175.254 -1.648 25139 6653 1 12 . 1 1 93 93 THR CA C 93 61.402 61.402 63.590 -2.188 25139 6654 1 12 . 1 1 93 93 THR CB C 93 69.046 69.046 69.779 -0.733 25139 6655 1 12 . 1 1 93 93 THR H H 93 7.445 7.445 7.630 -0.185 25139 6656 1 12 . 1 1 94 94 THR N N 94 121.432 121.432 121.955 -0.523 25139 6657 1 12 . 1 1 94 94 THR HA H 94 4.398 4.398 4.398 0.000 25139 6658 1 12 . 1 1 94 94 THR C C 94 173.493 173.493 174.918 -1.425 25139 6659 1 12 . 1 1 94 94 THR CA C 94 62.726 62.726 62.963 -0.237 25139 6660 1 12 . 1 1 94 94 THR CB C 94 69.704 69.704 68.889 0.815 25139 6661 1 12 . 1 1 94 94 THR H H 94 7.553 7.553 8.026 -0.473 25139 6662 1 12 . 1 1 95 95 GLN N N 95 129.410 129.410 128.134 1.276 25139 6663 1 12 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.997 -0.053 25139 6664 1 12 . 1 1 95 95 GLN C C 95 176.293 176.293 176.059 0.234 25139 6665 1 12 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.948 -0.908 25139 6666 1 12 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.709 -0.453 25139 6667 1 12 . 1 1 95 95 GLN H H 95 8.812 8.812 8.770 0.042 25139 6668 1 12 . 1 1 96 96 ASN N N 96 115.015 115.015 114.443 0.572 25139 6669 1 12 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.825 -0.626 25139 6670 1 12 . 1 1 96 96 ASN C C 96 172.260 172.260 173.894 -1.634 25139 6671 1 12 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.639 2.928 25139 6672 1 12 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.727 -1.890 25139 6673 1 12 . 1 1 96 96 ASN H H 96 8.791 8.791 8.062 0.729 25139 6674 1 12 . 1 1 97 97 CYS N N 97 115.830 115.830 120.282 -4.452 25139 6675 1 12 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.422 -0.321 25139 6676 1 12 . 1 1 97 97 CYS C C 97 175.025 175.025 174.197 0.828 25139 6677 1 12 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.767 -1.619 25139 6678 1 12 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.592 16.642 25139 6679 1 12 . 1 1 97 97 CYS H H 97 7.651 7.651 7.788 -0.137 25139 6680 1 12 . 1 1 98 98 ASN N N 98 125.148 125.148 125.506 -0.358 25139 6681 1 12 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.000 0.133 25139 6682 1 12 . 1 1 98 98 ASN C C 98 171.892 171.892 174.402 -2.510 25139 6683 1 12 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.593 -0.399 25139 6684 1 12 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.284 -1.336 25139 6685 1 12 . 1 1 98 98 ASN H H 98 8.736 8.736 8.315 0.421 25139 6686 1 12 . 1 1 99 99 LEU N N 99 120.898 120.898 120.209 0.689 25139 6687 1 12 . 1 1 99 99 LEU C C 99 173.084 173.084 173.972 -0.888 25139 6688 1 12 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.512 2.608 25139 6689 1 12 . 1 1 99 99 LEU CB C 99 44.328 44.328 46.108 -1.780 25139 6690 1 12 . 1 1 99 99 LEU H H 99 8.200 8.200 8.159 0.041 25139 6691 1 12 . 1 1 100 100 ALA N N 100 128.085 128.085 129.166 -1.081 25139 6692 1 12 . 1 1 100 100 ALA C C 100 174.938 174.938 175.436 -0.498 25139 6693 1 12 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.390 -0.643 25139 6694 1 12 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.627 0.087 25139 6695 1 12 . 1 1 100 100 ALA H H 100 9.156 9.156 9.195 -0.039 25139 6696 1 12 . 1 1 101 101 LEU N N 101 128.723 128.723 127.821 0.902 25139 6697 1 12 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.320 -0.178 25139 6698 1 12 . 1 1 101 101 LEU C C 101 174.379 174.379 175.303 -0.924 25139 6699 1 12 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.253 -0.400 25139 6700 1 12 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.584 0.723 25139 6701 1 12 . 1 1 101 101 LEU H H 101 9.578 9.578 9.279 0.299 25139 6702 1 12 . 1 1 102 102 VAL N N 102 119.417 119.417 119.528 -0.111 25139 6703 1 12 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.234 0.294 25139 6704 1 12 . 1 1 102 102 VAL C C 102 173.660 173.660 173.747 -0.087 25139 6705 1 12 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.593 0.027 25139 6706 1 12 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.672 -1.399 25139 6707 1 12 . 1 1 102 102 VAL H H 102 9.297 9.297 9.479 -0.182 25139 6708 1 12 . 1 1 103 103 GLU N N 103 124.427 124.427 122.885 1.542 25139 6709 1 12 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.274 -0.409 25139 6710 1 12 . 1 1 103 103 GLU C C 103 176.319 176.319 175.265 1.054 25139 6711 1 12 . 1 1 103 103 GLU CA C 103 54.101 54.101 53.987 0.114 25139 6712 1 12 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.827 0.374 25139 6713 1 12 . 1 1 103 103 GLU H H 103 7.749 7.749 8.199 -0.450 25139 6714 1 12 . 1 1 104 104 LEU N N 104 127.294 127.294 125.793 1.501 25139 6715 1 12 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.460 -0.140 25139 6716 1 12 . 1 1 104 104 LEU C C 104 176.593 176.593 177.666 -1.073 25139 6717 1 12 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.073 3.011 25139 6718 1 12 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.840 -0.449 25139 6719 1 12 . 1 1 104 104 LEU H H 104 8.323 8.323 8.495 -0.172 25139 6720 1 12 . 1 1 105 105 GLN N N 105 121.361 121.361 115.184 6.177 25139 6721 1 12 . 1 1 105 105 GLN C C 105 172.868 172.868 174.790 -1.922 25139 6722 1 12 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.591 -3.185 25139 6723 1 12 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.850 2.879 25139 6724 1 12 . 1 1 105 105 GLN H H 105 8.095 8.095 8.346 -0.251 25139 6725 1 12 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.468 -0.059 25139 6726 1 12 . 1 1 106 106 PRO C C 106 177.770 177.770 176.970 0.800 25139 6727 1 12 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.531 -0.046 25139 6728 1 12 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.093 -0.325 25139 6729 1 12 . 1 1 107 107 ASP N N 107 116.484 116.484 116.182 0.302 25139 6730 1 12 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.590 -0.150 25139 6731 1 12 . 1 1 107 107 ASP C C 107 176.749 176.749 175.900 0.849 25139 6732 1 12 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.466 -0.011 25139 6733 1 12 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.336 -1.448 25139 6734 1 12 . 1 1 107 107 ASP H H 107 8.638 8.638 8.546 0.092 25139 6735 1 12 . 1 1 108 108 ARG N N 108 117.895 117.895 119.696 -1.801 25139 6736 1 12 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.662 -0.172 25139 6737 1 12 . 1 1 108 108 ARG C C 108 176.111 176.111 177.039 -0.928 25139 6738 1 12 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.116 0.149 25139 6739 1 12 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.227 -0.150 25139 6740 1 12 . 1 1 108 108 ARG H H 108 7.905 7.905 8.219 -0.314 25139 6741 1 12 . 1 1 109 109 GLY N N 109 108.307 108.307 107.987 0.320 25139 6742 1 12 . 1 1 109 109 GLY C C 109 173.949 173.949 173.739 0.210 25139 6743 1 12 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.220 -0.669 25139 6744 1 12 . 1 1 109 109 GLY H H 109 7.753 7.753 8.328 -0.575 25139 6745 1 12 . 1 1 110 110 GLU N N 110 120.035 120.035 122.707 -2.672 25139 6746 1 12 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.479 -0.388 25139 6747 1 12 . 1 1 110 110 GLU C C 110 177.045 177.045 176.985 0.060 25139 6748 1 12 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.110 2.172 25139 6749 1 12 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.521 -1.848 25139 6750 1 12 . 1 1 110 110 GLU H H 110 8.509 8.509 8.590 -0.081 25139 6751 1 12 . 1 1 111 111 ASP N N 111 121.160 121.160 121.710 -0.550 25139 6752 1 12 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.439 0.131 25139 6753 1 12 . 1 1 111 111 ASP C C 111 175.089 175.089 175.898 -0.809 25139 6754 1 12 . 1 1 111 111 ASP CA C 111 54.591 54.591 57.127 -2.536 25139 6755 1 12 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.177 1.255 25139 6756 1 12 . 1 1 111 111 ASP H H 111 8.916 8.916 8.708 0.208 25139 6757 1 12 . 1 1 112 112 ALA N N 112 122.130 122.130 119.930 2.200 25139 6758 1 12 . 1 1 112 112 ALA C C 112 178.120 178.120 175.960 2.160 25139 6759 1 12 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.677 2.582 25139 6760 1 12 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.127 -1.357 25139 6761 1 12 . 1 1 112 112 ALA H H 112 7.361 7.361 7.557 -0.196 25139 6762 1 12 . 1 1 113 113 ILE N N 113 113.780 113.780 115.246 -1.466 25139 6763 1 12 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.676 0.210 25139 6764 1 12 . 1 1 113 113 ILE C C 113 174.258 174.258 174.839 -0.581 25139 6765 1 12 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.241 0.271 25139 6766 1 12 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.768 0.080 25139 6767 1 12 . 1 1 113 113 ILE H H 113 7.667 7.667 8.379 -0.712 25139 6768 1 12 . 1 1 114 114 ALA N N 114 122.673 122.673 125.109 -2.436 25139 6769 1 12 . 1 1 114 114 ALA C C 114 176.984 176.984 176.757 0.227 25139 6770 1 12 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.292 -1.728 25139 6771 1 12 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.610 0.972 25139 6772 1 12 . 1 1 114 114 ALA H H 114 8.904 8.904 8.866 0.038 25139 6773 1 12 . 1 1 115 115 ALA N N 115 116.486 116.486 116.465 0.021 25139 6774 1 12 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.326 0.029 25139 6775 1 12 . 1 1 115 115 ALA C C 115 174.138 174.138 174.129 0.009 25139 6776 1 12 . 1 1 115 115 ALA CA C 115 52.320 52.320 51.328 0.992 25139 6777 1 12 . 1 1 115 115 ALA CB C 115 22.983 22.983 20.854 2.129 25139 6778 1 12 . 1 1 115 115 ALA H H 115 7.182 7.182 7.347 -0.165 25139 6779 1 12 . 1 1 116 116 CYS N N 116 120.099 120.099 120.052 0.047 25139 6780 1 12 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.290 0.041 25139 6781 1 12 . 1 1 116 116 CYS C C 116 176.609 176.609 172.399 4.210 25139 6782 1 12 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.591 -2.642 25139 6783 1 12 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.361 12.023 25139 6784 1 12 . 1 1 116 116 CYS H H 116 8.298 8.298 7.849 0.449 25139 6785 1 12 . 1 1 117 117 PHE N N 117 126.406 126.406 125.329 1.077 25139 6786 1 12 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.218 -0.019 25139 6787 1 12 . 1 1 117 117 PHE C C 117 173.385 173.385 174.018 -0.633 25139 6788 1 12 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.132 0.122 25139 6789 1 12 . 1 1 117 117 PHE CB C 117 41.681 41.681 42.459 -0.778 25139 6790 1 12 . 1 1 117 117 PHE H H 117 9.712 9.712 9.111 0.601 25139 6791 1 12 . 1 1 118 118 LEU N N 118 122.119 122.119 122.950 -0.831 25139 6792 1 12 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.406 -0.240 25139 6793 1 12 . 1 1 118 118 LEU C C 118 175.097 175.097 175.847 -0.750 25139 6794 1 12 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.345 -0.441 25139 6795 1 12 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.965 -1.667 25139 6796 1 12 . 1 1 118 118 LEU H H 118 8.719 8.719 8.893 -0.174 25139 6797 1 12 . 1 1 119 119 ILE N N 119 125.324 125.324 122.785 2.539 25139 6798 1 12 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.996 -0.119 25139 6799 1 12 . 1 1 119 119 ILE C C 119 173.825 173.825 175.392 -1.567 25139 6800 1 12 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.922 -0.815 25139 6801 1 12 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.358 -0.849 25139 6802 1 12 . 1 1 119 119 ILE H H 119 8.986 8.986 9.086 -0.100 25139 6803 1 12 . 1 1 120 120 ASN N N 120 121.534 121.534 124.204 -2.670 25139 6804 1 12 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.720 0.670 25139 6805 1 12 . 1 1 120 120 ASN C C 120 176.098 176.098 175.904 0.194 25139 6806 1 12 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.548 -4.091 25139 6807 1 12 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.185 0.733 25139 6808 1 12 . 1 1 120 120 ASN H H 120 8.694 8.694 8.993 -0.299 25139 6809 1 12 . 1 1 121 121 CYS N N 121 122.779 122.779 117.170 5.609 25139 6810 1 12 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.081 0.402 25139 6811 1 12 . 1 1 121 121 CYS C C 121 173.195 173.195 173.425 -0.230 25139 6812 1 12 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.844 -4.080 25139 6813 1 12 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.649 16.058 25139 6814 1 12 . 1 1 121 121 CYS H H 121 10.668 10.668 8.601 2.067 25139 6815 1 12 . 1 1 122 122 LEU N N 122 121.063 121.063 117.727 3.336 25139 6816 1 12 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.511 -0.146 25139 6817 1 12 . 1 1 122 122 LEU C C 122 176.743 176.743 175.634 1.109 25139 6818 1 12 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.022 0.642 25139 6819 1 12 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.820 -1.586 25139 6820 1 12 . 1 1 122 122 LEU H H 122 8.256 8.256 8.139 0.117 25139 6821 1 12 . 1 1 123 123 TYR N N 123 123.081 123.081 122.638 0.443 25139 6822 1 12 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.722 -0.679 25139 6823 1 12 . 1 1 123 123 TYR C C 123 173.633 173.633 174.887 -1.254 25139 6824 1 12 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.214 -0.326 25139 6825 1 12 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.573 -0.492 25139 6826 1 12 . 1 1 123 123 TYR H H 123 8.990 8.990 9.038 -0.048 25139 6827 1 12 . 1 1 124 124 GLU N N 124 128.742 128.742 127.237 1.505 25139 6828 1 12 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.754 -0.204 25139 6829 1 12 . 1 1 124 124 GLU C C 124 174.835 174.835 175.444 -0.609 25139 6830 1 12 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.510 0.122 25139 6831 1 12 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.334 -0.439 25139 6832 1 12 . 1 1 124 124 GLU H H 124 9.135 9.135 8.782 0.353 25139 6833 1 12 . 1 1 125 125 GLN N N 125 108.066 108.066 109.894 -1.828 25139 6834 1 12 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.935 -0.214 25139 6835 1 12 . 1 1 125 125 GLN C C 125 174.627 174.627 174.964 -0.337 25139 6836 1 12 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.349 0.690 25139 6837 1 12 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.705 -0.377 25139 6838 1 12 . 1 1 125 125 GLN H H 125 8.390 8.390 8.579 -0.189 25139 6839 1 12 . 1 1 126 126 ASN N N 126 118.528 118.528 117.844 0.684 25139 6840 1 12 . 1 1 126 126 ASN C C 126 173.713 173.713 174.777 -1.064 25139 6841 1 12 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.506 -0.317 25139 6842 1 12 . 1 1 126 126 ASN CB C 126 40.801 40.801 40.019 0.782 25139 6843 1 12 . 1 1 126 126 ASN H H 126 8.092 8.092 7.984 0.108 25139 6844 1 12 . 1 1 127 127 PHE N N 127 124.680 124.680 122.687 1.993 25139 6845 1 12 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.804 0.233 25139 6846 1 12 . 1 1 127 127 PHE C C 127 177.125 177.125 176.309 0.816 25139 6847 1 12 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.544 0.869 25139 6848 1 12 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.356 0.888 25139 6849 1 12 . 1 1 127 127 PHE H H 127 9.026 9.026 8.898 0.128 25139 6850 1 12 . 1 1 128 128 VAL N N 128 119.455 119.455 120.307 -0.852 25139 6851 1 12 . 1 1 128 128 VAL C C 128 175.886 175.886 175.273 0.613 25139 6852 1 12 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.532 -0.613 25139 6853 1 12 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.003 2.191 25139 6854 1 12 . 1 1 128 128 VAL H H 128 8.364 8.364 7.541 0.823 25139 6855 1 12 . 1 1 129 129 CYS N N 129 116.130 116.130 119.963 -3.833 25139 6856 1 12 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.827 -0.350 25139 6857 1 12 . 1 1 129 129 CYS C C 129 170.569 170.569 174.338 -3.769 25139 6858 1 12 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.764 -3.614 25139 6859 1 12 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.789 18.828 25139 6860 1 12 . 1 1 129 129 CYS H H 129 5.390 5.390 7.180 -1.790 25139 6861 1 12 . 1 1 130 130 LYS N N 130 120.071 120.071 125.819 -5.748 25139 6862 1 12 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.278 0.283 25139 6863 1 12 . 1 1 130 130 LYS C C 130 176.853 176.853 174.489 2.364 25139 6864 1 12 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.938 -0.050 25139 6865 1 12 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.764 0.878 25139 6866 1 12 . 1 1 130 130 LYS H H 130 8.066 8.066 8.522 -0.456 25139 6867 1 12 . 1 1 131 131 PHE N N 131 118.415 118.415 119.753 -1.338 25139 6868 1 12 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.321 -0.714 25139 6869 1 12 . 1 1 131 131 PHE C C 131 174.013 174.013 175.119 -1.106 25139 6870 1 12 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.263 1.448 25139 6871 1 12 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.443 0.637 25139 6872 1 12 . 1 1 131 131 PHE H H 131 8.714 8.714 8.268 0.446 25139 6873 1 12 . 1 1 132 132 ALA N N 132 124.209 124.209 122.516 1.693 25139 6874 1 12 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.031 -0.414 25139 6875 1 12 . 1 1 132 132 ALA C C 132 174.352 174.352 174.350 0.002 25139 6876 1 12 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.435 2.006 25139 6877 1 12 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.846 -0.383 25139 6878 1 12 . 1 1 132 132 ALA H H 132 9.295 9.295 9.213 0.082 25139 6879 1 12 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.343 -0.460 25139 6880 1 12 . 1 1 133 133 PRO C C 133 173.923 173.923 176.457 -2.534 25139 6881 1 12 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.672 0.399 25139 6882 1 12 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.407 -0.804 25139 6883 1 12 . 1 1 134 134 ARG N N 134 126.071 126.071 122.474 3.597 25139 6884 1 12 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.556 -0.301 25139 6885 1 12 . 1 1 134 134 ARG C C 134 177.065 177.065 176.136 0.929 25139 6886 1 12 . 1 1 134 134 ARG CA C 134 57.164 57.164 56.094 1.070 25139 6887 1 12 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.413 -1.230 25139 6888 1 12 . 1 1 134 134 ARG H H 134 8.672 8.672 8.579 0.093 25139 6889 1 12 . 1 1 135 135 GLU N N 135 125.683 125.683 121.830 3.853 25139 6890 1 12 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.469 -0.116 25139 6891 1 12 . 1 1 135 135 GLU C C 135 178.081 178.081 177.210 0.871 25139 6892 1 12 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.353 0.298 25139 6893 1 12 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.075 -0.078 25139 6894 1 12 . 1 1 135 135 GLU H H 135 8.603 8.603 8.821 -0.218 25139 6895 1 12 . 1 1 136 136 GLY N N 136 110.031 110.031 107.248 2.783 25139 6896 1 12 . 1 1 136 136 GLY C C 136 173.079 173.079 172.749 0.330 25139 6897 1 12 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.839 0.939 25139 6898 1 12 . 1 1 136 136 GLY H H 136 9.036 9.036 8.304 0.732 25139 6899 1 12 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.616 0.059 25139 6900 1 12 . 1 1 137 137 PHE C C 137 174.936 174.936 174.219 0.717 25139 6901 1 12 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.196 -0.112 25139 6902 1 12 . 1 1 137 137 PHE CB C 137 44.696 44.696 43.069 1.627 25139 6903 1 12 . 1 1 138 138 ILE N N 138 117.417 117.417 114.907 2.510 25139 6904 1 12 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.626 -0.119 25139 6905 1 12 . 1 1 138 138 ILE C C 138 173.858 173.858 173.468 0.390 25139 6906 1 12 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.792 0.828 25139 6907 1 12 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.636 0.961 25139 6908 1 12 . 1 1 138 138 ILE H H 138 8.777 8.777 8.640 0.137 25139 6909 1 12 . 1 1 139 139 ASN N N 139 117.201 117.201 117.134 0.067 25139 6910 1 12 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.439 0.620 25139 6911 1 12 . 1 1 139 139 ASN C C 139 173.721 173.721 174.072 -0.351 25139 6912 1 12 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.765 -1.535 25139 6913 1 12 . 1 1 139 139 ASN CB C 139 43.861 43.861 41.930 1.931 25139 6914 1 12 . 1 1 139 139 ASN H H 139 8.872 8.872 8.128 0.744 25139 6915 1 12 . 1 1 140 140 TYR N N 140 123.991 123.991 121.157 2.834 25139 6916 1 12 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.831 0.347 25139 6917 1 12 . 1 1 140 140 TYR C C 140 174.791 174.791 175.665 -0.874 25139 6918 1 12 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.474 -1.402 25139 6919 1 12 . 1 1 140 140 TYR CB C 140 41.670 41.670 38.793 2.877 25139 6920 1 12 . 1 1 140 140 TYR H H 140 9.526 9.526 9.000 0.526 25139 6921 1 12 . 1 1 141 141 LEU N N 141 122.779 122.779 124.220 -1.441 25139 6922 1 12 . 1 1 141 141 LEU C C 141 175.404 175.404 177.894 -2.490 25139 6923 1 12 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.853 2.250 25139 6924 1 12 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.014 0.147 25139 6925 1 12 . 1 1 141 141 LEU H H 141 9.010 9.010 9.139 -0.129 25139 6926 1 12 . 1 1 142 142 THR N N 142 113.189 113.189 113.228 -0.039 25139 6927 1 12 . 1 1 142 142 THR HA H 142 4.061 4.061 4.251 -0.190 25139 6928 1 12 . 1 1 142 142 THR C C 142 175.940 175.940 176.350 -0.410 25139 6929 1 12 . 1 1 142 142 THR CA C 142 61.389 61.389 60.902 0.487 25139 6930 1 12 . 1 1 142 142 THR CB C 142 69.779 69.779 70.358 -0.579 25139 6931 1 12 . 1 1 142 142 THR H H 142 7.737 7.737 8.094 -0.357 25139 6932 1 12 . 1 1 143 143 ARG N N 143 120.975 120.975 119.556 1.419 25139 6933 1 12 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.945 -0.007 25139 6934 1 12 . 1 1 143 143 ARG C C 143 178.690 178.690 176.883 1.807 25139 6935 1 12 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.944 0.804 25139 6936 1 12 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.622 0.523 25139 6937 1 12 . 1 1 143 143 ARG H H 143 8.149 8.149 8.158 -0.009 25139 6938 1 12 . 1 1 144 144 GLU N N 144 116.997 116.997 117.499 -0.502 25139 6939 1 12 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.311 -0.202 25139 6940 1 12 . 1 1 144 144 GLU C C 144 178.442 178.442 177.770 0.672 25139 6941 1 12 . 1 1 144 144 GLU CA C 144 59.863 59.863 57.849 2.014 25139 6942 1 12 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.331 -0.749 25139 6943 1 12 . 1 1 144 144 GLU H H 144 8.622 8.622 7.526 1.096 25139 6944 1 12 . 1 1 145 145 VAL N N 145 111.213 111.213 119.880 -8.667 25139 6945 1 12 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.875 0.536 25139 6946 1 12 . 1 1 145 145 VAL C C 145 176.965 176.965 176.692 0.273 25139 6947 1 12 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.341 -0.747 25139 6948 1 12 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.328 -0.246 25139 6949 1 12 . 1 1 145 145 VAL H H 145 7.227 7.227 7.874 -0.647 25139 6950 1 12 . 1 1 146 146 TYR N N 146 123.512 123.512 120.960 2.552 25139 6951 1 12 . 1 1 146 146 TYR HA H 146 3.880 3.880 3.998 -0.118 25139 6952 1 12 . 1 1 146 146 TYR C C 146 176.377 176.377 176.825 -0.448 25139 6953 1 12 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.319 1.218 25139 6954 1 12 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.447 -0.107 25139 6955 1 12 . 1 1 146 146 TYR H H 146 8.492 8.492 8.599 -0.107 25139 6956 1 12 . 1 1 147 147 ARG N N 147 116.680 116.680 117.558 -0.878 25139 6957 1 12 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.792 0.022 25139 6958 1 12 . 1 1 147 147 ARG C C 147 178.858 178.858 178.412 0.446 25139 6959 1 12 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.446 0.250 25139 6960 1 12 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.795 -0.130 25139 6961 1 12 . 1 1 147 147 ARG H H 147 8.053 8.053 8.279 -0.226 25139 6962 1 12 . 1 1 148 148 SER N N 148 115.306 115.306 115.126 0.180 25139 6963 1 12 . 1 1 148 148 SER HA H 148 3.998 3.998 4.100 -0.102 25139 6964 1 12 . 1 1 148 148 SER C C 148 175.786 175.786 175.682 0.104 25139 6965 1 12 . 1 1 148 148 SER CA C 148 62.006 62.006 60.406 1.600 25139 6966 1 12 . 1 1 148 148 SER H H 148 7.139 7.139 7.537 -0.398 25139 6967 1 12 . 1 1 149 149 TYR N N 149 123.207 123.207 121.947 1.260 25139 6968 1 12 . 1 1 149 149 TYR C C 149 175.831 175.831 177.231 -1.400 25139 6969 1 12 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.058 -0.458 25139 6970 1 12 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.505 0.276 25139 6971 1 12 . 1 1 149 149 TYR H H 149 7.253 7.253 7.100 0.153 25139 6972 1 12 . 1 1 150 150 ARG N N 150 118.708 118.708 117.458 1.250 25139 6973 1 12 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.894 -0.548 25139 6974 1 12 . 1 1 150 150 ARG C C 150 177.644 177.644 177.637 0.007 25139 6975 1 12 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.460 -0.137 25139 6976 1 12 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.698 -0.844 25139 6977 1 12 . 1 1 150 150 ARG H H 150 8.441 8.441 7.640 0.801 25139 6978 1 12 . 1 1 151 151 GLN N N 151 116.551 116.551 115.983 0.568 25139 6979 1 12 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.081 -0.124 25139 6980 1 12 . 1 1 151 151 GLN C C 151 177.987 177.987 176.434 1.553 25139 6981 1 12 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.735 0.606 25139 6982 1 12 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.544 -0.080 25139 6983 1 12 . 1 1 151 151 GLN H H 151 7.332 7.332 7.636 -0.304 25139 6984 1 12 . 1 1 152 152 LEU N N 152 118.877 118.877 114.547 4.330 25139 6985 1 12 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.572 -0.393 25139 6986 1 12 . 1 1 152 152 LEU C C 152 179.070 179.070 177.130 1.940 25139 6987 1 12 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.572 1.510 25139 6988 1 12 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.364 -0.676 25139 6989 1 12 . 1 1 152 152 LEU H H 152 7.106 7.106 7.266 -0.160 25139 6990 1 12 . 1 1 153 153 VAL N N 153 119.076 119.076 112.134 6.942 25139 6991 1 12 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.132 -1.272 25139 6992 1 12 . 1 1 153 153 VAL C C 153 177.421 177.421 175.704 1.717 25139 6993 1 12 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.592 2.991 25139 6994 1 12 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.073 -1.555 25139 6995 1 12 . 1 1 153 153 VAL H H 153 7.427 7.427 7.170 0.257 25139 6996 1 12 . 1 1 154 154 ASP N N 154 119.888 119.888 121.108 -1.220 25139 6997 1 12 . 1 1 154 154 ASP C C 154 177.422 177.422 174.838 2.584 25139 6998 1 12 . 1 1 154 154 ASP CA C 154 56.071 56.071 53.537 2.534 25139 6999 1 12 . 1 1 154 154 ASP CB C 154 40.349 40.349 43.768 -3.419 25139 7000 1 12 . 1 1 154 154 ASP H H 154 7.930 7.930 7.398 0.532 25139 7001 1 12 . 1 1 155 155 HIS N N 155 117.821 117.821 120.275 -2.454 25139 7002 1 12 . 1 1 155 155 HIS CA C 155 57.756 57.756 54.766 2.990 25139 7003 1 12 . 1 1 155 155 HIS CB C 155 30.180 30.180 29.707 0.473 25139 7004 1 12 . 1 1 155 155 HIS H H 155 7.680 7.680 8.518 -0.838 25139 7005 1 12 . 1 1 156 156 HIS N N 156 119.180 119.180 119.275 -0.095 25139 7006 1 12 . 1 1 156 156 HIS CA C 156 57.931 57.931 56.205 1.726 25139 7007 1 12 . 1 1 156 156 HIS CB C 156 30.300 30.300 29.897 0.403 25139 7008 1 12 . 1 1 156 156 HIS H H 156 7.868 7.868 7.923 -0.055 25139 7009 1 13 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.718 1.186 25139 7010 1 13 . 1 1 48 48 ALA CB C 48 19.222 19.222 17.958 1.264 25139 7011 1 13 . 1 1 49 49 ASP N N 49 119.661 119.661 120.124 -0.463 25139 7012 1 13 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.548 -0.271 25139 7013 1 13 . 1 1 49 49 ASP CB C 49 41.062 41.062 42.318 -1.256 25139 7014 1 13 . 1 1 49 49 ASP H H 49 8.462 8.462 7.531 0.931 25139 7015 1 13 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.277 -0.225 25139 7016 1 13 . 1 1 51 51 LEU C C 51 178.514 178.514 179.155 -0.641 25139 7017 1 13 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.977 1.072 25139 7018 1 13 . 1 1 51 51 LEU CB C 51 41.193 41.193 40.427 0.766 25139 7019 1 13 . 1 1 52 52 ASN N N 52 113.819 113.819 117.709 -3.890 25139 7020 1 13 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.612 0.223 25139 7021 1 13 . 1 1 52 52 ASN C C 52 175.964 175.964 176.541 -0.577 25139 7022 1 13 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.474 -1.378 25139 7023 1 13 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.449 0.434 25139 7024 1 13 . 1 1 52 52 ASN H H 52 7.853 7.853 8.238 -0.385 25139 7025 1 13 . 1 1 53 53 SER N N 53 114.357 114.357 115.283 -0.926 25139 7026 1 13 . 1 1 53 53 SER CA C 53 59.908 59.908 59.707 0.201 25139 7027 1 13 . 1 1 53 53 SER CB C 53 64.395 64.395 63.895 0.500 25139 7028 1 13 . 1 1 53 53 SER H H 53 8.023 8.023 7.801 0.222 25139 7029 1 13 . 1 1 54 54 PHE N N 54 121.037 121.037 118.692 2.345 25139 7030 1 13 . 1 1 54 54 PHE C C 54 175.522 175.522 175.862 -0.340 25139 7031 1 13 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.002 1.062 25139 7032 1 13 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.595 -0.542 25139 7033 1 13 . 1 1 54 54 PHE H H 54 7.731 7.731 7.729 0.002 25139 7034 1 13 . 1 1 55 55 THR N N 55 116.535 116.535 118.356 -1.821 25139 7035 1 13 . 1 1 55 55 THR HA H 55 4.654 4.654 4.686 -0.032 25139 7036 1 13 . 1 1 55 55 THR C C 55 173.301 173.301 173.207 0.094 25139 7037 1 13 . 1 1 55 55 THR CA C 55 61.420 61.420 60.827 0.593 25139 7038 1 13 . 1 1 55 55 THR CB C 55 71.388 71.388 71.543 -0.155 25139 7039 1 13 . 1 1 55 55 THR H H 55 8.929 8.929 9.272 -0.343 25139 7040 1 13 . 1 1 56 56 ALA N N 56 129.359 129.359 128.936 0.423 25139 7041 1 13 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.928 0.387 25139 7042 1 13 . 1 1 56 56 ALA C C 56 178.305 178.305 177.133 1.172 25139 7043 1 13 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.945 0.926 25139 7044 1 13 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.164 0.160 25139 7045 1 13 . 1 1 56 56 ALA H H 56 8.907 8.907 8.654 0.253 25139 7046 1 13 . 1 1 57 57 GLY N N 57 106.331 106.331 109.275 -2.944 25139 7047 1 13 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.716 0.895 25139 7048 1 13 . 1 1 57 57 GLY H H 57 7.978 7.978 8.073 -0.095 25139 7049 1 13 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.298 0.025 25139 7050 1 13 . 1 1 59 59 PRO C C 59 177.466 177.466 177.762 -0.296 25139 7051 1 13 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.764 1.720 25139 7052 1 13 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.215 -0.480 25139 7053 1 13 . 1 1 60 60 GLY N N 60 109.688 109.688 108.360 1.328 25139 7054 1 13 . 1 1 60 60 GLY C C 60 173.555 173.555 173.450 0.105 25139 7055 1 13 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.285 0.256 25139 7056 1 13 . 1 1 60 60 GLY H H 60 8.402 8.402 8.392 0.010 25139 7057 1 13 . 1 1 61 61 PHE N N 61 122.491 122.491 122.358 0.133 25139 7058 1 13 . 1 1 61 61 PHE C C 61 175.146 175.146 174.955 0.191 25139 7059 1 13 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.198 2.084 25139 7060 1 13 . 1 1 61 61 PHE CB C 61 38.699 38.699 39.805 -1.106 25139 7061 1 13 . 1 1 61 61 PHE H H 61 7.957 7.957 7.182 0.775 25139 7062 1 13 . 1 1 62 62 VAL N N 62 121.128 121.128 115.907 5.221 25139 7063 1 13 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.351 -0.266 25139 7064 1 13 . 1 1 62 62 VAL C C 62 174.937 174.937 174.914 0.023 25139 7065 1 13 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.950 0.758 25139 7066 1 13 . 1 1 62 62 VAL CB C 62 36.432 36.432 36.323 0.109 25139 7067 1 13 . 1 1 62 62 VAL H H 62 7.994 7.994 9.165 -1.171 25139 7068 1 13 . 1 1 63 63 LEU N N 63 124.386 124.386 122.095 2.291 25139 7069 1 13 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.883 -1.567 25139 7070 1 13 . 1 1 63 63 LEU C C 63 175.278 175.278 176.433 -1.155 25139 7071 1 13 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.934 0.353 25139 7072 1 13 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.381 1.737 25139 7073 1 13 . 1 1 63 63 LEU H H 63 7.572 7.572 8.849 -1.277 25139 7074 1 13 . 1 1 64 64 ASP N N 64 126.746 126.746 127.559 -0.813 25139 7075 1 13 . 1 1 64 64 ASP C C 64 177.801 177.801 175.999 1.802 25139 7076 1 13 . 1 1 64 64 ASP CA C 64 51.721 51.721 53.787 -2.066 25139 7077 1 13 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.147 -0.749 25139 7078 1 13 . 1 1 64 64 ASP H H 64 8.552 8.552 8.333 0.219 25139 7079 1 13 . 1 1 65 65 THR C C 65 175.002 175.002 175.556 -0.554 25139 7080 1 13 . 1 1 65 65 THR CB C 65 67.919 67.919 68.802 -0.883 25139 7081 1 13 . 1 1 66 66 GLN N N 66 120.804 120.804 118.596 2.208 25139 7082 1 13 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.102 -0.225 25139 7083 1 13 . 1 1 66 66 GLN C C 66 178.901 178.901 175.689 3.212 25139 7084 1 13 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.626 1.790 25139 7085 1 13 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.665 0.260 25139 7086 1 13 . 1 1 66 66 GLN H H 66 8.447 8.447 8.302 0.145 25139 7087 1 13 . 1 1 67 67 ALA N N 67 121.267 121.267 120.016 1.251 25139 7088 1 13 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.322 -0.365 25139 7089 1 13 . 1 1 67 67 ALA C C 67 176.777 176.777 178.708 -1.931 25139 7090 1 13 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.346 0.978 25139 7091 1 13 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.549 -0.929 25139 7092 1 13 . 1 1 67 67 ALA H H 67 7.791 7.791 7.271 0.520 25139 7093 1 13 . 1 1 68 68 SER N N 68 113.339 113.339 114.183 -0.844 25139 7094 1 13 . 1 1 68 68 SER HA H 68 4.061 4.061 4.203 -0.142 25139 7095 1 13 . 1 1 68 68 SER C C 68 175.875 175.875 176.330 -0.455 25139 7096 1 13 . 1 1 68 68 SER CA C 68 62.970 62.970 61.936 1.034 25139 7097 1 13 . 1 1 68 68 SER CB C 68 61.330 61.330 63.985 -2.655 25139 7098 1 13 . 1 1 68 68 SER H H 68 7.785 7.785 7.813 -0.028 25139 7099 1 13 . 1 1 69 69 VAL N N 69 125.140 125.140 117.327 7.813 25139 7100 1 13 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.171 -0.095 25139 7101 1 13 . 1 1 69 69 VAL C C 69 176.384 176.384 176.698 -0.314 25139 7102 1 13 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.050 1.681 25139 7103 1 13 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.385 0.104 25139 7104 1 13 . 1 1 69 69 VAL H H 69 8.572 8.572 8.016 0.556 25139 7105 1 13 . 1 1 70 70 SER N N 70 116.704 116.704 113.680 3.024 25139 7106 1 13 . 1 1 70 70 SER HA H 70 4.229 4.229 4.226 0.003 25139 7107 1 13 . 1 1 70 70 SER C C 70 174.101 174.101 175.310 -1.209 25139 7108 1 13 . 1 1 70 70 SER CA C 70 61.627 61.627 59.145 2.482 25139 7109 1 13 . 1 1 70 70 SER H H 70 7.951 7.951 8.211 -0.260 25139 7110 1 13 . 1 1 71 71 ASN N N 71 117.576 117.576 117.206 0.370 25139 7111 1 13 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.662 0.140 25139 7112 1 13 . 1 1 71 71 ASN C C 71 174.332 174.332 174.858 -0.526 25139 7113 1 13 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.850 -0.411 25139 7114 1 13 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.880 0.587 25139 7115 1 13 . 1 1 71 71 ASN H H 71 7.131 7.131 7.523 -0.392 25139 7116 1 13 . 1 1 72 72 GLY N N 72 103.925 103.925 105.435 -1.510 25139 7117 1 13 . 1 1 72 72 GLY C C 72 174.710 174.710 173.564 1.146 25139 7118 1 13 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.526 0.023 25139 7119 1 13 . 1 1 72 72 GLY H H 72 7.338 7.338 7.358 -0.020 25139 7120 1 13 . 1 1 73 73 ALA N N 73 124.942 124.942 123.465 1.477 25139 7121 1 13 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.526 -0.354 25139 7122 1 13 . 1 1 73 73 ALA C C 73 175.896 175.896 176.332 -0.436 25139 7123 1 13 . 1 1 73 73 ALA CA C 73 52.673 52.673 52.068 0.605 25139 7124 1 13 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.065 -0.009 25139 7125 1 13 . 1 1 73 73 ALA H H 73 8.032 8.032 7.810 0.222 25139 7126 1 13 . 1 1 74 74 THR N N 74 113.423 113.423 116.145 -2.722 25139 7127 1 13 . 1 1 74 74 THR HA H 74 4.678 4.678 4.569 0.109 25139 7128 1 13 . 1 1 74 74 THR C C 74 173.339 173.339 173.247 0.092 25139 7129 1 13 . 1 1 74 74 THR CA C 74 61.545 61.545 60.629 0.916 25139 7130 1 13 . 1 1 74 74 THR CB C 74 71.319 71.319 71.722 -0.403 25139 7131 1 13 . 1 1 74 74 THR H H 74 8.530 8.530 8.236 0.294 25139 7132 1 13 . 1 1 75 75 PHE N N 75 128.180 128.180 129.291 -1.111 25139 7133 1 13 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.891 -0.287 25139 7134 1 13 . 1 1 75 75 PHE C C 75 174.623 174.623 174.880 -0.257 25139 7135 1 13 . 1 1 75 75 PHE CA C 75 57.616 57.616 58.196 -0.579 25139 7136 1 13 . 1 1 75 75 PHE CB C 75 38.675 38.675 39.176 -0.501 25139 7137 1 13 . 1 1 75 75 PHE H H 75 9.146 9.146 9.114 0.032 25139 7138 1 13 . 1 1 76 76 LEU N N 76 127.849 127.849 125.540 2.309 25139 7139 1 13 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.548 -0.197 25139 7140 1 13 . 1 1 76 76 LEU C C 76 176.339 176.339 176.253 0.086 25139 7141 1 13 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.114 0.869 25139 7142 1 13 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.482 -0.152 25139 7143 1 13 . 1 1 76 76 LEU H H 76 8.635 8.635 8.023 0.612 25139 7144 1 13 . 1 1 77 77 GLU N N 77 115.131 115.131 120.194 -5.063 25139 7145 1 13 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.361 0.047 25139 7146 1 13 . 1 1 77 77 GLU C C 77 174.734 174.734 174.766 -0.032 25139 7147 1 13 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.298 1.055 25139 7148 1 13 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.510 0.697 25139 7149 1 13 . 1 1 77 77 GLU H H 77 7.252 7.252 7.569 -0.317 25139 7150 1 13 . 1 1 78 78 SER N N 78 118.016 118.016 118.788 -0.772 25139 7151 1 13 . 1 1 78 78 SER HA H 78 5.561 5.561 5.059 0.502 25139 7152 1 13 . 1 1 78 78 SER C C 78 171.968 171.968 172.695 -0.727 25139 7153 1 13 . 1 1 78 78 SER CA C 78 54.061 54.061 54.429 -0.368 25139 7154 1 13 . 1 1 78 78 SER CB C 78 64.074 64.074 63.559 0.515 25139 7155 1 13 . 1 1 78 78 SER H H 78 9.033 9.033 8.626 0.407 25139 7156 1 13 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.910 -0.310 25139 7157 1 13 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.372 0.038 25139 7158 1 13 . 1 1 80 80 THR N N 80 118.079 118.079 114.321 3.758 25139 7159 1 13 . 1 1 80 80 THR HA H 80 4.342 4.342 4.389 -0.047 25139 7160 1 13 . 1 1 80 80 THR C C 80 174.494 174.494 174.450 0.044 25139 7161 1 13 . 1 1 80 80 THR CA C 80 61.453 61.453 60.066 1.387 25139 7162 1 13 . 1 1 80 80 THR CB C 80 67.797 67.797 68.692 -0.895 25139 7163 1 13 . 1 1 80 80 THR H H 80 8.670 8.670 8.215 0.455 25139 7164 1 13 . 1 1 81 81 VAL N N 81 117.395 117.395 118.000 -0.605 25139 7165 1 13 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.992 0.615 25139 7166 1 13 . 1 1 81 81 VAL C C 81 175.518 175.518 175.838 -0.320 25139 7167 1 13 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.835 -2.721 25139 7168 1 13 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.149 2.446 25139 7169 1 13 . 1 1 81 81 VAL H H 81 7.448 7.448 7.509 -0.061 25139 7170 1 13 . 1 1 82 82 ARG N N 82 117.852 117.852 118.052 -0.200 25139 7171 1 13 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.882 -0.361 25139 7172 1 13 . 1 1 82 82 ARG C C 82 176.992 176.992 176.029 0.963 25139 7173 1 13 . 1 1 82 82 ARG CA C 82 56.385 56.385 54.946 1.439 25139 7174 1 13 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.699 0.903 25139 7175 1 13 . 1 1 82 82 ARG H H 82 8.710 8.710 8.641 0.069 25139 7176 1 13 . 1 1 83 83 ARG N N 83 117.035 117.035 118.811 -1.776 25139 7177 1 13 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.799 0.523 25139 7178 1 13 . 1 1 83 83 ARG C C 83 177.379 177.379 176.476 0.903 25139 7179 1 13 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.742 -1.058 25139 7180 1 13 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.849 -0.808 25139 7181 1 13 . 1 1 83 83 ARG H H 83 7.292 7.292 7.821 -0.529 25139 7182 1 13 . 1 1 84 84 GLY N N 84 114.911 114.911 110.339 4.572 25139 7183 1 13 . 1 1 84 84 GLY C C 84 176.940 176.940 175.023 1.917 25139 7184 1 13 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.657 2.015 25139 7185 1 13 . 1 1 84 84 GLY H H 84 9.255 9.255 8.414 0.841 25139 7186 1 13 . 1 1 85 85 TRP N N 85 121.810 121.810 119.987 1.823 25139 7187 1 13 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.119 0.048 25139 7188 1 13 . 1 1 85 85 TRP C C 85 178.272 178.272 177.640 0.632 25139 7189 1 13 . 1 1 85 85 TRP CA C 85 60.045 60.045 60.078 -0.033 25139 7190 1 13 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.111 0.106 25139 7191 1 13 . 1 1 85 85 TRP H H 85 9.963 9.963 7.755 2.208 25139 7192 1 13 . 1 1 86 86 ASP N N 86 116.400 116.400 119.296 -2.896 25139 7193 1 13 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.406 -0.013 25139 7194 1 13 . 1 1 86 86 ASP C C 86 178.803 178.803 177.912 0.891 25139 7195 1 13 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.961 0.093 25139 7196 1 13 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.195 0.538 25139 7197 1 13 . 1 1 86 86 ASP H H 86 6.934 6.934 8.000 -1.066 25139 7198 1 13 . 1 1 87 87 CYS N N 87 122.454 122.454 119.284 3.170 25139 7199 1 13 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.193 0.057 25139 7200 1 13 . 1 1 87 87 CYS C C 87 174.956 174.956 176.504 -1.548 25139 7201 1 13 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.041 -3.894 25139 7202 1 13 . 1 1 87 87 CYS CB C 87 37.485 37.485 25.970 11.515 25139 7203 1 13 . 1 1 87 87 CYS H H 87 7.603 7.603 7.506 0.097 25139 7204 1 13 . 1 1 88 88 VAL N N 88 119.192 119.192 120.754 -1.562 25139 7205 1 13 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.161 -0.703 25139 7206 1 13 . 1 1 88 88 VAL C C 88 177.413 177.413 177.516 -0.103 25139 7207 1 13 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.418 0.558 25139 7208 1 13 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.120 -0.878 25139 7209 1 13 . 1 1 88 88 VAL H H 88 7.192 7.192 7.373 -0.181 25139 7210 1 13 . 1 1 89 89 ARG N N 89 118.185 118.185 119.035 -0.850 25139 7211 1 13 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.897 -0.217 25139 7212 1 13 . 1 1 89 89 ARG C C 89 178.677 178.677 178.065 0.612 25139 7213 1 13 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.056 0.899 25139 7214 1 13 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.377 0.414 25139 7215 1 13 . 1 1 89 89 ARG H H 89 7.971 7.971 8.037 -0.066 25139 7216 1 13 . 1 1 90 90 ALA N N 90 120.815 120.815 122.197 -1.382 25139 7217 1 13 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.104 -0.029 25139 7218 1 13 . 1 1 90 90 ALA C C 90 177.416 177.416 179.477 -2.061 25139 7219 1 13 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.661 -0.407 25139 7220 1 13 . 1 1 90 90 ALA CB C 90 17.436 17.436 17.916 -0.480 25139 7221 1 13 . 1 1 90 90 ALA H H 90 7.453 7.453 7.535 -0.082 25139 7222 1 13 . 1 1 91 91 CYS N N 91 120.380 120.380 116.492 3.888 25139 7223 1 13 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.222 0.149 25139 7224 1 13 . 1 1 91 91 CYS C C 91 176.654 176.654 175.869 0.785 25139 7225 1 13 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.368 -3.673 25139 7226 1 13 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.099 12.605 25139 7227 1 13 . 1 1 91 91 CYS H H 91 7.944 7.944 7.569 0.375 25139 7228 1 13 . 1 1 92 92 CYS N N 92 116.270 116.270 117.372 -1.102 25139 7229 1 13 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.507 -0.103 25139 7230 1 13 . 1 1 92 92 CYS C C 92 175.628 175.628 176.550 -0.922 25139 7231 1 13 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.811 -2.105 25139 7232 1 13 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.842 15.307 25139 7233 1 13 . 1 1 92 92 CYS H H 92 8.315 8.315 7.615 0.700 25139 7234 1 13 . 1 1 93 93 THR N N 93 107.283 107.283 111.684 -4.401 25139 7235 1 13 . 1 1 93 93 THR HA H 93 4.481 4.481 4.299 0.182 25139 7236 1 13 . 1 1 93 93 THR C C 93 173.606 173.606 175.367 -1.761 25139 7237 1 13 . 1 1 93 93 THR CA C 93 61.402 61.402 64.139 -2.737 25139 7238 1 13 . 1 1 93 93 THR CB C 93 69.046 69.046 69.178 -0.132 25139 7239 1 13 . 1 1 93 93 THR H H 93 7.445 7.445 7.621 -0.176 25139 7240 1 13 . 1 1 94 94 THR N N 94 121.432 121.432 121.535 -0.103 25139 7241 1 13 . 1 1 94 94 THR HA H 94 4.398 4.398 4.423 -0.025 25139 7242 1 13 . 1 1 94 94 THR C C 94 173.493 173.493 174.965 -1.472 25139 7243 1 13 . 1 1 94 94 THR CA C 94 62.726 62.726 63.236 -0.510 25139 7244 1 13 . 1 1 94 94 THR CB C 94 69.704 69.704 68.686 1.018 25139 7245 1 13 . 1 1 94 94 THR H H 94 7.553 7.553 7.980 -0.427 25139 7246 1 13 . 1 1 95 95 GLN N N 95 129.410 129.410 128.064 1.346 25139 7247 1 13 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.986 -0.042 25139 7248 1 13 . 1 1 95 95 GLN C C 95 176.293 176.293 175.965 0.328 25139 7249 1 13 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.837 -0.797 25139 7250 1 13 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.711 -0.455 25139 7251 1 13 . 1 1 95 95 GLN H H 95 8.812 8.812 8.741 0.071 25139 7252 1 13 . 1 1 96 96 ASN N N 96 115.015 115.015 114.620 0.395 25139 7253 1 13 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.831 -0.632 25139 7254 1 13 . 1 1 96 96 ASN C C 96 172.260 172.260 173.903 -1.643 25139 7255 1 13 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.661 2.906 25139 7256 1 13 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.706 -1.869 25139 7257 1 13 . 1 1 96 96 ASN H H 96 8.791 8.791 8.066 0.725 25139 7258 1 13 . 1 1 97 97 CYS N N 97 115.830 115.830 120.022 -4.192 25139 7259 1 13 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.454 -0.353 25139 7260 1 13 . 1 1 97 97 CYS C C 97 175.025 175.025 174.099 0.926 25139 7261 1 13 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.725 -1.577 25139 7262 1 13 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.965 16.269 25139 7263 1 13 . 1 1 97 97 CYS H H 97 7.651 7.651 7.780 -0.129 25139 7264 1 13 . 1 1 98 98 ASN N N 98 125.148 125.148 125.164 -0.016 25139 7265 1 13 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.990 0.143 25139 7266 1 13 . 1 1 98 98 ASN C C 98 171.892 171.892 174.337 -2.445 25139 7267 1 13 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.638 -0.444 25139 7268 1 13 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.534 -1.586 25139 7269 1 13 . 1 1 98 98 ASN H H 98 8.736 8.736 8.376 0.360 25139 7270 1 13 . 1 1 99 99 LEU N N 99 120.898 120.898 120.435 0.463 25139 7271 1 13 . 1 1 99 99 LEU C C 99 173.084 173.084 174.028 -0.944 25139 7272 1 13 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.483 2.637 25139 7273 1 13 . 1 1 99 99 LEU CB C 99 44.328 44.328 46.156 -1.828 25139 7274 1 13 . 1 1 99 99 LEU H H 99 8.200 8.200 8.324 -0.124 25139 7275 1 13 . 1 1 100 100 ALA N N 100 128.085 128.085 129.067 -0.982 25139 7276 1 13 . 1 1 100 100 ALA C C 100 174.938 174.938 175.470 -0.532 25139 7277 1 13 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.513 -0.766 25139 7278 1 13 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.352 0.362 25139 7279 1 13 . 1 1 100 100 ALA H H 100 9.156 9.156 9.309 -0.153 25139 7280 1 13 . 1 1 101 101 LEU N N 101 128.723 128.723 127.774 0.949 25139 7281 1 13 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.315 -0.173 25139 7282 1 13 . 1 1 101 101 LEU C C 101 174.379 174.379 175.296 -0.917 25139 7283 1 13 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.424 -0.571 25139 7284 1 13 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.562 0.745 25139 7285 1 13 . 1 1 101 101 LEU H H 101 9.578 9.578 9.171 0.407 25139 7286 1 13 . 1 1 102 102 VAL N N 102 119.417 119.417 118.989 0.428 25139 7287 1 13 . 1 1 102 102 VAL HA H 102 5.528 5.528 4.942 0.586 25139 7288 1 13 . 1 1 102 102 VAL C C 102 173.660 173.660 173.680 -0.020 25139 7289 1 13 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.666 -0.046 25139 7290 1 13 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.230 -0.957 25139 7291 1 13 . 1 1 102 102 VAL H H 102 9.297 9.297 9.409 -0.112 25139 7292 1 13 . 1 1 103 103 GLU N N 103 124.427 124.427 123.604 0.823 25139 7293 1 13 . 1 1 103 103 GLU HA H 103 3.865 3.865 3.406 0.459 25139 7294 1 13 . 1 1 103 103 GLU C C 103 176.319 176.319 174.379 1.940 25139 7295 1 13 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.388 -0.287 25139 7296 1 13 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.398 0.803 25139 7297 1 13 . 1 1 103 103 GLU H H 103 7.749 7.749 8.081 -0.332 25139 7298 1 13 . 1 1 104 104 LEU N N 104 127.294 127.294 125.898 1.396 25139 7299 1 13 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.446 -0.126 25139 7300 1 13 . 1 1 104 104 LEU C C 104 176.593 176.593 177.201 -0.608 25139 7301 1 13 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.847 2.237 25139 7302 1 13 . 1 1 104 104 LEU CB C 104 42.391 42.391 44.177 -1.786 25139 7303 1 13 . 1 1 104 104 LEU H H 104 8.323 8.323 8.279 0.044 25139 7304 1 13 . 1 1 105 105 GLN N N 105 121.361 121.361 116.093 5.268 25139 7305 1 13 . 1 1 105 105 GLN C C 105 172.868 172.868 174.825 -1.957 25139 7306 1 13 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.450 -3.044 25139 7307 1 13 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.860 2.869 25139 7308 1 13 . 1 1 105 105 GLN H H 105 8.095 8.095 8.193 -0.098 25139 7309 1 13 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.494 -0.085 25139 7310 1 13 . 1 1 106 106 PRO C C 106 177.770 177.770 176.904 0.866 25139 7311 1 13 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.448 0.037 25139 7312 1 13 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.133 -0.365 25139 7313 1 13 . 1 1 107 107 ASP N N 107 116.484 116.484 116.126 0.358 25139 7314 1 13 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.588 -0.148 25139 7315 1 13 . 1 1 107 107 ASP C C 107 176.749 176.749 176.000 0.749 25139 7316 1 13 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.440 0.015 25139 7317 1 13 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.444 -1.556 25139 7318 1 13 . 1 1 107 107 ASP H H 107 8.638 8.638 8.497 0.141 25139 7319 1 13 . 1 1 108 108 ARG N N 108 117.895 117.895 119.331 -1.436 25139 7320 1 13 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.664 -0.174 25139 7321 1 13 . 1 1 108 108 ARG C C 108 176.111 176.111 177.028 -0.917 25139 7322 1 13 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.191 0.074 25139 7323 1 13 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.532 -0.456 25139 7324 1 13 . 1 1 108 108 ARG H H 108 7.905 7.905 8.229 -0.324 25139 7325 1 13 . 1 1 109 109 GLY N N 109 108.307 108.307 108.077 0.230 25139 7326 1 13 . 1 1 109 109 GLY C C 109 173.949 173.949 174.193 -0.244 25139 7327 1 13 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.223 -0.672 25139 7328 1 13 . 1 1 109 109 GLY H H 109 7.753 7.753 8.397 -0.644 25139 7329 1 13 . 1 1 110 110 GLU N N 110 120.035 120.035 122.007 -1.972 25139 7330 1 13 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.463 -0.372 25139 7331 1 13 . 1 1 110 110 GLU C C 110 177.045 177.045 176.573 0.472 25139 7332 1 13 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.655 1.627 25139 7333 1 13 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.942 -2.269 25139 7334 1 13 . 1 1 110 110 GLU H H 110 8.509 8.509 8.527 -0.018 25139 7335 1 13 . 1 1 111 111 ASP N N 111 121.160 121.160 119.223 1.937 25139 7336 1 13 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.496 0.074 25139 7337 1 13 . 1 1 111 111 ASP C C 111 175.089 175.089 175.865 -0.776 25139 7338 1 13 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.626 -1.034 25139 7339 1 13 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.839 1.593 25139 7340 1 13 . 1 1 111 111 ASP H H 111 8.916 8.916 8.638 0.278 25139 7341 1 13 . 1 1 112 112 ALA N N 112 122.130 122.130 121.123 1.007 25139 7342 1 13 . 1 1 112 112 ALA C C 112 178.120 178.120 176.122 1.998 25139 7343 1 13 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.705 2.554 25139 7344 1 13 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.380 -1.609 25139 7345 1 13 . 1 1 112 112 ALA H H 112 7.361 7.361 7.555 -0.194 25139 7346 1 13 . 1 1 113 113 ILE N N 113 113.780 113.780 115.796 -2.016 25139 7347 1 13 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.802 0.084 25139 7348 1 13 . 1 1 113 113 ILE C C 113 174.258 174.258 174.773 -0.515 25139 7349 1 13 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.239 0.273 25139 7350 1 13 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.762 0.086 25139 7351 1 13 . 1 1 113 113 ILE H H 113 7.667 7.667 8.248 -0.581 25139 7352 1 13 . 1 1 114 114 ALA N N 114 122.673 122.673 125.149 -2.476 25139 7353 1 13 . 1 1 114 114 ALA C C 114 176.984 176.984 176.696 0.288 25139 7354 1 13 . 1 1 114 114 ALA CA C 114 51.564 51.564 52.876 -1.312 25139 7355 1 13 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.710 0.872 25139 7356 1 13 . 1 1 114 114 ALA H H 114 8.904 8.904 8.865 0.039 25139 7357 1 13 . 1 1 115 115 ALA N N 115 116.486 116.486 116.466 0.020 25139 7358 1 13 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.454 -0.099 25139 7359 1 13 . 1 1 115 115 ALA C C 115 174.138 174.138 174.151 -0.013 25139 7360 1 13 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.647 1.673 25139 7361 1 13 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.456 1.527 25139 7362 1 13 . 1 1 115 115 ALA H H 115 7.182 7.182 7.157 0.025 25139 7363 1 13 . 1 1 116 116 CYS N N 116 120.099 120.099 119.395 0.704 25139 7364 1 13 . 1 1 116 116 CYS HA H 116 5.331 5.331 4.982 0.348 25139 7365 1 13 . 1 1 116 116 CYS C C 116 176.609 176.609 172.417 4.192 25139 7366 1 13 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.256 -2.307 25139 7367 1 13 . 1 1 116 116 CYS CB C 116 40.384 40.384 29.021 11.363 25139 7368 1 13 . 1 1 116 116 CYS H H 116 8.298 8.298 7.830 0.469 25139 7369 1 13 . 1 1 117 117 PHE N N 117 126.406 126.406 125.226 1.180 25139 7370 1 13 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.151 0.048 25139 7371 1 13 . 1 1 117 117 PHE C C 117 173.385 173.385 174.079 -0.694 25139 7372 1 13 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.137 0.117 25139 7373 1 13 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.444 0.237 25139 7374 1 13 . 1 1 117 117 PHE H H 117 9.712 9.712 9.018 0.694 25139 7375 1 13 . 1 1 118 118 LEU N N 118 122.119 122.119 124.414 -2.295 25139 7376 1 13 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.402 -0.236 25139 7377 1 13 . 1 1 118 118 LEU C C 118 175.097 175.097 176.061 -0.964 25139 7378 1 13 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.398 -0.494 25139 7379 1 13 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.570 -1.272 25139 7380 1 13 . 1 1 118 118 LEU H H 118 8.719 8.719 9.178 -0.459 25139 7381 1 13 . 1 1 119 119 ILE N N 119 125.324 125.324 122.529 2.795 25139 7382 1 13 . 1 1 119 119 ILE HA H 119 4.877 4.877 5.026 -0.149 25139 7383 1 13 . 1 1 119 119 ILE C C 119 173.825 173.825 175.518 -1.693 25139 7384 1 13 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.952 -0.845 25139 7385 1 13 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.432 -0.922 25139 7386 1 13 . 1 1 119 119 ILE H H 119 8.986 8.986 9.140 -0.154 25139 7387 1 13 . 1 1 120 120 ASN N N 120 121.534 121.534 124.243 -2.709 25139 7388 1 13 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.726 0.664 25139 7389 1 13 . 1 1 120 120 ASN C C 120 176.098 176.098 175.890 0.208 25139 7390 1 13 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.628 -4.171 25139 7391 1 13 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.190 0.728 25139 7392 1 13 . 1 1 120 120 ASN H H 120 8.694 8.694 9.075 -0.381 25139 7393 1 13 . 1 1 121 121 CYS N N 121 122.779 122.779 118.222 4.557 25139 7394 1 13 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.151 0.332 25139 7395 1 13 . 1 1 121 121 CYS C C 121 173.195 173.195 173.499 -0.304 25139 7396 1 13 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.643 -3.879 25139 7397 1 13 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.579 16.128 25139 7398 1 13 . 1 1 121 121 CYS H H 121 10.668 10.668 8.531 2.137 25139 7399 1 13 . 1 1 122 122 LEU N N 122 121.063 121.063 117.478 3.585 25139 7400 1 13 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.513 -0.148 25139 7401 1 13 . 1 1 122 122 LEU C C 122 176.743 176.743 175.567 1.176 25139 7402 1 13 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.014 0.650 25139 7403 1 13 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.849 -1.615 25139 7404 1 13 . 1 1 122 122 LEU H H 122 8.256 8.256 8.269 -0.013 25139 7405 1 13 . 1 1 123 123 TYR N N 123 123.081 123.081 122.437 0.644 25139 7406 1 13 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.725 -0.682 25139 7407 1 13 . 1 1 123 123 TYR C C 123 173.633 173.633 174.588 -0.955 25139 7408 1 13 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.373 -0.485 25139 7409 1 13 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.510 -0.429 25139 7410 1 13 . 1 1 123 123 TYR H H 123 8.990 8.990 8.996 -0.006 25139 7411 1 13 . 1 1 124 124 GLU N N 124 128.742 128.742 126.666 2.076 25139 7412 1 13 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.744 -0.194 25139 7413 1 13 . 1 1 124 124 GLU C C 124 174.835 174.835 175.523 -0.688 25139 7414 1 13 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.442 0.190 25139 7415 1 13 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.333 -0.438 25139 7416 1 13 . 1 1 124 124 GLU H H 124 9.135 9.135 8.792 0.343 25139 7417 1 13 . 1 1 125 125 GLN N N 125 108.066 108.066 109.918 -1.852 25139 7418 1 13 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.934 -0.213 25139 7419 1 13 . 1 1 125 125 GLN C C 125 174.627 174.627 174.921 -0.294 25139 7420 1 13 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.336 0.703 25139 7421 1 13 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.757 -0.429 25139 7422 1 13 . 1 1 125 125 GLN H H 125 8.390 8.390 8.588 -0.198 25139 7423 1 13 . 1 1 126 126 ASN N N 126 118.528 118.528 117.682 0.846 25139 7424 1 13 . 1 1 126 126 ASN C C 126 173.713 173.713 174.737 -1.024 25139 7425 1 13 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.119 0.070 25139 7426 1 13 . 1 1 126 126 ASN CB C 126 40.801 40.801 40.124 0.677 25139 7427 1 13 . 1 1 126 126 ASN H H 126 8.092 8.092 7.949 0.143 25139 7428 1 13 . 1 1 127 127 PHE N N 127 124.680 124.680 122.070 2.610 25139 7429 1 13 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.838 0.199 25139 7430 1 13 . 1 1 127 127 PHE C C 127 177.125 177.125 176.635 0.490 25139 7431 1 13 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.223 1.190 25139 7432 1 13 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.151 1.093 25139 7433 1 13 . 1 1 127 127 PHE H H 127 9.026 9.026 8.882 0.144 25139 7434 1 13 . 1 1 128 128 VAL N N 128 119.455 119.455 118.359 1.096 25139 7435 1 13 . 1 1 128 128 VAL C C 128 175.886 175.886 175.657 0.229 25139 7436 1 13 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.885 -0.966 25139 7437 1 13 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.221 1.973 25139 7438 1 13 . 1 1 128 128 VAL H H 128 8.364 8.364 7.579 0.785 25139 7439 1 13 . 1 1 129 129 CYS N N 129 116.130 116.130 119.953 -3.823 25139 7440 1 13 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.807 -0.330 25139 7441 1 13 . 1 1 129 129 CYS C C 129 170.569 170.569 174.428 -3.859 25139 7442 1 13 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.617 -3.467 25139 7443 1 13 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.982 18.635 25139 7444 1 13 . 1 1 129 129 CYS H H 129 5.390 5.390 7.271 -1.881 25139 7445 1 13 . 1 1 130 130 LYS N N 130 120.071 120.071 125.750 -5.679 25139 7446 1 13 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.250 0.311 25139 7447 1 13 . 1 1 130 130 LYS C C 130 176.853 176.853 174.478 2.375 25139 7448 1 13 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.966 -0.079 25139 7449 1 13 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.397 1.245 25139 7450 1 13 . 1 1 130 130 LYS H H 130 8.066 8.066 8.639 -0.573 25139 7451 1 13 . 1 1 131 131 PHE N N 131 118.415 118.415 119.796 -1.381 25139 7452 1 13 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.446 -0.839 25139 7453 1 13 . 1 1 131 131 PHE C C 131 174.013 174.013 175.075 -1.062 25139 7454 1 13 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.239 1.472 25139 7455 1 13 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.373 0.707 25139 7456 1 13 . 1 1 131 131 PHE H H 131 8.714 8.714 8.223 0.491 25139 7457 1 13 . 1 1 132 132 ALA N N 132 124.209 124.209 122.900 1.309 25139 7458 1 13 . 1 1 132 132 ALA HA H 132 4.617 4.617 4.974 -0.357 25139 7459 1 13 . 1 1 132 132 ALA C C 132 174.352 174.352 174.324 0.028 25139 7460 1 13 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.669 1.772 25139 7461 1 13 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.934 -0.470 25139 7462 1 13 . 1 1 132 132 ALA H H 132 9.295 9.295 9.126 0.169 25139 7463 1 13 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.615 -0.732 25139 7464 1 13 . 1 1 133 133 PRO C C 133 173.923 173.923 176.594 -2.671 25139 7465 1 13 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.806 0.265 25139 7466 1 13 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.615 -1.012 25139 7467 1 13 . 1 1 134 134 ARG N N 134 126.071 126.071 122.131 3.940 25139 7468 1 13 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.574 -0.319 25139 7469 1 13 . 1 1 134 134 ARG C C 134 177.065 177.065 177.109 -0.044 25139 7470 1 13 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.514 2.650 25139 7471 1 13 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.309 -1.126 25139 7472 1 13 . 1 1 134 134 ARG H H 134 8.672 8.672 8.740 -0.068 25139 7473 1 13 . 1 1 135 135 GLU N N 135 125.683 125.683 121.212 4.471 25139 7474 1 13 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.314 0.039 25139 7475 1 13 . 1 1 135 135 GLU C C 135 178.081 178.081 176.955 1.126 25139 7476 1 13 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.099 0.552 25139 7477 1 13 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.236 0.760 25139 7478 1 13 . 1 1 135 135 GLU H H 135 8.603 8.603 8.820 -0.217 25139 7479 1 13 . 1 1 136 136 GLY N N 136 110.031 110.031 106.941 3.090 25139 7480 1 13 . 1 1 136 136 GLY C C 136 173.079 173.079 173.421 -0.342 25139 7481 1 13 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.866 0.912 25139 7482 1 13 . 1 1 136 136 GLY H H 136 9.036 9.036 8.219 0.817 25139 7483 1 13 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.738 0.937 25139 7484 1 13 . 1 1 137 137 PHE C C 137 174.936 174.936 175.128 -0.192 25139 7485 1 13 . 1 1 137 137 PHE CA C 137 56.084 56.084 57.778 -1.694 25139 7486 1 13 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.594 5.102 25139 7487 1 13 . 1 1 138 138 ILE N N 138 117.417 117.417 113.685 3.732 25139 7488 1 13 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.662 -0.155 25139 7489 1 13 . 1 1 138 138 ILE C C 138 173.858 173.858 173.551 0.307 25139 7490 1 13 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.614 1.006 25139 7491 1 13 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.073 1.524 25139 7492 1 13 . 1 1 138 138 ILE H H 138 8.777 8.777 8.121 0.656 25139 7493 1 13 . 1 1 139 139 ASN N N 139 117.201 117.201 116.707 0.494 25139 7494 1 13 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.566 0.493 25139 7495 1 13 . 1 1 139 139 ASN C C 139 173.721 173.721 173.943 -0.222 25139 7496 1 13 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.776 -1.546 25139 7497 1 13 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.531 1.330 25139 7498 1 13 . 1 1 139 139 ASN H H 139 8.872 8.872 8.293 0.579 25139 7499 1 13 . 1 1 140 140 TYR N N 140 123.991 123.991 119.820 4.171 25139 7500 1 13 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.857 0.321 25139 7501 1 13 . 1 1 140 140 TYR C C 140 174.791 174.791 175.088 -0.297 25139 7502 1 13 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.035 -0.963 25139 7503 1 13 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.034 1.636 25139 7504 1 13 . 1 1 140 140 TYR H H 140 9.526 9.526 9.045 0.481 25139 7505 1 13 . 1 1 141 141 LEU N N 141 122.779 122.779 120.556 2.223 25139 7506 1 13 . 1 1 141 141 LEU C C 141 175.404 175.404 177.489 -2.085 25139 7507 1 13 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.798 2.305 25139 7508 1 13 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.211 -1.050 25139 7509 1 13 . 1 1 141 141 LEU H H 141 9.010 9.010 9.065 -0.055 25139 7510 1 13 . 1 1 142 142 THR N N 142 113.189 113.189 111.561 1.628 25139 7511 1 13 . 1 1 142 142 THR HA H 142 4.061 4.061 4.398 -0.337 25139 7512 1 13 . 1 1 142 142 THR C C 142 175.940 175.940 176.271 -0.331 25139 7513 1 13 . 1 1 142 142 THR CA C 142 61.389 61.389 60.538 0.851 25139 7514 1 13 . 1 1 142 142 THR CB C 142 69.779 69.779 70.476 -0.697 25139 7515 1 13 . 1 1 142 142 THR H H 142 7.737 7.737 8.107 -0.370 25139 7516 1 13 . 1 1 143 143 ARG N N 143 120.975 120.975 119.293 1.682 25139 7517 1 13 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.037 -0.099 25139 7518 1 13 . 1 1 143 143 ARG C C 143 178.690 178.690 177.237 1.453 25139 7519 1 13 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.505 1.243 25139 7520 1 13 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.669 0.476 25139 7521 1 13 . 1 1 143 143 ARG H H 143 8.149 8.149 8.321 -0.172 25139 7522 1 13 . 1 1 144 144 GLU N N 144 116.997 116.997 116.197 0.800 25139 7523 1 13 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.362 -0.253 25139 7524 1 13 . 1 1 144 144 GLU C C 144 178.442 178.442 176.566 1.876 25139 7525 1 13 . 1 1 144 144 GLU CA C 144 59.863 59.863 57.438 2.425 25139 7526 1 13 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.434 -0.852 25139 7527 1 13 . 1 1 144 144 GLU H H 144 8.622 8.622 7.606 1.016 25139 7528 1 13 . 1 1 145 145 VAL N N 145 111.213 111.213 118.081 -6.868 25139 7529 1 13 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.090 0.321 25139 7530 1 13 . 1 1 145 145 VAL C C 145 176.965 176.965 176.025 0.940 25139 7531 1 13 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.180 0.414 25139 7532 1 13 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.718 -0.636 25139 7533 1 13 . 1 1 145 145 VAL H H 145 7.227 7.227 7.671 -0.444 25139 7534 1 13 . 1 1 146 146 TYR N N 146 123.512 123.512 122.381 1.131 25139 7535 1 13 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.021 -0.141 25139 7536 1 13 . 1 1 146 146 TYR C C 146 176.377 176.377 176.675 -0.298 25139 7537 1 13 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.370 0.167 25139 7538 1 13 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.539 -0.201 25139 7539 1 13 . 1 1 146 146 TYR H H 146 8.492 8.492 8.781 -0.289 25139 7540 1 13 . 1 1 147 147 ARG N N 147 116.680 116.680 116.799 -0.119 25139 7541 1 13 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.733 0.081 25139 7542 1 13 . 1 1 147 147 ARG C C 147 178.858 178.858 177.480 1.378 25139 7543 1 13 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.568 0.128 25139 7544 1 13 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.265 0.400 25139 7545 1 13 . 1 1 147 147 ARG H H 147 8.053 8.053 8.805 -0.752 25139 7546 1 13 . 1 1 148 148 SER N N 148 115.306 115.306 115.884 -0.578 25139 7547 1 13 . 1 1 148 148 SER HA H 148 3.998 3.998 4.404 -0.406 25139 7548 1 13 . 1 1 148 148 SER C C 148 175.786 175.786 175.630 0.156 25139 7549 1 13 . 1 1 148 148 SER CA C 148 62.006 62.006 60.357 1.649 25139 7550 1 13 . 1 1 148 148 SER H H 148 7.139 7.139 7.472 -0.333 25139 7551 1 13 . 1 1 149 149 TYR N N 149 123.207 123.207 122.040 1.167 25139 7552 1 13 . 1 1 149 149 TYR C C 149 175.831 175.831 176.353 -0.522 25139 7553 1 13 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.053 -0.453 25139 7554 1 13 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.619 0.162 25139 7555 1 13 . 1 1 149 149 TYR H H 149 7.253 7.253 7.216 0.037 25139 7556 1 13 . 1 1 150 150 ARG N N 150 118.708 118.708 116.731 1.977 25139 7557 1 13 . 1 1 150 150 ARG HA H 150 3.346 3.346 4.100 -0.754 25139 7558 1 13 . 1 1 150 150 ARG C C 150 177.644 177.644 178.161 -0.517 25139 7559 1 13 . 1 1 150 150 ARG CA C 150 57.323 57.323 56.832 0.491 25139 7560 1 13 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.680 -0.827 25139 7561 1 13 . 1 1 150 150 ARG H H 150 8.441 8.441 7.762 0.679 25139 7562 1 13 . 1 1 151 151 GLN N N 151 116.551 116.551 117.735 -1.184 25139 7563 1 13 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.104 -0.147 25139 7564 1 13 . 1 1 151 151 GLN C C 151 177.987 177.987 176.333 1.654 25139 7565 1 13 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.491 -0.150 25139 7566 1 13 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.389 0.075 25139 7567 1 13 . 1 1 151 151 GLN H H 151 7.332 7.332 7.814 -0.482 25139 7568 1 13 . 1 1 152 152 LEU N N 152 118.877 118.877 113.457 5.420 25139 7569 1 13 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.706 -0.527 25139 7570 1 13 . 1 1 152 152 LEU C C 152 179.070 179.070 177.203 1.867 25139 7571 1 13 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.082 1.000 25139 7572 1 13 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.327 -0.639 25139 7573 1 13 . 1 1 152 152 LEU H H 152 7.106 7.106 7.430 -0.324 25139 7574 1 13 . 1 1 153 153 VAL N N 153 119.076 119.076 113.596 5.480 25139 7575 1 13 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.275 -1.415 25139 7576 1 13 . 1 1 153 153 VAL C C 153 177.421 177.421 176.472 0.949 25139 7577 1 13 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.539 2.044 25139 7578 1 13 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.544 -2.026 25139 7579 1 13 . 1 1 153 153 VAL H H 153 7.427 7.427 7.326 0.101 25139 7580 1 13 . 1 1 154 154 ASP N N 154 119.888 119.888 123.517 -3.629 25139 7581 1 13 . 1 1 154 154 ASP C C 154 177.422 177.422 176.198 1.224 25139 7582 1 13 . 1 1 154 154 ASP CA C 154 56.071 56.071 54.042 2.029 25139 7583 1 13 . 1 1 154 154 ASP CB C 154 40.349 40.349 39.239 1.110 25139 7584 1 13 . 1 1 154 154 ASP H H 154 7.930 7.930 8.149 -0.219 25139 7585 1 13 . 1 1 155 155 HIS N N 155 117.821 117.821 123.390 -5.569 25139 7586 1 13 . 1 1 155 155 HIS CA C 155 57.756 57.756 58.529 -0.773 25139 7587 1 13 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.139 0.041 25139 7588 1 13 . 1 1 155 155 HIS H H 155 7.680 7.680 8.025 -0.345 25139 7589 1 13 . 1 1 156 156 HIS N N 156 119.180 119.180 116.872 2.308 25139 7590 1 13 . 1 1 156 156 HIS CA C 156 57.931 57.931 58.012 -0.081 25139 7591 1 13 . 1 1 156 156 HIS CB C 156 30.300 30.300 29.628 0.672 25139 7592 1 13 . 1 1 156 156 HIS H H 156 7.868 7.868 8.545 -0.677 25139 7593 1 14 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.179 0.725 25139 7594 1 14 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.238 -0.016 25139 7595 1 14 . 1 1 49 49 ASP N N 49 119.661 119.661 119.008 0.653 25139 7596 1 14 . 1 1 49 49 ASP CA C 49 54.277 54.277 53.406 0.871 25139 7597 1 14 . 1 1 49 49 ASP CB C 49 41.062 41.062 42.156 -1.094 25139 7598 1 14 . 1 1 49 49 ASP H H 49 8.462 8.462 8.273 0.189 25139 7599 1 14 . 1 1 51 51 LEU HA H 51 4.052 4.052 3.998 0.054 25139 7600 1 14 . 1 1 51 51 LEU C C 51 178.514 178.514 178.236 0.278 25139 7601 1 14 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.359 0.690 25139 7602 1 14 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.115 0.078 25139 7603 1 14 . 1 1 52 52 ASN N N 52 113.819 113.819 117.857 -4.038 25139 7604 1 14 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.594 0.241 25139 7605 1 14 . 1 1 52 52 ASN C C 52 175.964 175.964 175.957 0.007 25139 7606 1 14 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.001 -0.905 25139 7607 1 14 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.619 0.264 25139 7608 1 14 . 1 1 52 52 ASN H H 52 7.853 7.853 8.289 -0.436 25139 7609 1 14 . 1 1 53 53 SER N N 53 114.357 114.357 113.644 0.713 25139 7610 1 14 . 1 1 53 53 SER CA C 53 59.908 59.908 59.863 0.045 25139 7611 1 14 . 1 1 53 53 SER CB C 53 64.395 64.395 63.474 0.921 25139 7612 1 14 . 1 1 53 53 SER H H 53 8.023 8.023 8.411 -0.388 25139 7613 1 14 . 1 1 54 54 PHE N N 54 121.037 121.037 119.718 1.319 25139 7614 1 14 . 1 1 54 54 PHE C C 54 175.522 175.522 175.003 0.519 25139 7615 1 14 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.124 0.940 25139 7616 1 14 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.264 -0.211 25139 7617 1 14 . 1 1 54 54 PHE H H 54 7.731 7.731 7.764 -0.033 25139 7618 1 14 . 1 1 55 55 THR N N 55 116.535 116.535 117.582 -1.047 25139 7619 1 14 . 1 1 55 55 THR HA H 55 4.654 4.654 4.697 -0.043 25139 7620 1 14 . 1 1 55 55 THR C C 55 173.301 173.301 173.257 0.044 25139 7621 1 14 . 1 1 55 55 THR CA C 55 61.420 61.420 60.827 0.593 25139 7622 1 14 . 1 1 55 55 THR CB C 55 71.388 71.388 71.384 0.004 25139 7623 1 14 . 1 1 55 55 THR H H 55 8.929 8.929 9.035 -0.106 25139 7624 1 14 . 1 1 56 56 ALA N N 56 129.359 129.359 128.944 0.415 25139 7625 1 14 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.069 0.246 25139 7626 1 14 . 1 1 56 56 ALA C C 56 178.305 178.305 177.203 1.102 25139 7627 1 14 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.065 0.806 25139 7628 1 14 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.168 0.156 25139 7629 1 14 . 1 1 56 56 ALA H H 56 8.907 8.907 8.621 0.286 25139 7630 1 14 . 1 1 57 57 GLY N N 57 106.331 106.331 110.847 -4.516 25139 7631 1 14 . 1 1 57 57 GLY CA C 57 44.611 44.611 44.103 0.508 25139 7632 1 14 . 1 1 57 57 GLY H H 57 7.978 7.978 8.314 -0.336 25139 7633 1 14 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.313 0.011 25139 7634 1 14 . 1 1 59 59 PRO C C 59 177.466 177.466 177.374 0.092 25139 7635 1 14 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.006 1.478 25139 7636 1 14 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.066 -0.331 25139 7637 1 14 . 1 1 60 60 GLY N N 60 109.688 109.688 108.515 1.173 25139 7638 1 14 . 1 1 60 60 GLY C C 60 173.555 173.555 173.184 0.371 25139 7639 1 14 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.874 0.667 25139 7640 1 14 . 1 1 60 60 GLY H H 60 8.402 8.402 8.717 -0.315 25139 7641 1 14 . 1 1 61 61 PHE N N 61 122.491 122.491 121.823 0.668 25139 7642 1 14 . 1 1 61 61 PHE C C 61 175.146 175.146 174.543 0.603 25139 7643 1 14 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.607 1.675 25139 7644 1 14 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.153 -2.454 25139 7645 1 14 . 1 1 61 61 PHE H H 61 7.957 7.957 7.305 0.652 25139 7646 1 14 . 1 1 62 62 VAL N N 62 121.128 121.128 117.641 3.487 25139 7647 1 14 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.329 -0.244 25139 7648 1 14 . 1 1 62 62 VAL C C 62 174.937 174.937 174.903 0.034 25139 7649 1 14 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.341 0.367 25139 7650 1 14 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.976 0.456 25139 7651 1 14 . 1 1 62 62 VAL H H 62 7.994 7.994 9.254 -1.260 25139 7652 1 14 . 1 1 63 63 LEU N N 63 124.386 124.386 122.472 1.914 25139 7653 1 14 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.873 -1.557 25139 7654 1 14 . 1 1 63 63 LEU C C 63 175.278 175.278 176.321 -1.043 25139 7655 1 14 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.932 0.356 25139 7656 1 14 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.427 1.691 25139 7657 1 14 . 1 1 63 63 LEU H H 63 7.572 7.572 9.057 -1.485 25139 7658 1 14 . 1 1 64 64 ASP N N 64 126.746 126.746 127.069 -0.323 25139 7659 1 14 . 1 1 64 64 ASP C C 64 177.801 177.801 175.693 2.108 25139 7660 1 14 . 1 1 64 64 ASP CA C 64 51.721 51.721 52.616 -0.895 25139 7661 1 14 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.767 -1.369 25139 7662 1 14 . 1 1 64 64 ASP H H 64 8.552 8.552 8.389 0.163 25139 7663 1 14 . 1 1 65 65 THR C C 65 175.002 175.002 175.807 -0.805 25139 7664 1 14 . 1 1 65 65 THR CB C 65 67.919 67.919 68.846 -0.926 25139 7665 1 14 . 1 1 66 66 GLN N N 66 120.804 120.804 118.752 2.052 25139 7666 1 14 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.142 -0.265 25139 7667 1 14 . 1 1 66 66 GLN C C 66 178.901 178.901 176.133 2.768 25139 7668 1 14 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.713 1.703 25139 7669 1 14 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.246 -0.322 25139 7670 1 14 . 1 1 66 66 GLN H H 66 8.447 8.447 8.199 0.248 25139 7671 1 14 . 1 1 67 67 ALA N N 67 121.267 121.267 120.308 0.959 25139 7672 1 14 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.310 -0.353 25139 7673 1 14 . 1 1 67 67 ALA C C 67 176.777 176.777 178.984 -2.207 25139 7674 1 14 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.262 1.062 25139 7675 1 14 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.804 -1.184 25139 7676 1 14 . 1 1 67 67 ALA H H 67 7.791 7.791 7.344 0.447 25139 7677 1 14 . 1 1 68 68 SER N N 68 113.339 113.339 114.702 -1.363 25139 7678 1 14 . 1 1 68 68 SER HA H 68 4.061 4.061 4.137 -0.076 25139 7679 1 14 . 1 1 68 68 SER C C 68 175.875 175.875 176.691 -0.816 25139 7680 1 14 . 1 1 68 68 SER CA C 68 62.970 62.970 60.773 2.197 25139 7681 1 14 . 1 1 68 68 SER CB C 68 61.330 61.330 63.941 -2.611 25139 7682 1 14 . 1 1 68 68 SER H H 68 7.785 7.785 7.892 -0.107 25139 7683 1 14 . 1 1 69 69 VAL N N 69 125.140 125.140 117.087 8.053 25139 7684 1 14 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.090 -0.014 25139 7685 1 14 . 1 1 69 69 VAL C C 69 176.384 176.384 176.845 -0.461 25139 7686 1 14 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.420 1.311 25139 7687 1 14 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.545 -0.056 25139 7688 1 14 . 1 1 69 69 VAL H H 69 8.572 8.572 8.094 0.478 25139 7689 1 14 . 1 1 70 70 SER N N 70 116.704 116.704 113.563 3.141 25139 7690 1 14 . 1 1 70 70 SER HA H 70 4.229 4.229 4.220 0.009 25139 7691 1 14 . 1 1 70 70 SER C C 70 174.101 174.101 175.305 -1.204 25139 7692 1 14 . 1 1 70 70 SER CA C 70 61.627 61.627 59.349 2.278 25139 7693 1 14 . 1 1 70 70 SER H H 70 7.951 7.951 8.115 -0.164 25139 7694 1 14 . 1 1 71 71 ASN N N 71 117.576 117.576 117.021 0.555 25139 7695 1 14 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.658 0.144 25139 7696 1 14 . 1 1 71 71 ASN C C 71 174.332 174.332 174.773 -0.441 25139 7697 1 14 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.858 -0.419 25139 7698 1 14 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.826 0.641 25139 7699 1 14 . 1 1 71 71 ASN H H 71 7.131 7.131 7.464 -0.333 25139 7700 1 14 . 1 1 72 72 GLY N N 72 103.925 103.925 105.381 -1.456 25139 7701 1 14 . 1 1 72 72 GLY C C 72 174.710 174.710 173.466 1.244 25139 7702 1 14 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.531 0.018 25139 7703 1 14 . 1 1 72 72 GLY H H 72 7.338 7.338 7.354 -0.016 25139 7704 1 14 . 1 1 73 73 ALA N N 73 124.942 124.942 122.973 1.969 25139 7705 1 14 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.581 -0.409 25139 7706 1 14 . 1 1 73 73 ALA C C 73 175.896 175.896 176.244 -0.348 25139 7707 1 14 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.750 0.923 25139 7708 1 14 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.111 -0.055 25139 7709 1 14 . 1 1 73 73 ALA H H 73 8.032 8.032 7.732 0.300 25139 7710 1 14 . 1 1 74 74 THR N N 74 113.423 113.423 115.884 -2.461 25139 7711 1 14 . 1 1 74 74 THR HA H 74 4.678 4.678 4.557 0.121 25139 7712 1 14 . 1 1 74 74 THR C C 74 173.339 173.339 173.163 0.176 25139 7713 1 14 . 1 1 74 74 THR CA C 74 61.545 61.545 61.648 -0.103 25139 7714 1 14 . 1 1 74 74 THR CB C 74 71.319 71.319 71.402 -0.083 25139 7715 1 14 . 1 1 74 74 THR H H 74 8.530 8.530 8.301 0.229 25139 7716 1 14 . 1 1 75 75 PHE N N 75 128.180 128.180 130.640 -2.460 25139 7717 1 14 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.900 -0.296 25139 7718 1 14 . 1 1 75 75 PHE C C 75 174.623 174.623 175.322 -0.699 25139 7719 1 14 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.510 2.106 25139 7720 1 14 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.550 1.125 25139 7721 1 14 . 1 1 75 75 PHE H H 75 9.146 9.146 9.118 0.028 25139 7722 1 14 . 1 1 76 76 LEU N N 76 127.849 127.849 124.935 2.914 25139 7723 1 14 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.462 -0.111 25139 7724 1 14 . 1 1 76 76 LEU C C 76 176.339 176.339 176.949 -0.610 25139 7725 1 14 . 1 1 76 76 LEU CA C 76 55.983 55.983 56.029 -0.046 25139 7726 1 14 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.172 0.158 25139 7727 1 14 . 1 1 76 76 LEU H H 76 8.635 8.635 8.076 0.559 25139 7728 1 14 . 1 1 77 77 GLU N N 77 115.131 115.131 119.375 -4.244 25139 7729 1 14 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.522 -0.114 25139 7730 1 14 . 1 1 77 77 GLU C C 77 174.734 174.734 174.903 -0.169 25139 7731 1 14 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.546 0.807 25139 7732 1 14 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.104 0.103 25139 7733 1 14 . 1 1 77 77 GLU H H 77 7.252 7.252 7.714 -0.462 25139 7734 1 14 . 1 1 78 78 SER N N 78 118.016 118.016 118.273 -0.257 25139 7735 1 14 . 1 1 78 78 SER HA H 78 5.561 5.561 5.185 0.376 25139 7736 1 14 . 1 1 78 78 SER C C 78 171.968 171.968 172.644 -0.676 25139 7737 1 14 . 1 1 78 78 SER CA C 78 54.061 54.061 54.496 -0.435 25139 7738 1 14 . 1 1 78 78 SER CB C 78 64.074 64.074 63.568 0.506 25139 7739 1 14 . 1 1 78 78 SER H H 78 9.033 9.033 8.692 0.341 25139 7740 1 14 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.032 -0.432 25139 7741 1 14 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.369 0.041 25139 7742 1 14 . 1 1 80 80 THR N N 80 118.079 118.079 115.218 2.861 25139 7743 1 14 . 1 1 80 80 THR HA H 80 4.342 4.342 4.320 0.022 25139 7744 1 14 . 1 1 80 80 THR C C 80 174.494 174.494 174.750 -0.256 25139 7745 1 14 . 1 1 80 80 THR CA C 80 61.453 61.453 60.412 1.041 25139 7746 1 14 . 1 1 80 80 THR CB C 80 67.797 67.797 68.499 -0.702 25139 7747 1 14 . 1 1 80 80 THR H H 80 8.670 8.670 8.290 0.381 25139 7748 1 14 . 1 1 81 81 VAL N N 81 117.395 117.395 117.690 -0.295 25139 7749 1 14 . 1 1 81 81 VAL HA H 81 4.607 4.607 4.058 0.549 25139 7750 1 14 . 1 1 81 81 VAL C C 81 175.518 175.518 175.922 -0.404 25139 7751 1 14 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.310 -3.196 25139 7752 1 14 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.889 1.706 25139 7753 1 14 . 1 1 81 81 VAL H H 81 7.448 7.448 7.308 0.140 25139 7754 1 14 . 1 1 82 82 ARG N N 82 117.852 117.852 119.300 -1.448 25139 7755 1 14 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.598 -0.077 25139 7756 1 14 . 1 1 82 82 ARG C C 82 176.992 176.992 176.130 0.862 25139 7757 1 14 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.535 0.850 25139 7758 1 14 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.425 1.177 25139 7759 1 14 . 1 1 82 82 ARG H H 82 8.710 8.710 8.625 0.085 25139 7760 1 14 . 1 1 83 83 ARG N N 83 117.035 117.035 117.786 -0.751 25139 7761 1 14 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.813 0.509 25139 7762 1 14 . 1 1 83 83 ARG C C 83 177.379 177.379 176.656 0.723 25139 7763 1 14 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.719 -1.035 25139 7764 1 14 . 1 1 83 83 ARG CB C 83 33.041 33.041 34.099 -1.058 25139 7765 1 14 . 1 1 83 83 ARG H H 83 7.292 7.292 7.702 -0.410 25139 7766 1 14 . 1 1 84 84 GLY N N 84 114.911 114.911 110.044 4.867 25139 7767 1 14 . 1 1 84 84 GLY C C 84 176.940 176.940 175.224 1.716 25139 7768 1 14 . 1 1 84 84 GLY CA C 84 48.672 48.672 47.066 1.606 25139 7769 1 14 . 1 1 84 84 GLY H H 84 9.255 9.255 8.447 0.808 25139 7770 1 14 . 1 1 85 85 TRP N N 85 121.810 121.810 120.712 1.098 25139 7771 1 14 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.171 -0.004 25139 7772 1 14 . 1 1 85 85 TRP C C 85 178.272 178.272 177.251 1.021 25139 7773 1 14 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.881 0.164 25139 7774 1 14 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.146 0.071 25139 7775 1 14 . 1 1 85 85 TRP H H 85 9.963 9.963 7.748 2.215 25139 7776 1 14 . 1 1 86 86 ASP N N 86 116.400 116.400 118.698 -2.298 25139 7777 1 14 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.438 -0.045 25139 7778 1 14 . 1 1 86 86 ASP C C 86 178.803 178.803 177.674 1.129 25139 7779 1 14 . 1 1 86 86 ASP CA C 86 57.054 57.054 57.106 -0.052 25139 7780 1 14 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.372 0.361 25139 7781 1 14 . 1 1 86 86 ASP H H 86 6.934 6.934 8.012 -1.078 25139 7782 1 14 . 1 1 87 87 CYS N N 87 122.454 122.454 119.524 2.930 25139 7783 1 14 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.219 0.031 25139 7784 1 14 . 1 1 87 87 CYS C C 87 174.956 174.956 176.446 -1.490 25139 7785 1 14 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.745 -3.598 25139 7786 1 14 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.329 11.156 25139 7787 1 14 . 1 1 87 87 CYS H H 87 7.603 7.603 7.527 0.076 25139 7788 1 14 . 1 1 88 88 VAL N N 88 119.192 119.192 120.799 -1.607 25139 7789 1 14 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.083 -0.625 25139 7790 1 14 . 1 1 88 88 VAL C C 88 177.413 177.413 177.754 -0.341 25139 7791 1 14 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.842 1.134 25139 7792 1 14 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.955 -0.713 25139 7793 1 14 . 1 1 88 88 VAL H H 88 7.192 7.192 7.483 -0.291 25139 7794 1 14 . 1 1 89 89 ARG N N 89 118.185 118.185 118.851 -0.666 25139 7795 1 14 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.893 -0.213 25139 7796 1 14 . 1 1 89 89 ARG C C 89 178.677 178.677 177.753 0.924 25139 7797 1 14 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.132 0.823 25139 7798 1 14 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.554 0.237 25139 7799 1 14 . 1 1 89 89 ARG H H 89 7.971 7.971 7.863 0.108 25139 7800 1 14 . 1 1 90 90 ALA N N 90 120.815 120.815 122.173 -1.358 25139 7801 1 14 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.153 -0.078 25139 7802 1 14 . 1 1 90 90 ALA C C 90 177.416 177.416 179.382 -1.966 25139 7803 1 14 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.238 0.016 25139 7804 1 14 . 1 1 90 90 ALA CB C 90 17.436 17.436 17.942 -0.506 25139 7805 1 14 . 1 1 90 90 ALA H H 90 7.453 7.453 7.592 -0.139 25139 7806 1 14 . 1 1 91 91 CYS N N 91 120.380 120.380 116.875 3.505 25139 7807 1 14 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.250 0.121 25139 7808 1 14 . 1 1 91 91 CYS C C 91 176.654 176.654 175.951 0.703 25139 7809 1 14 . 1 1 91 91 CYS CA C 91 57.695 57.695 62.101 -4.406 25139 7810 1 14 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.402 12.302 25139 7811 1 14 . 1 1 91 91 CYS H H 91 7.944 7.944 7.549 0.395 25139 7812 1 14 . 1 1 92 92 CYS N N 92 116.270 116.270 117.056 -0.786 25139 7813 1 14 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.508 -0.104 25139 7814 1 14 . 1 1 92 92 CYS C C 92 175.628 175.628 176.538 -0.910 25139 7815 1 14 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.671 -1.965 25139 7816 1 14 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.649 15.500 25139 7817 1 14 . 1 1 92 92 CYS H H 92 8.315 8.315 7.650 0.665 25139 7818 1 14 . 1 1 93 93 THR N N 93 107.283 107.283 111.063 -3.780 25139 7819 1 14 . 1 1 93 93 THR HA H 93 4.481 4.481 4.392 0.089 25139 7820 1 14 . 1 1 93 93 THR C C 93 173.606 173.606 175.450 -1.844 25139 7821 1 14 . 1 1 93 93 THR CA C 93 61.402 61.402 63.726 -2.324 25139 7822 1 14 . 1 1 93 93 THR CB C 93 69.046 69.046 69.601 -0.555 25139 7823 1 14 . 1 1 93 93 THR H H 93 7.445 7.445 7.618 -0.173 25139 7824 1 14 . 1 1 94 94 THR N N 94 121.432 121.432 121.642 -0.210 25139 7825 1 14 . 1 1 94 94 THR HA H 94 4.398 4.398 4.517 -0.119 25139 7826 1 14 . 1 1 94 94 THR C C 94 173.493 173.493 175.096 -1.603 25139 7827 1 14 . 1 1 94 94 THR CA C 94 62.726 62.726 63.065 -0.339 25139 7828 1 14 . 1 1 94 94 THR CB C 94 69.704 69.704 68.653 1.051 25139 7829 1 14 . 1 1 94 94 THR H H 94 7.553 7.553 8.030 -0.477 25139 7830 1 14 . 1 1 95 95 GLN N N 95 129.410 129.410 128.038 1.372 25139 7831 1 14 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.032 -0.088 25139 7832 1 14 . 1 1 95 95 GLN C C 95 176.293 176.293 176.175 0.118 25139 7833 1 14 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.848 -0.808 25139 7834 1 14 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.707 -0.451 25139 7835 1 14 . 1 1 95 95 GLN H H 95 8.812 8.812 8.782 0.030 25139 7836 1 14 . 1 1 96 96 ASN N N 96 115.015 115.015 114.168 0.847 25139 7837 1 14 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.829 -0.630 25139 7838 1 14 . 1 1 96 96 ASN C C 96 172.260 172.260 174.052 -1.792 25139 7839 1 14 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.010 2.558 25139 7840 1 14 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.910 -2.073 25139 7841 1 14 . 1 1 96 96 ASN H H 96 8.791 8.791 8.163 0.628 25139 7842 1 14 . 1 1 97 97 CYS N N 97 115.830 115.830 120.767 -4.937 25139 7843 1 14 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.474 -0.373 25139 7844 1 14 . 1 1 97 97 CYS C C 97 175.025 175.025 174.150 0.875 25139 7845 1 14 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.874 -1.726 25139 7846 1 14 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.089 16.145 25139 7847 1 14 . 1 1 97 97 CYS H H 97 7.651 7.651 7.843 -0.192 25139 7848 1 14 . 1 1 98 98 ASN N N 98 125.148 125.148 125.071 0.077 25139 7849 1 14 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.038 0.095 25139 7850 1 14 . 1 1 98 98 ASN C C 98 171.892 171.892 174.298 -2.406 25139 7851 1 14 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.902 -0.708 25139 7852 1 14 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.890 -1.942 25139 7853 1 14 . 1 1 98 98 ASN H H 98 8.736 8.736 8.394 0.342 25139 7854 1 14 . 1 1 99 99 LEU N N 99 120.898 120.898 121.863 -0.965 25139 7855 1 14 . 1 1 99 99 LEU C C 99 173.084 173.084 174.193 -1.109 25139 7856 1 14 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.448 2.672 25139 7857 1 14 . 1 1 99 99 LEU CB C 99 44.328 44.328 44.858 -0.530 25139 7858 1 14 . 1 1 99 99 LEU H H 99 8.200 8.200 8.329 -0.129 25139 7859 1 14 . 1 1 100 100 ALA N N 100 128.085 128.085 130.376 -2.291 25139 7860 1 14 . 1 1 100 100 ALA C C 100 174.938 174.938 175.490 -0.552 25139 7861 1 14 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.516 -0.769 25139 7862 1 14 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.301 0.413 25139 7863 1 14 . 1 1 100 100 ALA H H 100 9.156 9.156 9.242 -0.086 25139 7864 1 14 . 1 1 101 101 LEU N N 101 128.723 128.723 128.053 0.670 25139 7865 1 14 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.353 -0.211 25139 7866 1 14 . 1 1 101 101 LEU C C 101 174.379 174.379 175.401 -1.022 25139 7867 1 14 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.539 -0.686 25139 7868 1 14 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.885 0.423 25139 7869 1 14 . 1 1 101 101 LEU H H 101 9.578 9.578 8.944 0.634 25139 7870 1 14 . 1 1 102 102 VAL N N 102 119.417 119.417 120.126 -0.709 25139 7871 1 14 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.280 0.248 25139 7872 1 14 . 1 1 102 102 VAL C C 102 173.660 173.660 174.080 -0.420 25139 7873 1 14 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.818 -0.198 25139 7874 1 14 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.532 -1.259 25139 7875 1 14 . 1 1 102 102 VAL H H 102 9.297 9.297 9.420 -0.123 25139 7876 1 14 . 1 1 103 103 GLU N N 103 124.427 124.427 124.019 0.408 25139 7877 1 14 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.215 -0.350 25139 7878 1 14 . 1 1 103 103 GLU C C 103 176.319 176.319 175.318 1.001 25139 7879 1 14 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.362 -0.261 25139 7880 1 14 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.567 0.635 25139 7881 1 14 . 1 1 103 103 GLU H H 103 7.749 7.749 8.286 -0.537 25139 7882 1 14 . 1 1 104 104 LEU N N 104 127.294 127.294 125.777 1.517 25139 7883 1 14 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.565 -0.245 25139 7884 1 14 . 1 1 104 104 LEU C C 104 176.593 176.593 177.445 -0.852 25139 7885 1 14 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.122 2.962 25139 7886 1 14 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.805 -0.414 25139 7887 1 14 . 1 1 104 104 LEU H H 104 8.323 8.323 8.494 -0.171 25139 7888 1 14 . 1 1 105 105 GLN N N 105 121.361 121.361 114.806 6.555 25139 7889 1 14 . 1 1 105 105 GLN C C 105 172.868 172.868 174.661 -1.793 25139 7890 1 14 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.560 -3.154 25139 7891 1 14 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.492 3.237 25139 7892 1 14 . 1 1 105 105 GLN H H 105 8.095 8.095 8.278 -0.183 25139 7893 1 14 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.489 -0.080 25139 7894 1 14 . 1 1 106 106 PRO C C 106 177.770 177.770 176.888 0.882 25139 7895 1 14 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.493 -0.008 25139 7896 1 14 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.106 -0.338 25139 7897 1 14 . 1 1 107 107 ASP N N 107 116.484 116.484 116.001 0.483 25139 7898 1 14 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.588 -0.148 25139 7899 1 14 . 1 1 107 107 ASP C C 107 176.749 176.749 175.687 1.062 25139 7900 1 14 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.416 0.039 25139 7901 1 14 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.407 -1.519 25139 7902 1 14 . 1 1 107 107 ASP H H 107 8.638 8.638 8.494 0.144 25139 7903 1 14 . 1 1 108 108 ARG N N 108 117.895 117.895 119.902 -2.007 25139 7904 1 14 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.718 -0.228 25139 7905 1 14 . 1 1 108 108 ARG C C 108 176.111 176.111 176.786 -0.675 25139 7906 1 14 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.291 -0.026 25139 7907 1 14 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.172 -0.096 25139 7908 1 14 . 1 1 108 108 ARG H H 108 7.905 7.905 8.287 -0.382 25139 7909 1 14 . 1 1 109 109 GLY N N 109 108.307 108.307 108.973 -0.666 25139 7910 1 14 . 1 1 109 109 GLY C C 109 173.949 173.949 175.205 -1.256 25139 7911 1 14 . 1 1 109 109 GLY CA C 109 44.551 44.551 46.564 -2.013 25139 7912 1 14 . 1 1 109 109 GLY H H 109 7.753 7.753 8.340 -0.587 25139 7913 1 14 . 1 1 110 110 GLU N N 110 120.035 120.035 122.423 -2.388 25139 7914 1 14 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.486 -0.395 25139 7915 1 14 . 1 1 110 110 GLU C C 110 177.045 177.045 177.567 -0.522 25139 7916 1 14 . 1 1 110 110 GLU CA C 110 58.282 58.282 57.200 1.082 25139 7917 1 14 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.823 -1.149 25139 7918 1 14 . 1 1 110 110 GLU H H 110 8.509 8.509 7.922 0.587 25139 7919 1 14 . 1 1 111 111 ASP N N 111 121.160 121.160 120.521 0.639 25139 7920 1 14 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.473 0.097 25139 7921 1 14 . 1 1 111 111 ASP C C 111 175.089 175.089 175.511 -0.422 25139 7922 1 14 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.939 -1.348 25139 7923 1 14 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.166 1.266 25139 7924 1 14 . 1 1 111 111 ASP H H 111 8.916 8.916 8.565 0.351 25139 7925 1 14 . 1 1 112 112 ALA N N 112 122.130 122.130 118.578 3.552 25139 7926 1 14 . 1 1 112 112 ALA C C 112 178.120 178.120 176.061 2.059 25139 7927 1 14 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.430 2.829 25139 7928 1 14 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.103 -1.333 25139 7929 1 14 . 1 1 112 112 ALA H H 112 7.361 7.361 7.408 -0.047 25139 7930 1 14 . 1 1 113 113 ILE N N 113 113.780 113.780 114.656 -0.876 25139 7931 1 14 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.858 0.028 25139 7932 1 14 . 1 1 113 113 ILE C C 113 174.258 174.258 174.953 -0.695 25139 7933 1 14 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.195 0.317 25139 7934 1 14 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.823 0.025 25139 7935 1 14 . 1 1 113 113 ILE H H 113 7.667 7.667 8.274 -0.607 25139 7936 1 14 . 1 1 114 114 ALA N N 114 122.673 122.673 126.171 -3.498 25139 7937 1 14 . 1 1 114 114 ALA C C 114 176.984 176.984 176.753 0.231 25139 7938 1 14 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.227 -1.663 25139 7939 1 14 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.505 1.077 25139 7940 1 14 . 1 1 114 114 ALA H H 114 8.904 8.904 8.805 0.099 25139 7941 1 14 . 1 1 115 115 ALA N N 115 116.486 116.486 116.484 0.002 25139 7942 1 14 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.419 -0.064 25139 7943 1 14 . 1 1 115 115 ALA C C 115 174.138 174.138 174.163 -0.025 25139 7944 1 14 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.824 1.496 25139 7945 1 14 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.366 1.617 25139 7946 1 14 . 1 1 115 115 ALA H H 115 7.182 7.182 7.209 -0.027 25139 7947 1 14 . 1 1 116 116 CYS N N 116 120.099 120.099 120.027 0.072 25139 7948 1 14 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.257 0.074 25139 7949 1 14 . 1 1 116 116 CYS C C 116 176.609 176.609 172.623 3.986 25139 7950 1 14 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.096 -2.147 25139 7951 1 14 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.637 11.748 25139 7952 1 14 . 1 1 116 116 CYS H H 116 8.298 8.298 7.872 0.426 25139 7953 1 14 . 1 1 117 117 PHE N N 117 126.406 126.406 126.276 0.130 25139 7954 1 14 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.165 0.034 25139 7955 1 14 . 1 1 117 117 PHE C C 117 173.385 173.385 174.397 -1.012 25139 7956 1 14 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.030 0.224 25139 7957 1 14 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.207 0.474 25139 7958 1 14 . 1 1 117 117 PHE H H 117 9.712 9.712 9.153 0.559 25139 7959 1 14 . 1 1 118 118 LEU N N 118 122.119 122.119 124.010 -1.891 25139 7960 1 14 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.477 -0.311 25139 7961 1 14 . 1 1 118 118 LEU C C 118 175.097 175.097 176.474 -1.377 25139 7962 1 14 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.163 -0.259 25139 7963 1 14 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.375 -1.077 25139 7964 1 14 . 1 1 118 118 LEU H H 118 8.719 8.719 9.356 -0.637 25139 7965 1 14 . 1 1 119 119 ILE N N 119 125.324 125.324 122.802 2.522 25139 7966 1 14 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.910 -0.033 25139 7967 1 14 . 1 1 119 119 ILE C C 119 173.825 173.825 175.587 -1.762 25139 7968 1 14 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.834 -0.727 25139 7969 1 14 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.185 -0.675 25139 7970 1 14 . 1 1 119 119 ILE H H 119 8.986 8.986 9.067 -0.081 25139 7971 1 14 . 1 1 120 120 ASN N N 120 121.534 121.534 124.675 -3.141 25139 7972 1 14 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.759 0.631 25139 7973 1 14 . 1 1 120 120 ASN C C 120 176.098 176.098 175.933 0.165 25139 7974 1 14 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.693 -4.236 25139 7975 1 14 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.026 0.892 25139 7976 1 14 . 1 1 120 120 ASN H H 120 8.694 8.694 9.103 -0.409 25139 7977 1 14 . 1 1 121 121 CYS N N 121 122.779 122.779 118.026 4.753 25139 7978 1 14 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.138 0.345 25139 7979 1 14 . 1 1 121 121 CYS C C 121 173.195 173.195 173.448 -0.253 25139 7980 1 14 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.695 -3.931 25139 7981 1 14 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.686 16.021 25139 7982 1 14 . 1 1 121 121 CYS H H 121 10.668 10.668 8.518 2.150 25139 7983 1 14 . 1 1 122 122 LEU N N 122 121.063 121.063 117.162 3.901 25139 7984 1 14 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.496 -0.131 25139 7985 1 14 . 1 1 122 122 LEU C C 122 176.743 176.743 175.513 1.230 25139 7986 1 14 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.975 0.689 25139 7987 1 14 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.950 -1.716 25139 7988 1 14 . 1 1 122 122 LEU H H 122 8.256 8.256 8.074 0.182 25139 7989 1 14 . 1 1 123 123 TYR N N 123 123.081 123.081 122.469 0.612 25139 7990 1 14 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.741 -0.698 25139 7991 1 14 . 1 1 123 123 TYR C C 123 173.633 173.633 174.898 -1.265 25139 7992 1 14 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.147 -0.259 25139 7993 1 14 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.489 -0.407 25139 7994 1 14 . 1 1 123 123 TYR H H 123 8.990 8.990 8.952 0.038 25139 7995 1 14 . 1 1 124 124 GLU N N 124 128.742 128.742 127.160 1.582 25139 7996 1 14 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.738 -0.188 25139 7997 1 14 . 1 1 124 124 GLU C C 124 174.835 174.835 175.441 -0.606 25139 7998 1 14 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.477 0.155 25139 7999 1 14 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.260 -0.365 25139 8000 1 14 . 1 1 124 124 GLU H H 124 9.135 9.135 8.777 0.358 25139 8001 1 14 . 1 1 125 125 GLN N N 125 108.066 108.066 109.897 -1.831 25139 8002 1 14 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.933 -0.212 25139 8003 1 14 . 1 1 125 125 GLN C C 125 174.627 174.627 175.003 -0.376 25139 8004 1 14 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.353 0.686 25139 8005 1 14 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.687 -0.359 25139 8006 1 14 . 1 1 125 125 GLN H H 125 8.390 8.390 8.567 -0.177 25139 8007 1 14 . 1 1 126 126 ASN N N 126 118.528 118.528 117.587 0.941 25139 8008 1 14 . 1 1 126 126 ASN C C 126 173.713 173.713 174.776 -1.063 25139 8009 1 14 . 1 1 126 126 ASN CA C 126 52.189 52.189 53.025 -0.836 25139 8010 1 14 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.678 1.123 25139 8011 1 14 . 1 1 126 126 ASN H H 126 8.092 8.092 7.953 0.139 25139 8012 1 14 . 1 1 127 127 PHE N N 127 124.680 124.680 122.713 1.967 25139 8013 1 14 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.739 0.298 25139 8014 1 14 . 1 1 127 127 PHE C C 127 177.125 177.125 176.554 0.571 25139 8015 1 14 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.180 1.233 25139 8016 1 14 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.084 1.160 25139 8017 1 14 . 1 1 127 127 PHE H H 127 9.026 9.026 8.865 0.161 25139 8018 1 14 . 1 1 128 128 VAL N N 128 119.455 119.455 118.981 0.474 25139 8019 1 14 . 1 1 128 128 VAL C C 128 175.886 175.886 175.483 0.403 25139 8020 1 14 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.590 -0.671 25139 8021 1 14 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.530 2.664 25139 8022 1 14 . 1 1 128 128 VAL H H 128 8.364 8.364 7.669 0.695 25139 8023 1 14 . 1 1 129 129 CYS N N 129 116.130 116.130 119.642 -3.512 25139 8024 1 14 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.764 -0.287 25139 8025 1 14 . 1 1 129 129 CYS C C 129 170.569 170.569 173.913 -3.344 25139 8026 1 14 . 1 1 129 129 CYS CA C 129 56.150 56.150 60.040 -3.890 25139 8027 1 14 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.624 18.993 25139 8028 1 14 . 1 1 129 129 CYS H H 129 5.390 5.390 7.050 -1.660 25139 8029 1 14 . 1 1 130 130 LYS N N 130 120.071 120.071 125.563 -5.492 25139 8030 1 14 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.174 0.387 25139 8031 1 14 . 1 1 130 130 LYS C C 130 176.853 176.853 174.444 2.409 25139 8032 1 14 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.069 -0.182 25139 8033 1 14 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.450 1.192 25139 8034 1 14 . 1 1 130 130 LYS H H 130 8.066 8.066 8.227 -0.161 25139 8035 1 14 . 1 1 131 131 PHE N N 131 118.415 118.415 119.731 -1.316 25139 8036 1 14 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.483 -0.876 25139 8037 1 14 . 1 1 131 131 PHE C C 131 174.013 174.013 175.254 -1.241 25139 8038 1 14 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.042 1.669 25139 8039 1 14 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.269 0.811 25139 8040 1 14 . 1 1 131 131 PHE H H 131 8.714 8.714 8.171 0.543 25139 8041 1 14 . 1 1 132 132 ALA N N 132 124.209 124.209 122.724 1.485 25139 8042 1 14 . 1 1 132 132 ALA HA H 132 4.617 4.617 4.982 -0.365 25139 8043 1 14 . 1 1 132 132 ALA C C 132 174.352 174.352 174.312 0.040 25139 8044 1 14 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.510 1.931 25139 8045 1 14 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.837 -0.373 25139 8046 1 14 . 1 1 132 132 ALA H H 132 9.295 9.295 9.167 0.128 25139 8047 1 14 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.381 -0.498 25139 8048 1 14 . 1 1 133 133 PRO C C 133 173.923 173.923 176.462 -2.539 25139 8049 1 14 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.653 0.418 25139 8050 1 14 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.465 -0.862 25139 8051 1 14 . 1 1 134 134 ARG N N 134 126.071 126.071 122.071 4.000 25139 8052 1 14 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.653 -0.398 25139 8053 1 14 . 1 1 134 134 ARG C C 134 177.065 177.065 176.111 0.954 25139 8054 1 14 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.664 1.500 25139 8055 1 14 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.875 -1.692 25139 8056 1 14 . 1 1 134 134 ARG H H 134 8.672 8.672 8.617 0.055 25139 8057 1 14 . 1 1 135 135 GLU N N 135 125.683 125.683 121.856 3.827 25139 8058 1 14 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.422 -0.069 25139 8059 1 14 . 1 1 135 135 GLU C C 135 178.081 178.081 177.559 0.522 25139 8060 1 14 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.153 0.498 25139 8061 1 14 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.659 0.337 25139 8062 1 14 . 1 1 135 135 GLU H H 135 8.603 8.603 8.853 -0.250 25139 8063 1 14 . 1 1 136 136 GLY N N 136 110.031 110.031 107.325 2.706 25139 8064 1 14 . 1 1 136 136 GLY C C 136 173.079 173.079 172.704 0.375 25139 8065 1 14 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.767 1.011 25139 8066 1 14 . 1 1 136 136 GLY H H 136 9.036 9.036 8.327 0.709 25139 8067 1 14 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.659 0.016 25139 8068 1 14 . 1 1 137 137 PHE C C 137 174.936 174.936 174.196 0.740 25139 8069 1 14 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.173 -0.089 25139 8070 1 14 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.897 1.799 25139 8071 1 14 . 1 1 138 138 ILE N N 138 117.417 117.417 114.665 2.752 25139 8072 1 14 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.667 -0.160 25139 8073 1 14 . 1 1 138 138 ILE C C 138 173.858 173.858 173.306 0.552 25139 8074 1 14 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.552 1.068 25139 8075 1 14 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.251 1.346 25139 8076 1 14 . 1 1 138 138 ILE H H 138 8.777 8.777 8.681 0.096 25139 8077 1 14 . 1 1 139 139 ASN N N 139 117.201 117.201 116.696 0.505 25139 8078 1 14 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.546 0.513 25139 8079 1 14 . 1 1 139 139 ASN C C 139 173.721 173.721 174.036 -0.315 25139 8080 1 14 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.613 -1.383 25139 8081 1 14 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.514 1.347 25139 8082 1 14 . 1 1 139 139 ASN H H 139 8.872 8.872 8.348 0.524 25139 8083 1 14 . 1 1 140 140 TYR N N 140 123.991 123.991 119.101 4.890 25139 8084 1 14 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.799 0.379 25139 8085 1 14 . 1 1 140 140 TYR C C 140 174.791 174.791 175.107 -0.316 25139 8086 1 14 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.074 -1.002 25139 8087 1 14 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.954 1.716 25139 8088 1 14 . 1 1 140 140 TYR H H 140 9.526 9.526 8.881 0.645 25139 8089 1 14 . 1 1 141 141 LEU N N 141 122.779 122.779 121.074 1.705 25139 8090 1 14 . 1 1 141 141 LEU C C 141 175.404 175.404 177.448 -2.044 25139 8091 1 14 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.820 2.283 25139 8092 1 14 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.288 -1.127 25139 8093 1 14 . 1 1 141 141 LEU H H 141 9.010 9.010 8.958 0.052 25139 8094 1 14 . 1 1 142 142 THR N N 142 113.189 113.189 112.903 0.286 25139 8095 1 14 . 1 1 142 142 THR HA H 142 4.061 4.061 4.449 -0.388 25139 8096 1 14 . 1 1 142 142 THR C C 142 175.940 175.940 176.428 -0.488 25139 8097 1 14 . 1 1 142 142 THR CA C 142 61.389 61.389 60.640 0.749 25139 8098 1 14 . 1 1 142 142 THR CB C 142 69.779 69.779 70.514 -0.735 25139 8099 1 14 . 1 1 142 142 THR H H 142 7.737 7.737 8.064 -0.327 25139 8100 1 14 . 1 1 143 143 ARG N N 143 120.975 120.975 120.308 0.667 25139 8101 1 14 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.926 0.012 25139 8102 1 14 . 1 1 143 143 ARG C C 143 178.690 178.690 178.253 0.437 25139 8103 1 14 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.817 -0.069 25139 8104 1 14 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.622 0.523 25139 8105 1 14 . 1 1 143 143 ARG H H 143 8.149 8.149 8.120 0.029 25139 8106 1 14 . 1 1 144 144 GLU N N 144 116.997 116.997 118.753 -1.756 25139 8107 1 14 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.221 -0.112 25139 8108 1 14 . 1 1 144 144 GLU C C 144 178.442 178.442 177.726 0.716 25139 8109 1 14 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.578 1.285 25139 8110 1 14 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.546 0.037 25139 8111 1 14 . 1 1 144 144 GLU H H 144 8.622 8.622 7.861 0.761 25139 8112 1 14 . 1 1 145 145 VAL N N 145 111.213 111.213 116.064 -4.851 25139 8113 1 14 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.010 0.401 25139 8114 1 14 . 1 1 145 145 VAL C C 145 176.965 176.965 177.111 -0.146 25139 8115 1 14 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.612 -1.018 25139 8116 1 14 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.282 -0.200 25139 8117 1 14 . 1 1 145 145 VAL H H 145 7.227 7.227 7.520 -0.293 25139 8118 1 14 . 1 1 146 146 TYR N N 146 123.512 123.512 122.541 0.971 25139 8119 1 14 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.101 -0.221 25139 8120 1 14 . 1 1 146 146 TYR C C 146 176.377 176.377 176.567 -0.190 25139 8121 1 14 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.764 -0.227 25139 8122 1 14 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.818 -0.479 25139 8123 1 14 . 1 1 146 146 TYR H H 146 8.492 8.492 8.907 -0.415 25139 8124 1 14 . 1 1 147 147 ARG N N 147 116.680 116.680 116.721 -0.041 25139 8125 1 14 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.999 -0.185 25139 8126 1 14 . 1 1 147 147 ARG C C 147 178.858 178.858 177.563 1.295 25139 8127 1 14 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.799 0.897 25139 8128 1 14 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.416 0.249 25139 8129 1 14 . 1 1 147 147 ARG H H 147 8.053 8.053 7.857 0.196 25139 8130 1 14 . 1 1 148 148 SER N N 148 115.306 115.306 113.583 1.723 25139 8131 1 14 . 1 1 148 148 SER HA H 148 3.998 3.998 4.275 -0.277 25139 8132 1 14 . 1 1 148 148 SER C C 148 175.786 175.786 175.531 0.255 25139 8133 1 14 . 1 1 148 148 SER CA C 148 62.006 62.006 59.310 2.696 25139 8134 1 14 . 1 1 148 148 SER H H 148 7.139 7.139 7.416 -0.277 25139 8135 1 14 . 1 1 149 149 TYR N N 149 123.207 123.207 122.865 0.342 25139 8136 1 14 . 1 1 149 149 TYR C C 149 175.831 175.831 177.963 -2.132 25139 8137 1 14 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.476 -0.876 25139 8138 1 14 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.498 0.283 25139 8139 1 14 . 1 1 149 149 TYR H H 149 7.253 7.253 7.877 -0.624 25139 8140 1 14 . 1 1 150 150 ARG N N 150 118.708 118.708 117.189 1.519 25139 8141 1 14 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.931 -0.585 25139 8142 1 14 . 1 1 150 150 ARG C C 150 177.644 177.644 177.972 -0.328 25139 8143 1 14 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.621 -0.298 25139 8144 1 14 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.091 -0.237 25139 8145 1 14 . 1 1 150 150 ARG H H 150 8.441 8.441 7.798 0.643 25139 8146 1 14 . 1 1 151 151 GLN N N 151 116.551 116.551 117.069 -0.518 25139 8147 1 14 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.178 -0.221 25139 8148 1 14 . 1 1 151 151 GLN C C 151 177.987 177.987 177.333 0.654 25139 8149 1 14 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.717 0.624 25139 8150 1 14 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.337 0.128 25139 8151 1 14 . 1 1 151 151 GLN H H 151 7.332 7.332 7.607 -0.275 25139 8152 1 14 . 1 1 152 152 LEU N N 152 118.877 118.877 112.631 6.246 25139 8153 1 14 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.616 -0.437 25139 8154 1 14 . 1 1 152 152 LEU C C 152 179.070 179.070 176.820 2.250 25139 8155 1 14 . 1 1 152 152 LEU CA C 152 57.082 57.082 54.913 2.168 25139 8156 1 14 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.451 -0.763 25139 8157 1 14 . 1 1 152 152 LEU H H 152 7.106 7.106 7.230 -0.124 25139 8158 1 14 . 1 1 153 153 VAL N N 153 119.076 119.076 112.036 7.040 25139 8159 1 14 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.120 -1.260 25139 8160 1 14 . 1 1 153 153 VAL C C 153 177.421 177.421 176.746 0.675 25139 8161 1 14 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.663 1.919 25139 8162 1 14 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.328 -1.810 25139 8163 1 14 . 1 1 153 153 VAL H H 153 7.427 7.427 7.091 0.336 25139 8164 1 14 . 1 1 154 154 ASP N N 154 119.888 119.888 120.445 -0.557 25139 8165 1 14 . 1 1 154 154 ASP C C 154 177.422 177.422 175.724 1.698 25139 8166 1 14 . 1 1 154 154 ASP CA C 154 56.071 56.071 55.932 0.139 25139 8167 1 14 . 1 1 154 154 ASP CB C 154 40.349 40.349 40.758 -0.409 25139 8168 1 14 . 1 1 154 154 ASP H H 154 7.930 7.930 7.836 0.094 25139 8169 1 14 . 1 1 155 155 HIS N N 155 117.821 117.821 117.031 0.790 25139 8170 1 14 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.170 2.586 25139 8171 1 14 . 1 1 155 155 HIS CB C 155 30.180 30.180 32.096 -1.916 25139 8172 1 14 . 1 1 155 155 HIS H H 155 7.680 7.680 7.797 -0.117 25139 8173 1 14 . 1 1 156 156 HIS N N 156 119.180 119.180 122.379 -3.199 25139 8174 1 14 . 1 1 156 156 HIS CA C 156 57.931 57.931 55.795 2.136 25139 8175 1 14 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.765 -0.465 25139 8176 1 14 . 1 1 156 156 HIS H H 156 7.868 7.868 8.146 -0.278 25139 8177 1 15 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.526 0.378 25139 8178 1 15 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.043 0.179 25139 8179 1 15 . 1 1 49 49 ASP N N 49 119.661 119.661 118.883 0.778 25139 8180 1 15 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.735 -0.458 25139 8181 1 15 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.593 -0.531 25139 8182 1 15 . 1 1 49 49 ASP H H 49 8.462 8.462 7.978 0.484 25139 8183 1 15 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.151 -0.099 25139 8184 1 15 . 1 1 51 51 LEU C C 51 178.514 178.514 177.287 1.227 25139 8185 1 15 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.021 1.028 25139 8186 1 15 . 1 1 51 51 LEU CB C 51 41.193 41.193 42.006 -0.813 25139 8187 1 15 . 1 1 52 52 ASN N N 52 113.819 113.819 115.239 -1.420 25139 8188 1 15 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.749 0.086 25139 8189 1 15 . 1 1 52 52 ASN C C 52 175.964 175.964 175.578 0.386 25139 8190 1 15 . 1 1 52 52 ASN CA C 52 54.096 54.096 53.868 0.228 25139 8191 1 15 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.334 0.548 25139 8192 1 15 . 1 1 52 52 ASN H H 52 7.853 7.853 7.867 -0.014 25139 8193 1 15 . 1 1 53 53 SER N N 53 114.357 114.357 114.365 -0.008 25139 8194 1 15 . 1 1 53 53 SER CA C 53 59.908 59.908 58.742 1.166 25139 8195 1 15 . 1 1 53 53 SER CB C 53 64.395 64.395 64.299 0.096 25139 8196 1 15 . 1 1 53 53 SER H H 53 8.023 8.023 8.007 0.016 25139 8197 1 15 . 1 1 54 54 PHE N N 54 121.037 121.037 120.910 0.127 25139 8198 1 15 . 1 1 54 54 PHE C C 54 175.522 175.522 175.412 0.110 25139 8199 1 15 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.375 0.689 25139 8200 1 15 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.003 0.050 25139 8201 1 15 . 1 1 54 54 PHE H H 54 7.731 7.731 7.561 0.170 25139 8202 1 15 . 1 1 55 55 THR N N 55 116.535 116.535 117.386 -0.851 25139 8203 1 15 . 1 1 55 55 THR HA H 55 4.654 4.654 4.703 -0.049 25139 8204 1 15 . 1 1 55 55 THR C C 55 173.301 173.301 172.998 0.303 25139 8205 1 15 . 1 1 55 55 THR CA C 55 61.420 61.420 60.840 0.580 25139 8206 1 15 . 1 1 55 55 THR CB C 55 71.388 71.388 71.432 -0.044 25139 8207 1 15 . 1 1 55 55 THR H H 55 8.929 8.929 8.982 -0.053 25139 8208 1 15 . 1 1 56 56 ALA N N 56 129.359 129.359 128.356 1.003 25139 8209 1 15 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.106 0.209 25139 8210 1 15 . 1 1 56 56 ALA C C 56 178.305 178.305 177.964 0.341 25139 8211 1 15 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.775 1.096 25139 8212 1 15 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.157 0.167 25139 8213 1 15 . 1 1 56 56 ALA H H 56 8.907 8.907 8.720 0.187 25139 8214 1 15 . 1 1 57 57 GLY N N 57 106.331 106.331 109.459 -3.128 25139 8215 1 15 . 1 1 57 57 GLY CA C 57 44.611 44.611 44.715 -0.104 25139 8216 1 15 . 1 1 57 57 GLY H H 57 7.978 7.978 8.501 -0.523 25139 8217 1 15 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.337 -0.013 25139 8218 1 15 . 1 1 59 59 PRO C C 59 177.466 177.466 177.854 -0.388 25139 8219 1 15 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.229 1.255 25139 8220 1 15 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.094 -0.359 25139 8221 1 15 . 1 1 60 60 GLY N N 60 109.688 109.688 109.159 0.529 25139 8222 1 15 . 1 1 60 60 GLY C C 60 173.555 173.555 173.191 0.364 25139 8223 1 15 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.875 0.666 25139 8224 1 15 . 1 1 60 60 GLY H H 60 8.402 8.402 8.779 -0.377 25139 8225 1 15 . 1 1 61 61 PHE N N 61 122.491 122.491 122.248 0.243 25139 8226 1 15 . 1 1 61 61 PHE C C 61 175.146 175.146 175.050 0.096 25139 8227 1 15 . 1 1 61 61 PHE CA C 61 58.282 58.282 57.072 1.210 25139 8228 1 15 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.116 -2.417 25139 8229 1 15 . 1 1 61 61 PHE H H 61 7.957 7.957 7.469 0.488 25139 8230 1 15 . 1 1 62 62 VAL N N 62 121.128 121.128 118.549 2.579 25139 8231 1 15 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.465 -0.380 25139 8232 1 15 . 1 1 62 62 VAL C C 62 174.937 174.937 174.791 0.146 25139 8233 1 15 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.483 0.225 25139 8234 1 15 . 1 1 62 62 VAL CB C 62 36.432 36.432 36.072 0.360 25139 8235 1 15 . 1 1 62 62 VAL H H 62 7.994 7.994 9.238 -1.244 25139 8236 1 15 . 1 1 63 63 LEU N N 63 124.386 124.386 122.653 1.733 25139 8237 1 15 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.969 -1.653 25139 8238 1 15 . 1 1 63 63 LEU C C 63 175.278 175.278 176.317 -1.039 25139 8239 1 15 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.681 0.607 25139 8240 1 15 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.338 1.780 25139 8241 1 15 . 1 1 63 63 LEU H H 63 7.572 7.572 9.054 -1.482 25139 8242 1 15 . 1 1 64 64 ASP N N 64 126.746 126.746 127.388 -0.642 25139 8243 1 15 . 1 1 64 64 ASP C C 64 177.801 177.801 175.983 1.818 25139 8244 1 15 . 1 1 64 64 ASP CA C 64 51.721 51.721 52.708 -0.987 25139 8245 1 15 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.613 -1.215 25139 8246 1 15 . 1 1 64 64 ASP H H 64 8.552 8.552 8.418 0.134 25139 8247 1 15 . 1 1 65 65 THR C C 65 175.002 175.002 175.809 -0.807 25139 8248 1 15 . 1 1 65 65 THR CB C 65 67.919 67.919 68.974 -1.055 25139 8249 1 15 . 1 1 66 66 GLN N N 66 120.804 120.804 119.129 1.675 25139 8250 1 15 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.167 -0.290 25139 8251 1 15 . 1 1 66 66 GLN C C 66 178.901 178.901 176.621 2.280 25139 8252 1 15 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.009 1.407 25139 8253 1 15 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.893 0.031 25139 8254 1 15 . 1 1 66 66 GLN H H 66 8.447 8.447 8.301 0.146 25139 8255 1 15 . 1 1 67 67 ALA N N 67 121.267 121.267 121.714 -0.447 25139 8256 1 15 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.284 -0.327 25139 8257 1 15 . 1 1 67 67 ALA C C 67 176.777 176.777 178.708 -1.931 25139 8258 1 15 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.697 0.627 25139 8259 1 15 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.881 -0.261 25139 8260 1 15 . 1 1 67 67 ALA H H 67 7.791 7.791 7.541 0.250 25139 8261 1 15 . 1 1 68 68 SER N N 68 113.339 113.339 113.661 -0.322 25139 8262 1 15 . 1 1 68 68 SER HA H 68 4.061 4.061 4.248 -0.187 25139 8263 1 15 . 1 1 68 68 SER C C 68 175.875 175.875 176.547 -0.672 25139 8264 1 15 . 1 1 68 68 SER CA C 68 62.970 62.970 60.457 2.513 25139 8265 1 15 . 1 1 68 68 SER CB C 68 61.330 61.330 63.831 -2.501 25139 8266 1 15 . 1 1 68 68 SER H H 68 7.785 7.785 7.651 0.134 25139 8267 1 15 . 1 1 69 69 VAL N N 69 125.140 125.140 116.470 8.670 25139 8268 1 15 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.140 -0.064 25139 8269 1 15 . 1 1 69 69 VAL C C 69 176.384 176.384 176.758 -0.374 25139 8270 1 15 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.730 1.001 25139 8271 1 15 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.613 -0.124 25139 8272 1 15 . 1 1 69 69 VAL H H 69 8.572 8.572 8.023 0.549 25139 8273 1 15 . 1 1 70 70 SER N N 70 116.704 116.704 113.336 3.368 25139 8274 1 15 . 1 1 70 70 SER HA H 70 4.229 4.229 4.224 0.005 25139 8275 1 15 . 1 1 70 70 SER C C 70 174.101 174.101 175.221 -1.120 25139 8276 1 15 . 1 1 70 70 SER CA C 70 61.627 61.627 59.230 2.397 25139 8277 1 15 . 1 1 70 70 SER H H 70 7.951 7.951 7.990 -0.039 25139 8278 1 15 . 1 1 71 71 ASN N N 71 117.576 117.576 117.018 0.558 25139 8279 1 15 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.665 0.137 25139 8280 1 15 . 1 1 71 71 ASN C C 71 174.332 174.332 174.812 -0.480 25139 8281 1 15 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.859 -0.420 25139 8282 1 15 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.809 0.658 25139 8283 1 15 . 1 1 71 71 ASN H H 71 7.131 7.131 7.535 -0.404 25139 8284 1 15 . 1 1 72 72 GLY N N 72 103.925 103.925 105.461 -1.536 25139 8285 1 15 . 1 1 72 72 GLY C C 72 174.710 174.710 173.479 1.231 25139 8286 1 15 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.445 0.104 25139 8287 1 15 . 1 1 72 72 GLY H H 72 7.338 7.338 7.392 -0.054 25139 8288 1 15 . 1 1 73 73 ALA N N 73 124.942 124.942 123.163 1.779 25139 8289 1 15 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.558 -0.386 25139 8290 1 15 . 1 1 73 73 ALA C C 73 175.896 175.896 176.319 -0.423 25139 8291 1 15 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.843 0.830 25139 8292 1 15 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.142 -0.086 25139 8293 1 15 . 1 1 73 73 ALA H H 73 8.032 8.032 7.782 0.250 25139 8294 1 15 . 1 1 74 74 THR N N 74 113.423 113.423 116.059 -2.636 25139 8295 1 15 . 1 1 74 74 THR HA H 74 4.678 4.678 4.562 0.116 25139 8296 1 15 . 1 1 74 74 THR C C 74 173.339 173.339 173.243 0.096 25139 8297 1 15 . 1 1 74 74 THR CA C 74 61.545 61.545 60.639 0.906 25139 8298 1 15 . 1 1 74 74 THR CB C 74 71.319 71.319 71.707 -0.388 25139 8299 1 15 . 1 1 74 74 THR H H 74 8.530 8.530 8.237 0.293 25139 8300 1 15 . 1 1 75 75 PHE N N 75 128.180 128.180 129.371 -1.191 25139 8301 1 15 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.876 -0.272 25139 8302 1 15 . 1 1 75 75 PHE C C 75 174.623 174.623 174.914 -0.291 25139 8303 1 15 . 1 1 75 75 PHE CA C 75 57.616 57.616 58.153 -0.537 25139 8304 1 15 . 1 1 75 75 PHE CB C 75 38.675 38.675 39.101 -0.426 25139 8305 1 15 . 1 1 75 75 PHE H H 75 9.146 9.146 9.105 0.041 25139 8306 1 15 . 1 1 76 76 LEU N N 76 127.849 127.849 125.651 2.198 25139 8307 1 15 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.508 -0.157 25139 8308 1 15 . 1 1 76 76 LEU C C 76 176.339 176.339 176.272 0.067 25139 8309 1 15 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.204 0.779 25139 8310 1 15 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.462 -0.132 25139 8311 1 15 . 1 1 76 76 LEU H H 76 8.635 8.635 8.011 0.624 25139 8312 1 15 . 1 1 77 77 GLU N N 77 115.131 115.131 119.683 -4.552 25139 8313 1 15 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.419 -0.011 25139 8314 1 15 . 1 1 77 77 GLU C C 77 174.734 174.734 174.469 0.265 25139 8315 1 15 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.197 1.155 25139 8316 1 15 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.891 0.316 25139 8317 1 15 . 1 1 77 77 GLU H H 77 7.252 7.252 7.379 -0.127 25139 8318 1 15 . 1 1 78 78 SER N N 78 118.016 118.016 117.932 0.084 25139 8319 1 15 . 1 1 78 78 SER HA H 78 5.561 5.561 5.312 0.249 25139 8320 1 15 . 1 1 78 78 SER C C 78 171.968 171.968 172.732 -0.764 25139 8321 1 15 . 1 1 78 78 SER CA C 78 54.061 54.061 55.238 -1.177 25139 8322 1 15 . 1 1 78 78 SER CB C 78 64.074 64.074 63.601 0.473 25139 8323 1 15 . 1 1 78 78 SER H H 78 9.033 9.033 8.510 0.523 25139 8324 1 15 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.640 -0.040 25139 8325 1 15 . 1 1 79 79 PRO CB C 79 32.410 32.410 33.556 -1.146 25139 8326 1 15 . 1 1 80 80 THR N N 80 118.079 118.079 114.537 3.542 25139 8327 1 15 . 1 1 80 80 THR HA H 80 4.342 4.342 4.305 0.037 25139 8328 1 15 . 1 1 80 80 THR C C 80 174.494 174.494 174.712 -0.218 25139 8329 1 15 . 1 1 80 80 THR CA C 80 61.453 61.453 60.128 1.325 25139 8330 1 15 . 1 1 80 80 THR CB C 80 67.797 67.797 68.775 -0.978 25139 8331 1 15 . 1 1 80 80 THR H H 80 8.670 8.670 8.186 0.484 25139 8332 1 15 . 1 1 81 81 VAL N N 81 117.395 117.395 118.739 -1.344 25139 8333 1 15 . 1 1 81 81 VAL HA H 81 4.607 4.607 4.053 0.554 25139 8334 1 15 . 1 1 81 81 VAL C C 81 175.518 175.518 176.178 -0.660 25139 8335 1 15 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.996 -2.882 25139 8336 1 15 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.176 2.419 25139 8337 1 15 . 1 1 81 81 VAL H H 81 7.448 7.448 7.479 -0.031 25139 8338 1 15 . 1 1 82 82 ARG N N 82 117.852 117.852 119.456 -1.604 25139 8339 1 15 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.596 -0.075 25139 8340 1 15 . 1 1 82 82 ARG C C 82 176.992 176.992 176.311 0.681 25139 8341 1 15 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.653 0.732 25139 8342 1 15 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.398 1.204 25139 8343 1 15 . 1 1 82 82 ARG H H 82 8.710 8.710 8.644 0.066 25139 8344 1 15 . 1 1 83 83 ARG N N 83 117.035 117.035 117.641 -0.606 25139 8345 1 15 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.597 0.725 25139 8346 1 15 . 1 1 83 83 ARG C C 83 177.379 177.379 176.672 0.707 25139 8347 1 15 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.651 -0.967 25139 8348 1 15 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.938 -0.897 25139 8349 1 15 . 1 1 83 83 ARG H H 83 7.292 7.292 7.673 -0.381 25139 8350 1 15 . 1 1 84 84 GLY N N 84 114.911 114.911 109.989 4.922 25139 8351 1 15 . 1 1 84 84 GLY C C 84 176.940 176.940 175.107 1.833 25139 8352 1 15 . 1 1 84 84 GLY CA C 84 48.672 48.672 47.077 1.595 25139 8353 1 15 . 1 1 84 84 GLY H H 84 9.255 9.255 9.053 0.202 25139 8354 1 15 . 1 1 85 85 TRP N N 85 121.810 121.810 120.142 1.668 25139 8355 1 15 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.069 0.098 25139 8356 1 15 . 1 1 85 85 TRP C C 85 178.272 178.272 177.295 0.977 25139 8357 1 15 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.014 1.031 25139 8358 1 15 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.090 0.127 25139 8359 1 15 . 1 1 85 85 TRP H H 85 9.963 9.963 7.993 1.970 25139 8360 1 15 . 1 1 86 86 ASP N N 86 116.400 116.400 119.750 -3.350 25139 8361 1 15 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.489 -0.096 25139 8362 1 15 . 1 1 86 86 ASP C C 86 178.803 178.803 177.957 0.846 25139 8363 1 15 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.680 0.374 25139 8364 1 15 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.325 0.408 25139 8365 1 15 . 1 1 86 86 ASP H H 86 6.934 6.934 7.615 -0.681 25139 8366 1 15 . 1 1 87 87 CYS N N 87 122.454 122.454 119.415 3.039 25139 8367 1 15 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.247 0.003 25139 8368 1 15 . 1 1 87 87 CYS C C 87 174.956 174.956 176.639 -1.683 25139 8369 1 15 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.834 -3.687 25139 8370 1 15 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.343 11.142 25139 8371 1 15 . 1 1 87 87 CYS H H 87 7.603 7.603 7.537 0.066 25139 8372 1 15 . 1 1 88 88 VAL N N 88 119.192 119.192 121.099 -1.907 25139 8373 1 15 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.393 -0.935 25139 8374 1 15 . 1 1 88 88 VAL C C 88 177.413 177.413 176.772 0.641 25139 8375 1 15 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.485 1.491 25139 8376 1 15 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.064 -0.821 25139 8377 1 15 . 1 1 88 88 VAL H H 88 7.192 7.192 7.287 -0.095 25139 8378 1 15 . 1 1 89 89 ARG N N 89 118.185 118.185 118.524 -0.339 25139 8379 1 15 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.833 -0.153 25139 8380 1 15 . 1 1 89 89 ARG C C 89 178.677 178.677 177.823 0.854 25139 8381 1 15 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.020 0.935 25139 8382 1 15 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.204 0.587 25139 8383 1 15 . 1 1 89 89 ARG H H 89 7.971 7.971 7.432 0.539 25139 8384 1 15 . 1 1 90 90 ALA N N 90 120.815 120.815 121.308 -0.493 25139 8385 1 15 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.177 -0.102 25139 8386 1 15 . 1 1 90 90 ALA C C 90 177.416 177.416 178.562 -1.146 25139 8387 1 15 . 1 1 90 90 ALA CA C 90 54.254 54.254 53.901 0.353 25139 8388 1 15 . 1 1 90 90 ALA CB C 90 17.436 17.436 17.918 -0.481 25139 8389 1 15 . 1 1 90 90 ALA H H 90 7.453 7.453 7.832 -0.379 25139 8390 1 15 . 1 1 91 91 CYS N N 91 120.380 120.380 116.149 4.231 25139 8391 1 15 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.238 0.133 25139 8392 1 15 . 1 1 91 91 CYS C C 91 176.654 176.654 175.780 0.874 25139 8393 1 15 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.410 -3.715 25139 8394 1 15 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.099 12.605 25139 8395 1 15 . 1 1 91 91 CYS H H 91 7.944 7.944 7.502 0.442 25139 8396 1 15 . 1 1 92 92 CYS N N 92 116.270 116.270 117.778 -1.508 25139 8397 1 15 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.496 -0.092 25139 8398 1 15 . 1 1 92 92 CYS C C 92 175.628 175.628 176.359 -0.731 25139 8399 1 15 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.634 -1.928 25139 8400 1 15 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.162 14.987 25139 8401 1 15 . 1 1 92 92 CYS H H 92 8.315 8.315 7.734 0.582 25139 8402 1 15 . 1 1 93 93 THR N N 93 107.283 107.283 111.967 -4.684 25139 8403 1 15 . 1 1 93 93 THR HA H 93 4.481 4.481 4.316 0.165 25139 8404 1 15 . 1 1 93 93 THR C C 93 173.606 173.606 175.386 -1.780 25139 8405 1 15 . 1 1 93 93 THR CA C 93 61.402 61.402 63.997 -2.595 25139 8406 1 15 . 1 1 93 93 THR CB C 93 69.046 69.046 69.192 -0.146 25139 8407 1 15 . 1 1 93 93 THR H H 93 7.445 7.445 7.586 -0.141 25139 8408 1 15 . 1 1 94 94 THR N N 94 121.432 121.432 121.669 -0.237 25139 8409 1 15 . 1 1 94 94 THR HA H 94 4.398 4.398 4.426 -0.028 25139 8410 1 15 . 1 1 94 94 THR C C 94 173.493 173.493 174.871 -1.378 25139 8411 1 15 . 1 1 94 94 THR CA C 94 62.726 62.726 63.169 -0.443 25139 8412 1 15 . 1 1 94 94 THR CB C 94 69.704 69.704 68.637 1.067 25139 8413 1 15 . 1 1 94 94 THR H H 94 7.553 7.553 8.028 -0.475 25139 8414 1 15 . 1 1 95 95 GLN N N 95 129.410 129.410 127.015 2.395 25139 8415 1 15 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.996 -0.052 25139 8416 1 15 . 1 1 95 95 GLN C C 95 176.293 176.293 175.458 0.835 25139 8417 1 15 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.710 -0.670 25139 8418 1 15 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.674 -0.418 25139 8419 1 15 . 1 1 95 95 GLN H H 95 8.812 8.812 8.585 0.227 25139 8420 1 15 . 1 1 96 96 ASN N N 96 115.015 115.015 115.107 -0.092 25139 8421 1 15 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.849 -0.650 25139 8422 1 15 . 1 1 96 96 ASN C C 96 172.260 172.260 174.212 -1.952 25139 8423 1 15 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.733 2.834 25139 8424 1 15 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.262 -1.425 25139 8425 1 15 . 1 1 96 96 ASN H H 96 8.791 8.791 8.122 0.669 25139 8426 1 15 . 1 1 97 97 CYS N N 97 115.830 115.830 120.533 -4.703 25139 8427 1 15 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.427 -0.326 25139 8428 1 15 . 1 1 97 97 CYS C C 97 175.025 175.025 173.532 1.493 25139 8429 1 15 . 1 1 97 97 CYS CA C 97 58.148 58.148 60.009 -1.861 25139 8430 1 15 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.128 16.106 25139 8431 1 15 . 1 1 97 97 CYS H H 97 7.651 7.651 7.807 -0.156 25139 8432 1 15 . 1 1 98 98 ASN N N 98 125.148 125.148 124.675 0.473 25139 8433 1 15 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.102 0.031 25139 8434 1 15 . 1 1 98 98 ASN C C 98 171.892 171.892 174.282 -2.390 25139 8435 1 15 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.321 -0.127 25139 8436 1 15 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.243 -1.295 25139 8437 1 15 . 1 1 98 98 ASN H H 98 8.736 8.736 8.413 0.323 25139 8438 1 15 . 1 1 99 99 LEU N N 99 120.898 120.898 121.313 -0.415 25139 8439 1 15 . 1 1 99 99 LEU C C 99 173.084 173.084 174.110 -1.026 25139 8440 1 15 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.927 2.193 25139 8441 1 15 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.211 -0.883 25139 8442 1 15 . 1 1 99 99 LEU H H 99 8.200 8.200 8.150 0.050 25139 8443 1 15 . 1 1 100 100 ALA N N 100 128.085 128.085 130.373 -2.288 25139 8444 1 15 . 1 1 100 100 ALA C C 100 174.938 174.938 175.395 -0.457 25139 8445 1 15 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.614 -0.867 25139 8446 1 15 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.191 0.523 25139 8447 1 15 . 1 1 100 100 ALA H H 100 9.156 9.156 9.255 -0.099 25139 8448 1 15 . 1 1 101 101 LEU N N 101 128.723 128.723 127.684 1.039 25139 8449 1 15 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.381 -0.239 25139 8450 1 15 . 1 1 101 101 LEU C C 101 174.379 174.379 175.354 -0.975 25139 8451 1 15 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.700 -0.847 25139 8452 1 15 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.852 0.455 25139 8453 1 15 . 1 1 101 101 LEU H H 101 9.578 9.578 8.622 0.956 25139 8454 1 15 . 1 1 102 102 VAL N N 102 119.417 119.417 120.404 -0.987 25139 8455 1 15 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.283 0.245 25139 8456 1 15 . 1 1 102 102 VAL C C 102 173.660 173.660 174.095 -0.435 25139 8457 1 15 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.014 -0.395 25139 8458 1 15 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.101 -1.828 25139 8459 1 15 . 1 1 102 102 VAL H H 102 9.297 9.297 9.394 -0.097 25139 8460 1 15 . 1 1 103 103 GLU N N 103 124.427 124.427 123.827 0.600 25139 8461 1 15 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.372 -0.507 25139 8462 1 15 . 1 1 103 103 GLU C C 103 176.319 176.319 175.357 0.962 25139 8463 1 15 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.370 -0.269 25139 8464 1 15 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.869 0.332 25139 8465 1 15 . 1 1 103 103 GLU H H 103 7.749 7.749 8.305 -0.556 25139 8466 1 15 . 1 1 104 104 LEU N N 104 127.294 127.294 125.763 1.531 25139 8467 1 15 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.463 -0.143 25139 8468 1 15 . 1 1 104 104 LEU C C 104 176.593 176.593 177.685 -1.092 25139 8469 1 15 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.257 2.827 25139 8470 1 15 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.719 -0.328 25139 8471 1 15 . 1 1 104 104 LEU H H 104 8.323 8.323 8.127 0.196 25139 8472 1 15 . 1 1 105 105 GLN N N 105 121.361 121.361 115.875 5.486 25139 8473 1 15 . 1 1 105 105 GLN C C 105 172.868 172.868 174.669 -1.801 25139 8474 1 15 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.622 -3.216 25139 8475 1 15 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.947 2.782 25139 8476 1 15 . 1 1 105 105 GLN H H 105 8.095 8.095 8.268 -0.173 25139 8477 1 15 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.455 -0.046 25139 8478 1 15 . 1 1 106 106 PRO C C 106 177.770 177.770 176.792 0.978 25139 8479 1 15 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.508 -0.023 25139 8480 1 15 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.125 -0.357 25139 8481 1 15 . 1 1 107 107 ASP N N 107 116.484 116.484 116.520 -0.036 25139 8482 1 15 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.571 -0.131 25139 8483 1 15 . 1 1 107 107 ASP C C 107 176.749 176.749 175.862 0.887 25139 8484 1 15 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.340 0.115 25139 8485 1 15 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.162 -1.274 25139 8486 1 15 . 1 1 107 107 ASP H H 107 8.638 8.638 8.460 0.178 25139 8487 1 15 . 1 1 108 108 ARG N N 108 117.895 117.895 120.674 -2.779 25139 8488 1 15 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.702 -0.212 25139 8489 1 15 . 1 1 108 108 ARG C C 108 176.111 176.111 176.912 -0.801 25139 8490 1 15 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.317 -0.052 25139 8491 1 15 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.042 0.034 25139 8492 1 15 . 1 1 108 108 ARG H H 108 7.905 7.905 8.347 -0.442 25139 8493 1 15 . 1 1 109 109 GLY N N 109 108.307 108.307 109.655 -1.348 25139 8494 1 15 . 1 1 109 109 GLY C C 109 173.949 173.949 175.506 -1.557 25139 8495 1 15 . 1 1 109 109 GLY CA C 109 44.551 44.551 46.497 -1.946 25139 8496 1 15 . 1 1 109 109 GLY H H 109 7.753 7.753 8.318 -0.565 25139 8497 1 15 . 1 1 110 110 GLU N N 110 120.035 120.035 122.786 -2.751 25139 8498 1 15 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.616 -0.525 25139 8499 1 15 . 1 1 110 110 GLU C C 110 177.045 177.045 177.384 -0.339 25139 8500 1 15 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.751 1.531 25139 8501 1 15 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.849 -1.176 25139 8502 1 15 . 1 1 110 110 GLU H H 110 8.509 8.509 8.013 0.496 25139 8503 1 15 . 1 1 111 111 ASP N N 111 121.160 121.160 119.993 1.167 25139 8504 1 15 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.492 0.078 25139 8505 1 15 . 1 1 111 111 ASP C C 111 175.089 175.089 175.476 -0.387 25139 8506 1 15 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.913 -1.321 25139 8507 1 15 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.295 1.137 25139 8508 1 15 . 1 1 111 111 ASP H H 111 8.916 8.916 8.060 0.856 25139 8509 1 15 . 1 1 112 112 ALA N N 112 122.130 122.130 118.261 3.869 25139 8510 1 15 . 1 1 112 112 ALA C C 112 178.120 178.120 175.397 2.723 25139 8511 1 15 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.294 2.965 25139 8512 1 15 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.884 -2.114 25139 8513 1 15 . 1 1 112 112 ALA H H 112 7.361 7.361 7.292 0.070 25139 8514 1 15 . 1 1 113 113 ILE N N 113 113.780 113.780 113.858 -0.078 25139 8515 1 15 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.816 0.070 25139 8516 1 15 . 1 1 113 113 ILE C C 113 174.258 174.258 174.871 -0.613 25139 8517 1 15 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.229 0.283 25139 8518 1 15 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.760 0.088 25139 8519 1 15 . 1 1 113 113 ILE H H 113 7.667 7.667 8.332 -0.665 25139 8520 1 15 . 1 1 114 114 ALA N N 114 122.673 122.673 125.961 -3.288 25139 8521 1 15 . 1 1 114 114 ALA C C 114 176.984 176.984 176.778 0.206 25139 8522 1 15 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.164 -1.600 25139 8523 1 15 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.541 1.041 25139 8524 1 15 . 1 1 114 114 ALA H H 114 8.904 8.904 8.839 0.065 25139 8525 1 15 . 1 1 115 115 ALA N N 115 116.486 116.486 116.741 -0.255 25139 8526 1 15 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.418 -0.063 25139 8527 1 15 . 1 1 115 115 ALA C C 115 174.138 174.138 174.133 0.005 25139 8528 1 15 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.873 1.448 25139 8529 1 15 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.298 1.685 25139 8530 1 15 . 1 1 115 115 ALA H H 115 7.182 7.182 7.229 -0.047 25139 8531 1 15 . 1 1 116 116 CYS N N 116 120.099 120.099 120.020 0.079 25139 8532 1 15 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.233 0.098 25139 8533 1 15 . 1 1 116 116 CYS C C 116 176.609 176.609 172.700 3.909 25139 8534 1 15 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.180 -2.231 25139 8535 1 15 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.517 11.867 25139 8536 1 15 . 1 1 116 116 CYS H H 116 8.298 8.298 7.903 0.395 25139 8537 1 15 . 1 1 117 117 PHE N N 117 126.406 126.406 126.618 -0.212 25139 8538 1 15 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.222 -0.023 25139 8539 1 15 . 1 1 117 117 PHE C C 117 173.385 173.385 174.572 -1.187 25139 8540 1 15 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.076 0.178 25139 8541 1 15 . 1 1 117 117 PHE CB C 117 41.681 41.681 40.916 0.765 25139 8542 1 15 . 1 1 117 117 PHE H H 117 9.712 9.712 9.140 0.572 25139 8543 1 15 . 1 1 118 118 LEU N N 118 122.119 122.119 124.005 -1.886 25139 8544 1 15 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.417 -0.251 25139 8545 1 15 . 1 1 118 118 LEU C C 118 175.097 175.097 176.188 -1.091 25139 8546 1 15 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.065 -0.161 25139 8547 1 15 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.455 -1.157 25139 8548 1 15 . 1 1 118 118 LEU H H 118 8.719 8.719 9.086 -0.367 25139 8549 1 15 . 1 1 119 119 ILE N N 119 125.324 125.324 122.380 2.944 25139 8550 1 15 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.953 -0.076 25139 8551 1 15 . 1 1 119 119 ILE C C 119 173.825 173.825 175.395 -1.570 25139 8552 1 15 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.967 -0.860 25139 8553 1 15 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.310 -0.801 25139 8554 1 15 . 1 1 119 119 ILE H H 119 8.986 8.986 9.009 -0.023 25139 8555 1 15 . 1 1 120 120 ASN N N 120 121.534 121.534 124.466 -2.932 25139 8556 1 15 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.753 0.637 25139 8557 1 15 . 1 1 120 120 ASN C C 120 176.098 176.098 176.107 -0.009 25139 8558 1 15 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.165 -3.708 25139 8559 1 15 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.847 1.071 25139 8560 1 15 . 1 1 120 120 ASN H H 120 8.694 8.694 9.101 -0.407 25139 8561 1 15 . 1 1 121 121 CYS N N 121 122.779 122.779 115.967 6.812 25139 8562 1 15 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.125 0.358 25139 8563 1 15 . 1 1 121 121 CYS C C 121 173.195 173.195 173.619 -0.424 25139 8564 1 15 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.865 -4.101 25139 8565 1 15 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.543 16.164 25139 8566 1 15 . 1 1 121 121 CYS H H 121 10.668 10.668 8.615 2.053 25139 8567 1 15 . 1 1 122 122 LEU N N 122 121.063 121.063 117.623 3.440 25139 8568 1 15 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.515 -0.150 25139 8569 1 15 . 1 1 122 122 LEU C C 122 176.743 176.743 175.641 1.102 25139 8570 1 15 . 1 1 122 122 LEU CA C 122 53.664 53.664 52.988 0.676 25139 8571 1 15 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.600 -1.366 25139 8572 1 15 . 1 1 122 122 LEU H H 122 8.256 8.256 7.517 0.739 25139 8573 1 15 . 1 1 123 123 TYR N N 123 123.081 123.081 123.123 -0.042 25139 8574 1 15 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.733 -0.690 25139 8575 1 15 . 1 1 123 123 TYR C C 123 173.633 173.633 174.916 -1.283 25139 8576 1 15 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.086 -0.198 25139 8577 1 15 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.668 -0.587 25139 8578 1 15 . 1 1 123 123 TYR H H 123 8.990 8.990 8.990 -0.000 25139 8579 1 15 . 1 1 124 124 GLU N N 124 128.742 128.742 127.029 1.713 25139 8580 1 15 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.731 -0.181 25139 8581 1 15 . 1 1 124 124 GLU C C 124 174.835 174.835 175.434 -0.599 25139 8582 1 15 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.470 0.162 25139 8583 1 15 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.282 -0.387 25139 8584 1 15 . 1 1 124 124 GLU H H 124 9.135 9.135 8.743 0.392 25139 8585 1 15 . 1 1 125 125 GLN N N 125 108.066 108.066 109.006 -0.940 25139 8586 1 15 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.850 -0.129 25139 8587 1 15 . 1 1 125 125 GLN C C 125 174.627 174.627 174.646 -0.019 25139 8588 1 15 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.770 0.269 25139 8589 1 15 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.682 -0.354 25139 8590 1 15 . 1 1 125 125 GLN H H 125 8.390 8.390 8.449 -0.059 25139 8591 1 15 . 1 1 126 126 ASN N N 126 118.528 118.528 117.506 1.022 25139 8592 1 15 . 1 1 126 126 ASN C C 126 173.713 173.713 174.664 -0.951 25139 8593 1 15 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.834 -0.645 25139 8594 1 15 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.678 1.123 25139 8595 1 15 . 1 1 126 126 ASN H H 126 8.092 8.092 7.902 0.190 25139 8596 1 15 . 1 1 127 127 PHE N N 127 124.680 124.680 122.526 2.154 25139 8597 1 15 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.736 0.301 25139 8598 1 15 . 1 1 127 127 PHE C C 127 177.125 177.125 176.337 0.788 25139 8599 1 15 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.773 0.639 25139 8600 1 15 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.472 0.772 25139 8601 1 15 . 1 1 127 127 PHE H H 127 9.026 9.026 8.845 0.181 25139 8602 1 15 . 1 1 128 128 VAL N N 128 119.455 119.455 119.710 -0.255 25139 8603 1 15 . 1 1 128 128 VAL C C 128 175.886 175.886 175.704 0.182 25139 8604 1 15 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.095 -0.176 25139 8605 1 15 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.938 2.256 25139 8606 1 15 . 1 1 128 128 VAL H H 128 8.364 8.364 7.686 0.678 25139 8607 1 15 . 1 1 129 129 CYS N N 129 116.130 116.130 120.866 -4.736 25139 8608 1 15 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.909 -0.432 25139 8609 1 15 . 1 1 129 129 CYS C C 129 170.569 170.569 173.997 -3.428 25139 8610 1 15 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.907 -3.757 25139 8611 1 15 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.800 18.817 25139 8612 1 15 . 1 1 129 129 CYS H H 129 5.390 5.390 7.161 -1.771 25139 8613 1 15 . 1 1 130 130 LYS N N 130 120.071 120.071 125.232 -5.161 25139 8614 1 15 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.129 0.432 25139 8615 1 15 . 1 1 130 130 LYS C C 130 176.853 176.853 174.401 2.452 25139 8616 1 15 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.929 -0.042 25139 8617 1 15 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.804 0.838 25139 8618 1 15 . 1 1 130 130 LYS H H 130 8.066 8.066 8.265 -0.199 25139 8619 1 15 . 1 1 131 131 PHE N N 131 118.415 118.415 119.441 -1.026 25139 8620 1 15 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.550 -0.943 25139 8621 1 15 . 1 1 131 131 PHE C C 131 174.013 174.013 175.299 -1.286 25139 8622 1 15 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.005 1.706 25139 8623 1 15 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.342 0.738 25139 8624 1 15 . 1 1 131 131 PHE H H 131 8.714 8.714 8.162 0.552 25139 8625 1 15 . 1 1 132 132 ALA N N 132 124.209 124.209 122.612 1.597 25139 8626 1 15 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.002 -0.385 25139 8627 1 15 . 1 1 132 132 ALA C C 132 174.352 174.352 174.282 0.070 25139 8628 1 15 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.583 1.858 25139 8629 1 15 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.819 -0.355 25139 8630 1 15 . 1 1 132 132 ALA H H 132 9.295 9.295 9.148 0.147 25139 8631 1 15 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.222 -0.339 25139 8632 1 15 . 1 1 133 133 PRO C C 133 173.923 173.923 176.501 -2.578 25139 8633 1 15 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.523 0.548 25139 8634 1 15 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.334 -0.731 25139 8635 1 15 . 1 1 134 134 ARG N N 134 126.071 126.071 121.743 4.328 25139 8636 1 15 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.656 -0.401 25139 8637 1 15 . 1 1 134 134 ARG C C 134 177.065 177.065 175.727 1.338 25139 8638 1 15 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.719 1.445 25139 8639 1 15 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.740 -1.557 25139 8640 1 15 . 1 1 134 134 ARG H H 134 8.672 8.672 8.490 0.182 25139 8641 1 15 . 1 1 135 135 GLU N N 135 125.683 125.683 120.801 4.882 25139 8642 1 15 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.506 -0.153 25139 8643 1 15 . 1 1 135 135 GLU C C 135 178.081 178.081 176.747 1.334 25139 8644 1 15 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.048 0.603 25139 8645 1 15 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.247 -0.251 25139 8646 1 15 . 1 1 135 135 GLU H H 135 8.603 8.603 8.886 -0.283 25139 8647 1 15 . 1 1 136 136 GLY N N 136 110.031 110.031 107.692 2.339 25139 8648 1 15 . 1 1 136 136 GLY C C 136 173.079 173.079 172.441 0.638 25139 8649 1 15 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.515 1.263 25139 8650 1 15 . 1 1 136 136 GLY H H 136 9.036 9.036 8.324 0.712 25139 8651 1 15 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.590 0.085 25139 8652 1 15 . 1 1 137 137 PHE C C 137 174.936 174.936 174.070 0.866 25139 8653 1 15 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.524 -0.440 25139 8654 1 15 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.969 1.727 25139 8655 1 15 . 1 1 138 138 ILE N N 138 117.417 117.417 114.742 2.675 25139 8656 1 15 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.686 -0.179 25139 8657 1 15 . 1 1 138 138 ILE C C 138 173.858 173.858 173.396 0.462 25139 8658 1 15 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.654 0.966 25139 8659 1 15 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.464 1.133 25139 8660 1 15 . 1 1 138 138 ILE H H 138 8.777 8.777 8.590 0.187 25139 8661 1 15 . 1 1 139 139 ASN N N 139 117.201 117.201 116.709 0.492 25139 8662 1 15 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.577 0.482 25139 8663 1 15 . 1 1 139 139 ASN C C 139 173.721 173.721 174.115 -0.394 25139 8664 1 15 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.760 -1.530 25139 8665 1 15 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.415 1.446 25139 8666 1 15 . 1 1 139 139 ASN H H 139 8.872 8.872 8.474 0.398 25139 8667 1 15 . 1 1 140 140 TYR N N 140 123.991 123.991 119.990 4.001 25139 8668 1 15 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.821 0.357 25139 8669 1 15 . 1 1 140 140 TYR C C 140 174.791 174.791 175.186 -0.395 25139 8670 1 15 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.447 -1.375 25139 8671 1 15 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.737 1.933 25139 8672 1 15 . 1 1 140 140 TYR H H 140 9.526 9.526 8.821 0.705 25139 8673 1 15 . 1 1 141 141 LEU N N 141 122.779 122.779 120.059 2.720 25139 8674 1 15 . 1 1 141 141 LEU C C 141 175.404 175.404 177.499 -2.095 25139 8675 1 15 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.802 2.301 25139 8676 1 15 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.407 -1.246 25139 8677 1 15 . 1 1 141 141 LEU H H 141 9.010 9.010 8.934 0.076 25139 8678 1 15 . 1 1 142 142 THR N N 142 113.189 113.189 111.281 1.908 25139 8679 1 15 . 1 1 142 142 THR HA H 142 4.061 4.061 3.981 0.080 25139 8680 1 15 . 1 1 142 142 THR C C 142 175.940 175.940 176.265 -0.325 25139 8681 1 15 . 1 1 142 142 THR CA C 142 61.389 61.389 61.118 0.271 25139 8682 1 15 . 1 1 142 142 THR CB C 142 69.779 69.779 70.178 -0.399 25139 8683 1 15 . 1 1 142 142 THR H H 142 7.737 7.737 8.116 -0.379 25139 8684 1 15 . 1 1 143 143 ARG N N 143 120.975 120.975 119.854 1.121 25139 8685 1 15 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.891 0.047 25139 8686 1 15 . 1 1 143 143 ARG C C 143 178.690 178.690 177.145 1.545 25139 8687 1 15 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.445 0.303 25139 8688 1 15 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.815 0.330 25139 8689 1 15 . 1 1 143 143 ARG H H 143 8.149 8.149 8.101 0.048 25139 8690 1 15 . 1 1 144 144 GLU N N 144 116.997 116.997 117.962 -0.965 25139 8691 1 15 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.296 -0.187 25139 8692 1 15 . 1 1 144 144 GLU C C 144 178.442 178.442 177.902 0.540 25139 8693 1 15 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.459 1.404 25139 8694 1 15 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.634 -0.052 25139 8695 1 15 . 1 1 144 144 GLU H H 144 8.622 8.622 7.701 0.921 25139 8696 1 15 . 1 1 145 145 VAL N N 145 111.213 111.213 118.754 -7.541 25139 8697 1 15 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.032 0.379 25139 8698 1 15 . 1 1 145 145 VAL C C 145 176.965 176.965 176.580 0.385 25139 8699 1 15 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.858 -0.264 25139 8700 1 15 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.998 -0.916 25139 8701 1 15 . 1 1 145 145 VAL H H 145 7.227 7.227 7.552 -0.325 25139 8702 1 15 . 1 1 146 146 TYR N N 146 123.512 123.512 121.442 2.070 25139 8703 1 15 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.022 -0.142 25139 8704 1 15 . 1 1 146 146 TYR C C 146 176.377 176.377 176.898 -0.521 25139 8705 1 15 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.964 0.573 25139 8706 1 15 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.565 -0.226 25139 8707 1 15 . 1 1 146 146 TYR H H 146 8.492 8.492 8.736 -0.244 25139 8708 1 15 . 1 1 147 147 ARG N N 147 116.680 116.680 116.498 0.182 25139 8709 1 15 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.770 0.044 25139 8710 1 15 . 1 1 147 147 ARG C C 147 178.858 178.858 178.001 0.857 25139 8711 1 15 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.899 -0.203 25139 8712 1 15 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.645 0.020 25139 8713 1 15 . 1 1 147 147 ARG H H 147 8.053 8.053 8.611 -0.558 25139 8714 1 15 . 1 1 148 148 SER N N 148 115.306 115.306 114.087 1.219 25139 8715 1 15 . 1 1 148 148 SER HA H 148 3.998 3.998 4.314 -0.316 25139 8716 1 15 . 1 1 148 148 SER C C 148 175.786 175.786 175.806 -0.020 25139 8717 1 15 . 1 1 148 148 SER CA C 148 62.006 62.006 60.211 1.795 25139 8718 1 15 . 1 1 148 148 SER H H 148 7.139 7.139 7.515 -0.376 25139 8719 1 15 . 1 1 149 149 TYR N N 149 123.207 123.207 122.714 0.493 25139 8720 1 15 . 1 1 149 149 TYR C C 149 175.831 175.831 177.798 -1.967 25139 8721 1 15 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.349 -0.750 25139 8722 1 15 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.535 0.246 25139 8723 1 15 . 1 1 149 149 TYR H H 149 7.253 7.253 7.371 -0.118 25139 8724 1 15 . 1 1 150 150 ARG N N 150 118.708 118.708 117.383 1.325 25139 8725 1 15 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.948 -0.602 25139 8726 1 15 . 1 1 150 150 ARG C C 150 177.644 177.644 177.726 -0.082 25139 8727 1 15 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.116 0.207 25139 8728 1 15 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.355 -0.500 25139 8729 1 15 . 1 1 150 150 ARG H H 150 8.441 8.441 7.770 0.671 25139 8730 1 15 . 1 1 151 151 GLN N N 151 116.551 116.551 118.561 -2.010 25139 8731 1 15 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.102 -0.145 25139 8732 1 15 . 1 1 151 151 GLN C C 151 177.987 177.987 176.722 1.265 25139 8733 1 15 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.310 0.031 25139 8734 1 15 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.204 0.260 25139 8735 1 15 . 1 1 151 151 GLN H H 151 7.332 7.332 7.677 -0.345 25139 8736 1 15 . 1 1 152 152 LEU N N 152 118.877 118.877 115.227 3.650 25139 8737 1 15 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.665 -0.486 25139 8738 1 15 . 1 1 152 152 LEU C C 152 179.070 179.070 177.084 1.986 25139 8739 1 15 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.331 1.751 25139 8740 1 15 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.471 -0.783 25139 8741 1 15 . 1 1 152 152 LEU H H 152 7.106 7.106 7.369 -0.263 25139 8742 1 15 . 1 1 153 153 VAL N N 153 119.076 119.076 114.193 4.883 25139 8743 1 15 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.991 -1.131 25139 8744 1 15 . 1 1 153 153 VAL C C 153 177.421 177.421 175.879 1.542 25139 8745 1 15 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.327 2.256 25139 8746 1 15 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.291 -1.773 25139 8747 1 15 . 1 1 153 153 VAL H H 153 7.427 7.427 7.232 0.195 25139 8748 1 15 . 1 1 154 154 ASP N N 154 119.888 119.888 123.860 -3.972 25139 8749 1 15 . 1 1 154 154 ASP C C 154 177.422 177.422 175.921 1.501 25139 8750 1 15 . 1 1 154 154 ASP CA C 154 56.071 56.071 55.336 0.735 25139 8751 1 15 . 1 1 154 154 ASP CB C 154 40.349 40.349 39.885 0.464 25139 8752 1 15 . 1 1 154 154 ASP H H 154 7.930 7.930 7.792 0.138 25139 8753 1 15 . 1 1 155 155 HIS N N 155 117.821 117.821 120.826 -3.005 25139 8754 1 15 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.014 2.742 25139 8755 1 15 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.667 -0.487 25139 8756 1 15 . 1 1 155 155 HIS H H 155 7.680 7.680 8.235 -0.555 25139 8757 1 15 . 1 1 156 156 HIS N N 156 119.180 119.180 117.644 1.536 25139 8758 1 15 . 1 1 156 156 HIS CA C 156 57.931 57.931 54.952 2.979 25139 8759 1 15 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.594 -0.294 25139 8760 1 15 . 1 1 156 156 HIS H H 156 7.868 7.868 8.020 -0.152 25139 8761 1 16 . 1 1 48 48 ALA CA C 48 52.904 52.904 51.702 1.202 25139 8762 1 16 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.003 1.219 25139 8763 1 16 . 1 1 49 49 ASP N N 49 119.661 119.661 120.934 -1.273 25139 8764 1 16 . 1 1 49 49 ASP CA C 49 54.277 54.277 56.514 -2.237 25139 8765 1 16 . 1 1 49 49 ASP CB C 49 41.062 41.062 40.341 0.721 25139 8766 1 16 . 1 1 49 49 ASP H H 49 8.462 8.462 8.276 0.186 25139 8767 1 16 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.624 -0.572 25139 8768 1 16 . 1 1 51 51 LEU C C 51 178.514 178.514 177.443 1.071 25139 8769 1 16 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.758 1.291 25139 8770 1 16 . 1 1 51 51 LEU CB C 51 41.193 41.193 43.441 -2.248 25139 8771 1 16 . 1 1 52 52 ASN N N 52 113.819 113.819 116.828 -3.009 25139 8772 1 16 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.903 -0.068 25139 8773 1 16 . 1 1 52 52 ASN C C 52 175.964 175.964 176.076 -0.112 25139 8774 1 16 . 1 1 52 52 ASN CA C 52 54.096 54.096 54.821 -0.725 25139 8775 1 16 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.180 -0.297 25139 8776 1 16 . 1 1 52 52 ASN H H 52 7.853 7.853 8.330 -0.477 25139 8777 1 16 . 1 1 53 53 SER N N 53 114.357 114.357 115.815 -1.458 25139 8778 1 16 . 1 1 53 53 SER CA C 53 59.908 59.908 59.664 0.244 25139 8779 1 16 . 1 1 53 53 SER CB C 53 64.395 64.395 63.566 0.829 25139 8780 1 16 . 1 1 53 53 SER H H 53 8.023 8.023 7.819 0.204 25139 8781 1 16 . 1 1 54 54 PHE N N 54 121.037 121.037 119.517 1.520 25139 8782 1 16 . 1 1 54 54 PHE C C 54 175.522 175.522 176.384 -0.862 25139 8783 1 16 . 1 1 54 54 PHE CA C 54 58.064 58.064 59.554 -1.490 25139 8784 1 16 . 1 1 54 54 PHE CB C 54 43.053 43.053 39.885 3.168 25139 8785 1 16 . 1 1 54 54 PHE H H 54 7.731 7.731 7.776 -0.045 25139 8786 1 16 . 1 1 55 55 THR N N 55 116.535 116.535 119.262 -2.727 25139 8787 1 16 . 1 1 55 55 THR HA H 55 4.654 4.654 4.578 0.076 25139 8788 1 16 . 1 1 55 55 THR C C 55 173.301 173.301 173.165 0.136 25139 8789 1 16 . 1 1 55 55 THR CA C 55 61.420 61.420 61.499 -0.079 25139 8790 1 16 . 1 1 55 55 THR CB C 55 71.388 71.388 70.512 0.876 25139 8791 1 16 . 1 1 55 55 THR H H 55 8.929 8.929 9.069 -0.140 25139 8792 1 16 . 1 1 56 56 ALA N N 56 129.359 129.359 129.442 -0.083 25139 8793 1 16 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.981 0.334 25139 8794 1 16 . 1 1 56 56 ALA C C 56 178.305 178.305 177.053 1.252 25139 8795 1 16 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.080 0.791 25139 8796 1 16 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.321 0.003 25139 8797 1 16 . 1 1 56 56 ALA H H 56 8.907 8.907 8.703 0.204 25139 8798 1 16 . 1 1 57 57 GLY N N 57 106.331 106.331 109.291 -2.960 25139 8799 1 16 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.491 1.120 25139 8800 1 16 . 1 1 57 57 GLY H H 57 7.978 7.978 8.174 -0.196 25139 8801 1 16 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.352 -0.028 25139 8802 1 16 . 1 1 59 59 PRO C C 59 177.466 177.466 177.782 -0.316 25139 8803 1 16 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.932 1.552 25139 8804 1 16 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.317 -0.582 25139 8805 1 16 . 1 1 60 60 GLY N N 60 109.688 109.688 108.410 1.278 25139 8806 1 16 . 1 1 60 60 GLY C C 60 173.555 173.555 173.246 0.309 25139 8807 1 16 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.179 0.362 25139 8808 1 16 . 1 1 60 60 GLY H H 60 8.402 8.402 8.463 -0.061 25139 8809 1 16 . 1 1 61 61 PHE N N 61 122.491 122.491 121.915 0.576 25139 8810 1 16 . 1 1 61 61 PHE C C 61 175.146 175.146 174.711 0.435 25139 8811 1 16 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.260 2.022 25139 8812 1 16 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.505 -1.806 25139 8813 1 16 . 1 1 61 61 PHE H H 61 7.957 7.957 7.252 0.705 25139 8814 1 16 . 1 1 62 62 VAL N N 62 121.128 121.128 117.936 3.192 25139 8815 1 16 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.396 -0.311 25139 8816 1 16 . 1 1 62 62 VAL C C 62 174.937 174.937 175.107 -0.170 25139 8817 1 16 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.150 0.558 25139 8818 1 16 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.878 0.554 25139 8819 1 16 . 1 1 62 62 VAL H H 62 7.994 7.994 8.889 -0.895 25139 8820 1 16 . 1 1 63 63 LEU N N 63 124.386 124.386 122.473 1.913 25139 8821 1 16 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.945 -1.629 25139 8822 1 16 . 1 1 63 63 LEU C C 63 175.278 175.278 176.476 -1.198 25139 8823 1 16 . 1 1 63 63 LEU CA C 63 56.288 56.288 56.124 0.164 25139 8824 1 16 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.439 1.679 25139 8825 1 16 . 1 1 63 63 LEU H H 63 7.572 7.572 9.108 -1.536 25139 8826 1 16 . 1 1 64 64 ASP N N 64 126.746 126.746 127.085 -0.339 25139 8827 1 16 . 1 1 64 64 ASP C C 64 177.801 177.801 175.708 2.093 25139 8828 1 16 . 1 1 64 64 ASP CA C 64 51.721 51.721 52.774 -1.053 25139 8829 1 16 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.811 -1.413 25139 8830 1 16 . 1 1 64 64 ASP H H 64 8.552 8.552 8.356 0.196 25139 8831 1 16 . 1 1 65 65 THR C C 65 175.002 175.002 175.685 -0.683 25139 8832 1 16 . 1 1 65 65 THR CB C 65 67.919 67.919 68.978 -1.059 25139 8833 1 16 . 1 1 66 66 GLN N N 66 120.804 120.804 119.241 1.563 25139 8834 1 16 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.155 -0.278 25139 8835 1 16 . 1 1 66 66 GLN C C 66 178.901 178.901 176.674 2.227 25139 8836 1 16 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.966 1.450 25139 8837 1 16 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.064 -0.140 25139 8838 1 16 . 1 1 66 66 GLN H H 66 8.447 8.447 8.452 -0.005 25139 8839 1 16 . 1 1 67 67 ALA N N 67 121.267 121.267 121.698 -0.431 25139 8840 1 16 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.304 -0.347 25139 8841 1 16 . 1 1 67 67 ALA C C 67 176.777 176.777 178.626 -1.849 25139 8842 1 16 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.650 0.674 25139 8843 1 16 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.012 -0.392 25139 8844 1 16 . 1 1 67 67 ALA H H 67 7.791 7.791 7.377 0.414 25139 8845 1 16 . 1 1 68 68 SER N N 68 113.339 113.339 113.605 -0.266 25139 8846 1 16 . 1 1 68 68 SER HA H 68 4.061 4.061 4.260 -0.199 25139 8847 1 16 . 1 1 68 68 SER C C 68 175.875 175.875 176.555 -0.680 25139 8848 1 16 . 1 1 68 68 SER CA C 68 62.970 62.970 60.455 2.515 25139 8849 1 16 . 1 1 68 68 SER CB C 68 61.330 61.330 63.943 -2.613 25139 8850 1 16 . 1 1 68 68 SER H H 68 7.785 7.785 7.683 0.102 25139 8851 1 16 . 1 1 69 69 VAL N N 69 125.140 125.140 117.946 7.194 25139 8852 1 16 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.172 -0.096 25139 8853 1 16 . 1 1 69 69 VAL C C 69 176.384 176.384 176.818 -0.434 25139 8854 1 16 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.691 1.040 25139 8855 1 16 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.569 -0.080 25139 8856 1 16 . 1 1 69 69 VAL H H 69 8.572 8.572 8.033 0.539 25139 8857 1 16 . 1 1 70 70 SER N N 70 116.704 116.704 112.860 3.844 25139 8858 1 16 . 1 1 70 70 SER HA H 70 4.229 4.229 4.229 0.000 25139 8859 1 16 . 1 1 70 70 SER C C 70 174.101 174.101 175.227 -1.126 25139 8860 1 16 . 1 1 70 70 SER CA C 70 61.627 61.627 59.097 2.530 25139 8861 1 16 . 1 1 70 70 SER H H 70 7.951 7.951 7.969 -0.018 25139 8862 1 16 . 1 1 71 71 ASN N N 71 117.576 117.576 116.995 0.581 25139 8863 1 16 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.651 0.151 25139 8864 1 16 . 1 1 71 71 ASN C C 71 174.332 174.332 174.920 -0.588 25139 8865 1 16 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.976 -0.537 25139 8866 1 16 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.993 0.474 25139 8867 1 16 . 1 1 71 71 ASN H H 71 7.131 7.131 7.544 -0.413 25139 8868 1 16 . 1 1 72 72 GLY N N 72 103.925 103.925 105.349 -1.424 25139 8869 1 16 . 1 1 72 72 GLY C C 72 174.710 174.710 173.461 1.249 25139 8870 1 16 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.514 0.035 25139 8871 1 16 . 1 1 72 72 GLY H H 72 7.338 7.338 7.524 -0.186 25139 8872 1 16 . 1 1 73 73 ALA N N 73 124.942 124.942 123.148 1.794 25139 8873 1 16 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.555 -0.383 25139 8874 1 16 . 1 1 73 73 ALA C C 73 175.896 175.896 176.244 -0.348 25139 8875 1 16 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.889 0.784 25139 8876 1 16 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.136 -0.080 25139 8877 1 16 . 1 1 73 73 ALA H H 73 8.032 8.032 7.949 0.083 25139 8878 1 16 . 1 1 74 74 THR N N 74 113.423 113.423 115.486 -2.063 25139 8879 1 16 . 1 1 74 74 THR HA H 74 4.678 4.678 4.542 0.136 25139 8880 1 16 . 1 1 74 74 THR C C 74 173.339 173.339 173.092 0.247 25139 8881 1 16 . 1 1 74 74 THR CA C 74 61.545 61.545 61.659 -0.114 25139 8882 1 16 . 1 1 74 74 THR CB C 74 71.319 71.319 71.817 -0.498 25139 8883 1 16 . 1 1 74 74 THR H H 74 8.530 8.530 8.274 0.256 25139 8884 1 16 . 1 1 75 75 PHE N N 75 128.180 128.180 129.792 -1.612 25139 8885 1 16 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.787 -0.183 25139 8886 1 16 . 1 1 75 75 PHE C C 75 174.623 174.623 175.088 -0.465 25139 8887 1 16 . 1 1 75 75 PHE CA C 75 57.616 57.616 58.444 -0.828 25139 8888 1 16 . 1 1 75 75 PHE CB C 75 38.675 38.675 39.068 -0.393 25139 8889 1 16 . 1 1 75 75 PHE H H 75 9.146 9.146 9.106 0.040 25139 8890 1 16 . 1 1 76 76 LEU N N 76 127.849 127.849 125.627 2.222 25139 8891 1 16 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.491 -0.140 25139 8892 1 16 . 1 1 76 76 LEU C C 76 176.339 176.339 176.281 0.058 25139 8893 1 16 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.166 0.817 25139 8894 1 16 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.277 0.053 25139 8895 1 16 . 1 1 76 76 LEU H H 76 8.635 8.635 7.902 0.733 25139 8896 1 16 . 1 1 77 77 GLU N N 77 115.131 115.131 119.709 -4.578 25139 8897 1 16 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.397 0.011 25139 8898 1 16 . 1 1 77 77 GLU C C 77 174.734 174.734 174.497 0.237 25139 8899 1 16 . 1 1 77 77 GLU CA C 77 56.353 56.353 54.920 1.433 25139 8900 1 16 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.609 0.598 25139 8901 1 16 . 1 1 77 77 GLU H H 77 7.252 7.252 7.597 -0.345 25139 8902 1 16 . 1 1 78 78 SER N N 78 118.016 118.016 118.507 -0.491 25139 8903 1 16 . 1 1 78 78 SER HA H 78 5.561 5.561 5.217 0.344 25139 8904 1 16 . 1 1 78 78 SER C C 78 171.968 171.968 173.189 -1.221 25139 8905 1 16 . 1 1 78 78 SER CA C 78 54.061 54.061 55.344 -1.283 25139 8906 1 16 . 1 1 78 78 SER CB C 78 64.074 64.074 63.296 0.778 25139 8907 1 16 . 1 1 78 78 SER H H 78 9.033 9.033 8.653 0.380 25139 8908 1 16 . 1 1 79 79 PRO CA C 79 62.600 62.600 64.063 -1.463 25139 8909 1 16 . 1 1 79 79 PRO CB C 79 32.410 32.410 31.599 0.811 25139 8910 1 16 . 1 1 80 80 THR N N 80 118.079 118.079 110.907 7.172 25139 8911 1 16 . 1 1 80 80 THR HA H 80 4.342 4.342 3.758 0.584 25139 8912 1 16 . 1 1 80 80 THR C C 80 174.494 174.494 173.388 1.106 25139 8913 1 16 . 1 1 80 80 THR CA C 80 61.453 61.453 63.120 -1.667 25139 8914 1 16 . 1 1 80 80 THR CB C 80 67.797 67.797 68.159 -0.362 25139 8915 1 16 . 1 1 80 80 THR H H 80 8.670 8.670 7.842 0.828 25139 8916 1 16 . 1 1 81 81 VAL N N 81 117.395 117.395 110.988 6.407 25139 8917 1 16 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.873 0.734 25139 8918 1 16 . 1 1 81 81 VAL C C 81 175.518 175.518 176.402 -0.884 25139 8919 1 16 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.794 -2.680 25139 8920 1 16 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.417 2.178 25139 8921 1 16 . 1 1 81 81 VAL H H 81 7.448 7.448 7.386 0.062 25139 8922 1 16 . 1 1 82 82 ARG N N 82 117.852 117.852 118.073 -0.221 25139 8923 1 16 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.720 -0.199 25139 8924 1 16 . 1 1 82 82 ARG C C 82 176.992 176.992 175.553 1.439 25139 8925 1 16 . 1 1 82 82 ARG CA C 82 56.385 56.385 54.918 1.467 25139 8926 1 16 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.487 1.115 25139 8927 1 16 . 1 1 82 82 ARG H H 82 8.710 8.710 8.683 0.027 25139 8928 1 16 . 1 1 83 83 ARG N N 83 117.035 117.035 118.953 -1.918 25139 8929 1 16 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.786 0.536 25139 8930 1 16 . 1 1 83 83 ARG C C 83 177.379 177.379 176.294 1.085 25139 8931 1 16 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.867 -1.183 25139 8932 1 16 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.990 -0.949 25139 8933 1 16 . 1 1 83 83 ARG H H 83 7.292 7.292 7.797 -0.505 25139 8934 1 16 . 1 1 84 84 GLY N N 84 114.911 114.911 110.481 4.430 25139 8935 1 16 . 1 1 84 84 GLY C C 84 176.940 176.940 175.079 1.861 25139 8936 1 16 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.630 2.042 25139 8937 1 16 . 1 1 84 84 GLY H H 84 9.255 9.255 8.309 0.946 25139 8938 1 16 . 1 1 85 85 TRP N N 85 121.810 121.810 119.637 2.173 25139 8939 1 16 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.137 0.030 25139 8940 1 16 . 1 1 85 85 TRP C C 85 178.272 178.272 177.730 0.542 25139 8941 1 16 . 1 1 85 85 TRP CA C 85 60.045 60.045 60.451 -0.406 25139 8942 1 16 . 1 1 85 85 TRP CB C 85 29.217 29.217 28.982 0.235 25139 8943 1 16 . 1 1 85 85 TRP H H 85 9.963 9.963 7.725 2.238 25139 8944 1 16 . 1 1 86 86 ASP N N 86 116.400 116.400 119.001 -2.601 25139 8945 1 16 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.435 -0.042 25139 8946 1 16 . 1 1 86 86 ASP C C 86 178.803 178.803 177.862 0.941 25139 8947 1 16 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.958 0.096 25139 8948 1 16 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.242 0.491 25139 8949 1 16 . 1 1 86 86 ASP H H 86 6.934 6.934 7.997 -1.063 25139 8950 1 16 . 1 1 87 87 CYS N N 87 122.454 122.454 119.336 3.118 25139 8951 1 16 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.220 0.030 25139 8952 1 16 . 1 1 87 87 CYS C C 87 174.956 174.956 176.574 -1.618 25139 8953 1 16 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.995 -3.848 25139 8954 1 16 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.026 11.459 25139 8955 1 16 . 1 1 87 87 CYS H H 87 7.603 7.603 7.412 0.191 25139 8956 1 16 . 1 1 88 88 VAL N N 88 119.192 119.192 120.632 -1.440 25139 8957 1 16 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.066 -0.608 25139 8958 1 16 . 1 1 88 88 VAL C C 88 177.413 177.413 177.675 -0.262 25139 8959 1 16 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.271 0.705 25139 8960 1 16 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.020 -0.778 25139 8961 1 16 . 1 1 88 88 VAL H H 88 7.192 7.192 7.559 -0.367 25139 8962 1 16 . 1 1 89 89 ARG N N 89 118.185 118.185 118.628 -0.443 25139 8963 1 16 . 1 1 89 89 ARG HA H 89 3.680 3.680 4.286 -0.606 25139 8964 1 16 . 1 1 89 89 ARG C C 89 178.677 178.677 178.063 0.614 25139 8965 1 16 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.699 1.256 25139 8966 1 16 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.507 0.284 25139 8967 1 16 . 1 1 89 89 ARG H H 89 7.971 7.971 7.769 0.202 25139 8968 1 16 . 1 1 90 90 ALA N N 90 120.815 120.815 122.283 -1.468 25139 8969 1 16 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.167 -0.092 25139 8970 1 16 . 1 1 90 90 ALA C C 90 177.416 177.416 179.307 -1.891 25139 8971 1 16 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.523 -0.269 25139 8972 1 16 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.025 -0.589 25139 8973 1 16 . 1 1 90 90 ALA H H 90 7.453 7.453 7.593 -0.141 25139 8974 1 16 . 1 1 91 91 CYS N N 91 120.380 120.380 116.132 4.248 25139 8975 1 16 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.245 0.126 25139 8976 1 16 . 1 1 91 91 CYS C C 91 176.654 176.654 175.827 0.827 25139 8977 1 16 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.449 -3.754 25139 8978 1 16 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.019 12.685 25139 8979 1 16 . 1 1 91 91 CYS H H 91 7.944 7.944 7.611 0.333 25139 8980 1 16 . 1 1 92 92 CYS N N 92 116.270 116.270 119.771 -3.501 25139 8981 1 16 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.440 -0.036 25139 8982 1 16 . 1 1 92 92 CYS C C 92 175.628 175.628 176.682 -1.054 25139 8983 1 16 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.943 -3.237 25139 8984 1 16 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.164 14.985 25139 8985 1 16 . 1 1 92 92 CYS H H 92 8.315 8.315 7.771 0.544 25139 8986 1 16 . 1 1 93 93 THR N N 93 107.283 107.283 111.120 -3.837 25139 8987 1 16 . 1 1 93 93 THR HA H 93 4.481 4.481 4.144 0.337 25139 8988 1 16 . 1 1 93 93 THR C C 93 173.606 173.606 175.495 -1.889 25139 8989 1 16 . 1 1 93 93 THR CA C 93 61.402 61.402 64.524 -3.122 25139 8990 1 16 . 1 1 93 93 THR CB C 93 69.046 69.046 68.539 0.507 25139 8991 1 16 . 1 1 93 93 THR H H 93 7.445 7.445 7.398 0.047 25139 8992 1 16 . 1 1 94 94 THR N N 94 121.432 121.432 121.421 0.011 25139 8993 1 16 . 1 1 94 94 THR HA H 94 4.398 4.398 4.421 -0.023 25139 8994 1 16 . 1 1 94 94 THR C C 94 173.493 173.493 174.725 -1.232 25139 8995 1 16 . 1 1 94 94 THR CA C 94 62.726 62.726 62.665 0.061 25139 8996 1 16 . 1 1 94 94 THR CB C 94 69.704 69.704 69.092 0.612 25139 8997 1 16 . 1 1 94 94 THR H H 94 7.553 7.553 7.996 -0.443 25139 8998 1 16 . 1 1 95 95 GLN N N 95 129.410 129.410 127.197 2.213 25139 8999 1 16 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.018 -0.074 25139 9000 1 16 . 1 1 95 95 GLN C C 95 176.293 176.293 175.942 0.351 25139 9001 1 16 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.463 -0.423 25139 9002 1 16 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.650 -0.394 25139 9003 1 16 . 1 1 95 95 GLN H H 95 8.812 8.812 8.512 0.300 25139 9004 1 16 . 1 1 96 96 ASN N N 96 115.015 115.015 114.962 0.053 25139 9005 1 16 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.823 -0.624 25139 9006 1 16 . 1 1 96 96 ASN C C 96 172.260 172.260 174.161 -1.901 25139 9007 1 16 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.623 2.944 25139 9008 1 16 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.733 -1.896 25139 9009 1 16 . 1 1 96 96 ASN H H 96 8.791 8.791 8.123 0.668 25139 9010 1 16 . 1 1 97 97 CYS N N 97 115.830 115.830 120.135 -4.305 25139 9011 1 16 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.512 -0.411 25139 9012 1 16 . 1 1 97 97 CYS C C 97 175.025 175.025 174.401 0.624 25139 9013 1 16 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.458 -1.310 25139 9014 1 16 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.732 16.502 25139 9015 1 16 . 1 1 97 97 CYS H H 97 7.651 7.651 7.662 -0.011 25139 9016 1 16 . 1 1 98 98 ASN N N 98 125.148 125.148 125.580 -0.432 25139 9017 1 16 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.083 0.050 25139 9018 1 16 . 1 1 98 98 ASN C C 98 171.892 171.892 174.277 -2.385 25139 9019 1 16 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.340 -0.146 25139 9020 1 16 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.558 -1.610 25139 9021 1 16 . 1 1 98 98 ASN H H 98 8.736 8.736 8.496 0.240 25139 9022 1 16 . 1 1 99 99 LEU N N 99 120.898 120.898 121.215 -0.317 25139 9023 1 16 . 1 1 99 99 LEU C C 99 173.084 173.084 174.310 -1.226 25139 9024 1 16 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.683 2.437 25139 9025 1 16 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.659 -1.331 25139 9026 1 16 . 1 1 99 99 LEU H H 99 8.200 8.200 8.178 0.022 25139 9027 1 16 . 1 1 100 100 ALA N N 100 128.085 128.085 129.821 -1.736 25139 9028 1 16 . 1 1 100 100 ALA C C 100 174.938 174.938 175.480 -0.542 25139 9029 1 16 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.737 -0.990 25139 9030 1 16 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.381 0.333 25139 9031 1 16 . 1 1 100 100 ALA H H 100 9.156 9.156 9.029 0.127 25139 9032 1 16 . 1 1 101 101 LEU N N 101 128.723 128.723 127.881 0.842 25139 9033 1 16 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.161 -0.019 25139 9034 1 16 . 1 1 101 101 LEU C C 101 174.379 174.379 175.313 -0.934 25139 9035 1 16 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.826 -0.973 25139 9036 1 16 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.520 0.787 25139 9037 1 16 . 1 1 101 101 LEU H H 101 9.578 9.578 8.850 0.728 25139 9038 1 16 . 1 1 102 102 VAL N N 102 119.417 119.417 120.764 -1.347 25139 9039 1 16 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.165 0.363 25139 9040 1 16 . 1 1 102 102 VAL C C 102 173.660 173.660 173.938 -0.278 25139 9041 1 16 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.082 -0.462 25139 9042 1 16 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.151 -1.878 25139 9043 1 16 . 1 1 102 102 VAL H H 102 9.297 9.297 9.341 -0.044 25139 9044 1 16 . 1 1 103 103 GLU N N 103 124.427 124.427 123.043 1.384 25139 9045 1 16 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.292 -0.427 25139 9046 1 16 . 1 1 103 103 GLU C C 103 176.319 176.319 174.496 1.823 25139 9047 1 16 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.282 -0.181 25139 9048 1 16 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.993 0.208 25139 9049 1 16 . 1 1 103 103 GLU H H 103 7.749 7.749 8.244 -0.495 25139 9050 1 16 . 1 1 104 104 LEU N N 104 127.294 127.294 125.266 2.028 25139 9051 1 16 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.490 -0.170 25139 9052 1 16 . 1 1 104 104 LEU C C 104 176.593 176.593 177.266 -0.673 25139 9053 1 16 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.111 2.973 25139 9054 1 16 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.889 -0.498 25139 9055 1 16 . 1 1 104 104 LEU H H 104 8.323 8.323 8.128 0.195 25139 9056 1 16 . 1 1 105 105 GLN N N 105 121.361 121.361 118.366 2.995 25139 9057 1 16 . 1 1 105 105 GLN C C 105 172.868 172.868 174.620 -1.752 25139 9058 1 16 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.396 -2.990 25139 9059 1 16 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.421 2.308 25139 9060 1 16 . 1 1 105 105 GLN H H 105 8.095 8.095 8.267 -0.172 25139 9061 1 16 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.454 -0.045 25139 9062 1 16 . 1 1 106 106 PRO C C 106 177.770 177.770 176.849 0.921 25139 9063 1 16 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.255 0.230 25139 9064 1 16 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.435 -0.667 25139 9065 1 16 . 1 1 107 107 ASP N N 107 116.484 116.484 116.069 0.415 25139 9066 1 16 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.581 -0.141 25139 9067 1 16 . 1 1 107 107 ASP C C 107 176.749 176.749 175.868 0.881 25139 9068 1 16 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.526 -0.071 25139 9069 1 16 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.046 -1.158 25139 9070 1 16 . 1 1 107 107 ASP H H 107 8.638 8.638 8.621 0.017 25139 9071 1 16 . 1 1 108 108 ARG N N 108 117.895 117.895 118.974 -1.079 25139 9072 1 16 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.703 -0.213 25139 9073 1 16 . 1 1 108 108 ARG C C 108 176.111 176.111 176.795 -0.684 25139 9074 1 16 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.573 -0.308 25139 9075 1 16 . 1 1 108 108 ARG CB C 108 31.076 31.076 32.075 -0.999 25139 9076 1 16 . 1 1 108 108 ARG H H 108 7.905 7.905 8.158 -0.253 25139 9077 1 16 . 1 1 109 109 GLY N N 109 108.307 108.307 107.342 0.965 25139 9078 1 16 . 1 1 109 109 GLY C C 109 173.949 173.949 173.802 0.147 25139 9079 1 16 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.533 -0.982 25139 9080 1 16 . 1 1 109 109 GLY H H 109 7.753 7.753 8.272 -0.519 25139 9081 1 16 . 1 1 110 110 GLU N N 110 120.035 120.035 121.885 -1.850 25139 9082 1 16 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.568 -0.477 25139 9083 1 16 . 1 1 110 110 GLU C C 110 177.045 177.045 176.721 0.324 25139 9084 1 16 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.913 1.369 25139 9085 1 16 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.179 -0.506 25139 9086 1 16 . 1 1 110 110 GLU H H 110 8.509 8.509 8.576 -0.067 25139 9087 1 16 . 1 1 111 111 ASP N N 111 121.160 121.160 121.439 -0.279 25139 9088 1 16 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.521 0.050 25139 9089 1 16 . 1 1 111 111 ASP C C 111 175.089 175.089 176.284 -1.195 25139 9090 1 16 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.539 -1.948 25139 9091 1 16 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.562 1.870 25139 9092 1 16 . 1 1 111 111 ASP H H 111 8.916 8.916 8.604 0.312 25139 9093 1 16 . 1 1 112 112 ALA N N 112 122.130 122.130 119.257 2.873 25139 9094 1 16 . 1 1 112 112 ALA C C 112 178.120 178.120 175.492 2.628 25139 9095 1 16 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.392 2.867 25139 9096 1 16 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.295 -1.525 25139 9097 1 16 . 1 1 112 112 ALA H H 112 7.361 7.361 7.709 -0.348 25139 9098 1 16 . 1 1 113 113 ILE N N 113 113.780 113.780 115.290 -1.510 25139 9099 1 16 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.668 0.218 25139 9100 1 16 . 1 1 113 113 ILE C C 113 174.258 174.258 174.843 -0.585 25139 9101 1 16 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.310 0.202 25139 9102 1 16 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.770 0.078 25139 9103 1 16 . 1 1 113 113 ILE H H 113 7.667 7.667 8.206 -0.539 25139 9104 1 16 . 1 1 114 114 ALA N N 114 122.673 122.673 124.859 -2.186 25139 9105 1 16 . 1 1 114 114 ALA C C 114 176.984 176.984 176.724 0.260 25139 9106 1 16 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.187 -1.623 25139 9107 1 16 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.660 0.922 25139 9108 1 16 . 1 1 114 114 ALA H H 114 8.904 8.904 9.063 -0.159 25139 9109 1 16 . 1 1 115 115 ALA N N 115 116.486 116.486 116.534 -0.048 25139 9110 1 16 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.540 -0.185 25139 9111 1 16 . 1 1 115 115 ALA C C 115 174.138 174.138 174.092 0.046 25139 9112 1 16 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.701 1.619 25139 9113 1 16 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.096 1.887 25139 9114 1 16 . 1 1 115 115 ALA H H 115 7.182 7.182 7.271 -0.089 25139 9115 1 16 . 1 1 116 116 CYS N N 116 120.099 120.099 119.894 0.205 25139 9116 1 16 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.301 0.030 25139 9117 1 16 . 1 1 116 116 CYS C C 116 176.609 176.609 172.412 4.197 25139 9118 1 16 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.996 -3.047 25139 9119 1 16 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.356 12.028 25139 9120 1 16 . 1 1 116 116 CYS H H 116 8.298 8.298 7.862 0.436 25139 9121 1 16 . 1 1 117 117 PHE N N 117 126.406 126.406 126.207 0.199 25139 9122 1 16 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.230 -0.031 25139 9123 1 16 . 1 1 117 117 PHE C C 117 173.385 173.385 174.406 -1.021 25139 9124 1 16 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.142 0.112 25139 9125 1 16 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.563 0.118 25139 9126 1 16 . 1 1 117 117 PHE H H 117 9.712 9.712 9.144 0.568 25139 9127 1 16 . 1 1 118 118 LEU N N 118 122.119 122.119 123.687 -1.568 25139 9128 1 16 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.398 -0.232 25139 9129 1 16 . 1 1 118 118 LEU C C 118 175.097 175.097 176.129 -1.032 25139 9130 1 16 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.083 -0.179 25139 9131 1 16 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.521 -1.223 25139 9132 1 16 . 1 1 118 118 LEU H H 118 8.719 8.719 8.803 -0.084 25139 9133 1 16 . 1 1 119 119 ILE N N 119 125.324 125.324 122.132 3.192 25139 9134 1 16 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.931 -0.054 25139 9135 1 16 . 1 1 119 119 ILE C C 119 173.825 173.825 175.423 -1.598 25139 9136 1 16 . 1 1 119 119 ILE CA C 119 59.107 59.107 60.004 -0.897 25139 9137 1 16 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.540 -1.030 25139 9138 1 16 . 1 1 119 119 ILE H H 119 8.986 8.986 8.864 0.122 25139 9139 1 16 . 1 1 120 120 ASN N N 120 121.534 121.534 124.388 -2.854 25139 9140 1 16 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.779 0.611 25139 9141 1 16 . 1 1 120 120 ASN C C 120 176.098 176.098 176.086 0.012 25139 9142 1 16 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.314 -3.857 25139 9143 1 16 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.877 1.041 25139 9144 1 16 . 1 1 120 120 ASN H H 120 8.694 8.694 9.104 -0.410 25139 9145 1 16 . 1 1 121 121 CYS N N 121 122.779 122.779 116.469 6.310 25139 9146 1 16 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.154 0.329 25139 9147 1 16 . 1 1 121 121 CYS C C 121 173.195 173.195 173.482 -0.287 25139 9148 1 16 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.849 -4.085 25139 9149 1 16 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.531 16.176 25139 9150 1 16 . 1 1 121 121 CYS H H 121 10.668 10.668 8.616 2.052 25139 9151 1 16 . 1 1 122 122 LEU N N 122 121.063 121.063 117.370 3.693 25139 9152 1 16 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.480 -0.115 25139 9153 1 16 . 1 1 122 122 LEU C C 122 176.743 176.743 175.533 1.210 25139 9154 1 16 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.038 0.626 25139 9155 1 16 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.813 -1.579 25139 9156 1 16 . 1 1 122 122 LEU H H 122 8.256 8.256 7.627 0.629 25139 9157 1 16 . 1 1 123 123 TYR N N 123 123.081 123.081 122.678 0.403 25139 9158 1 16 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.745 -0.702 25139 9159 1 16 . 1 1 123 123 TYR C C 123 173.633 173.633 174.661 -1.028 25139 9160 1 16 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.307 -0.419 25139 9161 1 16 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.570 -0.489 25139 9162 1 16 . 1 1 123 123 TYR H H 123 8.990 8.990 8.955 0.035 25139 9163 1 16 . 1 1 124 124 GLU N N 124 128.742 128.742 126.675 2.067 25139 9164 1 16 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.739 -0.189 25139 9165 1 16 . 1 1 124 124 GLU C C 124 174.835 174.835 175.496 -0.661 25139 9166 1 16 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.462 0.170 25139 9167 1 16 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.321 -0.426 25139 9168 1 16 . 1 1 124 124 GLU H H 124 9.135 9.135 8.822 0.313 25139 9169 1 16 . 1 1 125 125 GLN N N 125 108.066 108.066 109.938 -1.872 25139 9170 1 16 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.932 -0.211 25139 9171 1 16 . 1 1 125 125 GLN C C 125 174.627 174.627 174.875 -0.248 25139 9172 1 16 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.298 0.741 25139 9173 1 16 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.738 -0.411 25139 9174 1 16 . 1 1 125 125 GLN H H 125 8.390 8.390 8.588 -0.198 25139 9175 1 16 . 1 1 126 126 ASN N N 126 118.528 118.528 117.578 0.950 25139 9176 1 16 . 1 1 126 126 ASN C C 126 173.713 173.713 174.722 -1.009 25139 9177 1 16 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.014 0.175 25139 9178 1 16 . 1 1 126 126 ASN CB C 126 40.801 40.801 40.259 0.542 25139 9179 1 16 . 1 1 126 126 ASN H H 126 8.092 8.092 7.970 0.122 25139 9180 1 16 . 1 1 127 127 PHE N N 127 124.680 124.680 122.560 2.120 25139 9181 1 16 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.762 0.275 25139 9182 1 16 . 1 1 127 127 PHE C C 127 177.125 177.125 176.585 0.540 25139 9183 1 16 . 1 1 127 127 PHE CA C 127 58.413 58.413 56.858 1.555 25139 9184 1 16 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.071 1.173 25139 9185 1 16 . 1 1 127 127 PHE H H 127 9.026 9.026 8.881 0.145 25139 9186 1 16 . 1 1 128 128 VAL N N 128 119.455 119.455 118.186 1.269 25139 9187 1 16 . 1 1 128 128 VAL C C 128 175.886 175.886 175.973 -0.087 25139 9188 1 16 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.848 -0.929 25139 9189 1 16 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.558 2.636 25139 9190 1 16 . 1 1 128 128 VAL H H 128 8.364 8.364 7.741 0.623 25139 9191 1 16 . 1 1 129 129 CYS N N 129 116.130 116.130 120.857 -4.727 25139 9192 1 16 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.858 -0.381 25139 9193 1 16 . 1 1 129 129 CYS C C 129 170.569 170.569 173.626 -3.057 25139 9194 1 16 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.818 -3.668 25139 9195 1 16 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.777 18.840 25139 9196 1 16 . 1 1 129 129 CYS H H 129 5.390 5.390 7.114 -1.724 25139 9197 1 16 . 1 1 130 130 LYS N N 130 120.071 120.071 125.217 -5.146 25139 9198 1 16 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.062 0.499 25139 9199 1 16 . 1 1 130 130 LYS C C 130 176.853 176.853 174.363 2.490 25139 9200 1 16 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.507 -0.620 25139 9201 1 16 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.307 1.335 25139 9202 1 16 . 1 1 130 130 LYS H H 130 8.066 8.066 7.748 0.318 25139 9203 1 16 . 1 1 131 131 PHE N N 131 118.415 118.415 119.872 -1.457 25139 9204 1 16 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.430 -0.823 25139 9205 1 16 . 1 1 131 131 PHE C C 131 174.013 174.013 175.289 -1.276 25139 9206 1 16 . 1 1 131 131 PHE CA C 131 57.711 57.711 55.986 1.725 25139 9207 1 16 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.145 0.935 25139 9208 1 16 . 1 1 131 131 PHE H H 131 8.714 8.714 8.154 0.560 25139 9209 1 16 . 1 1 132 132 ALA N N 132 124.209 124.209 122.739 1.470 25139 9210 1 16 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.008 -0.391 25139 9211 1 16 . 1 1 132 132 ALA C C 132 174.352 174.352 174.333 0.019 25139 9212 1 16 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.547 1.894 25139 9213 1 16 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.866 -0.402 25139 9214 1 16 . 1 1 132 132 ALA H H 132 9.295 9.295 9.091 0.204 25139 9215 1 16 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.395 -0.512 25139 9216 1 16 . 1 1 133 133 PRO C C 133 173.923 173.923 176.342 -2.419 25139 9217 1 16 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.672 0.399 25139 9218 1 16 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.355 -0.752 25139 9219 1 16 . 1 1 134 134 ARG N N 134 126.071 126.071 122.635 3.436 25139 9220 1 16 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.650 -0.395 25139 9221 1 16 . 1 1 134 134 ARG C C 134 177.065 177.065 174.557 2.508 25139 9222 1 16 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.080 2.084 25139 9223 1 16 . 1 1 134 134 ARG CB C 134 32.183 32.183 34.625 -2.442 25139 9224 1 16 . 1 1 134 134 ARG H H 134 8.672 8.672 8.944 -0.272 25139 9225 1 16 . 1 1 135 135 GLU N N 135 125.683 125.683 120.727 4.956 25139 9226 1 16 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.623 -0.270 25139 9227 1 16 . 1 1 135 135 GLU C C 135 178.081 178.081 176.383 1.698 25139 9228 1 16 . 1 1 135 135 GLU CA C 135 57.651 57.651 56.096 1.555 25139 9229 1 16 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.937 0.059 25139 9230 1 16 . 1 1 135 135 GLU H H 135 8.603 8.603 8.815 -0.212 25139 9231 1 16 . 1 1 136 136 GLY N N 136 110.031 110.031 112.031 -2.000 25139 9232 1 16 . 1 1 136 136 GLY C C 136 173.079 173.079 174.597 -1.518 25139 9233 1 16 . 1 1 136 136 GLY CA C 136 45.778 45.778 45.195 0.583 25139 9234 1 16 . 1 1 136 136 GLY H H 136 9.036 9.036 8.740 0.296 25139 9235 1 16 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.418 1.257 25139 9236 1 16 . 1 1 137 137 PHE C C 137 174.936 174.936 175.591 -0.655 25139 9237 1 16 . 1 1 137 137 PHE CA C 137 56.084 56.084 59.195 -3.111 25139 9238 1 16 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.701 4.995 25139 9239 1 16 . 1 1 138 138 ILE N N 138 117.417 117.417 114.711 2.706 25139 9240 1 16 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.702 -0.195 25139 9241 1 16 . 1 1 138 138 ILE C C 138 173.858 173.858 173.728 0.130 25139 9242 1 16 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.302 1.318 25139 9243 1 16 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.519 1.078 25139 9244 1 16 . 1 1 138 138 ILE H H 138 8.777 8.777 7.873 0.904 25139 9245 1 16 . 1 1 139 139 ASN N N 139 117.201 117.201 117.108 0.093 25139 9246 1 16 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.375 0.684 25139 9247 1 16 . 1 1 139 139 ASN C C 139 173.721 173.721 173.935 -0.214 25139 9248 1 16 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.716 -1.486 25139 9249 1 16 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.255 1.606 25139 9250 1 16 . 1 1 139 139 ASN H H 139 8.872 8.872 8.186 0.686 25139 9251 1 16 . 1 1 140 140 TYR N N 140 123.991 123.991 119.634 4.357 25139 9252 1 16 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.775 0.403 25139 9253 1 16 . 1 1 140 140 TYR C C 140 174.791 174.791 175.161 -0.370 25139 9254 1 16 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.421 -1.349 25139 9255 1 16 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.734 1.936 25139 9256 1 16 . 1 1 140 140 TYR H H 140 9.526 9.526 8.724 0.802 25139 9257 1 16 . 1 1 141 141 LEU N N 141 122.779 122.779 120.909 1.870 25139 9258 1 16 . 1 1 141 141 LEU C C 141 175.404 175.404 177.423 -2.019 25139 9259 1 16 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.778 2.325 25139 9260 1 16 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.277 -1.116 25139 9261 1 16 . 1 1 141 141 LEU H H 141 9.010 9.010 9.047 -0.037 25139 9262 1 16 . 1 1 142 142 THR N N 142 113.189 113.189 112.407 0.782 25139 9263 1 16 . 1 1 142 142 THR HA H 142 4.061 4.061 4.184 -0.123 25139 9264 1 16 . 1 1 142 142 THR C C 142 175.940 175.940 175.969 -0.029 25139 9265 1 16 . 1 1 142 142 THR CA C 142 61.389 61.389 60.573 0.816 25139 9266 1 16 . 1 1 142 142 THR CB C 142 69.779 69.779 70.349 -0.570 25139 9267 1 16 . 1 1 142 142 THR H H 142 7.737 7.737 8.106 -0.369 25139 9268 1 16 . 1 1 143 143 ARG N N 143 120.975 120.975 120.082 0.893 25139 9269 1 16 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.007 -0.069 25139 9270 1 16 . 1 1 143 143 ARG C C 143 178.690 178.690 178.332 0.358 25139 9271 1 16 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.854 -0.106 25139 9272 1 16 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.843 0.302 25139 9273 1 16 . 1 1 143 143 ARG H H 143 8.149 8.149 8.908 -0.759 25139 9274 1 16 . 1 1 144 144 GLU N N 144 116.997 116.997 118.561 -1.564 25139 9275 1 16 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.241 -0.132 25139 9276 1 16 . 1 1 144 144 GLU C C 144 178.442 178.442 178.391 0.051 25139 9277 1 16 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.671 1.192 25139 9278 1 16 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.931 -0.349 25139 9279 1 16 . 1 1 144 144 GLU H H 144 8.622 8.622 7.714 0.908 25139 9280 1 16 . 1 1 145 145 VAL N N 145 111.213 111.213 115.422 -4.209 25139 9281 1 16 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.966 0.445 25139 9282 1 16 . 1 1 145 145 VAL C C 145 176.965 176.965 176.921 0.044 25139 9283 1 16 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.603 -1.009 25139 9284 1 16 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.800 0.281 25139 9285 1 16 . 1 1 145 145 VAL H H 145 7.227 7.227 7.479 -0.252 25139 9286 1 16 . 1 1 146 146 TYR N N 146 123.512 123.512 121.808 1.704 25139 9287 1 16 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.085 -0.205 25139 9288 1 16 . 1 1 146 146 TYR C C 146 176.377 176.377 176.939 -0.562 25139 9289 1 16 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.418 0.119 25139 9290 1 16 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.660 -0.321 25139 9291 1 16 . 1 1 146 146 TYR H H 146 8.492 8.492 8.785 -0.293 25139 9292 1 16 . 1 1 147 147 ARG N N 147 116.680 116.680 117.957 -1.277 25139 9293 1 16 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.769 0.045 25139 9294 1 16 . 1 1 147 147 ARG C C 147 178.858 178.858 178.003 0.855 25139 9295 1 16 . 1 1 147 147 ARG CA C 147 59.696 59.696 60.124 -0.428 25139 9296 1 16 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.826 -0.161 25139 9297 1 16 . 1 1 147 147 ARG H H 147 8.053 8.053 8.496 -0.443 25139 9298 1 16 . 1 1 148 148 SER N N 148 115.306 115.306 114.772 0.534 25139 9299 1 16 . 1 1 148 148 SER HA H 148 3.998 3.998 4.453 -0.455 25139 9300 1 16 . 1 1 148 148 SER C C 148 175.786 175.786 175.875 -0.089 25139 9301 1 16 . 1 1 148 148 SER CA C 148 62.006 62.006 60.561 1.445 25139 9302 1 16 . 1 1 148 148 SER H H 148 7.139 7.139 7.472 -0.333 25139 9303 1 16 . 1 1 149 149 TYR N N 149 123.207 123.207 122.449 0.758 25139 9304 1 16 . 1 1 149 149 TYR C C 149 175.831 175.831 176.355 -0.524 25139 9305 1 16 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.260 -0.660 25139 9306 1 16 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.580 0.201 25139 9307 1 16 . 1 1 149 149 TYR H H 149 7.253 7.253 7.536 -0.283 25139 9308 1 16 . 1 1 150 150 ARG N N 150 118.708 118.708 116.132 2.576 25139 9309 1 16 . 1 1 150 150 ARG HA H 150 3.346 3.346 4.017 -0.671 25139 9310 1 16 . 1 1 150 150 ARG C C 150 177.644 177.644 177.882 -0.238 25139 9311 1 16 . 1 1 150 150 ARG CA C 150 57.323 57.323 56.710 0.613 25139 9312 1 16 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.756 -0.902 25139 9313 1 16 . 1 1 150 150 ARG H H 150 8.441 8.441 7.554 0.887 25139 9314 1 16 . 1 1 151 151 GLN N N 151 116.551 116.551 118.008 -1.457 25139 9315 1 16 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.245 -0.288 25139 9316 1 16 . 1 1 151 151 GLN C C 151 177.987 177.987 177.001 0.986 25139 9317 1 16 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.751 -0.410 25139 9318 1 16 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.224 0.240 25139 9319 1 16 . 1 1 151 151 GLN H H 151 7.332 7.332 7.782 -0.450 25139 9320 1 16 . 1 1 152 152 LEU N N 152 118.877 118.877 114.494 4.383 25139 9321 1 16 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.694 -0.515 25139 9322 1 16 . 1 1 152 152 LEU C C 152 179.070 179.070 176.939 2.131 25139 9323 1 16 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.233 0.849 25139 9324 1 16 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.220 -0.532 25139 9325 1 16 . 1 1 152 152 LEU H H 152 7.106 7.106 7.530 -0.424 25139 9326 1 16 . 1 1 153 153 VAL N N 153 119.076 119.076 112.233 6.843 25139 9327 1 16 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.102 -1.242 25139 9328 1 16 . 1 1 153 153 VAL C C 153 177.421 177.421 176.550 0.871 25139 9329 1 16 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.382 2.201 25139 9330 1 16 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.365 -1.847 25139 9331 1 16 . 1 1 153 153 VAL H H 153 7.427 7.427 7.175 0.252 25139 9332 1 16 . 1 1 154 154 ASP N N 154 119.888 119.888 120.153 -0.265 25139 9333 1 16 . 1 1 154 154 ASP C C 154 177.422 177.422 175.546 1.876 25139 9334 1 16 . 1 1 154 154 ASP CA C 154 56.071 56.071 55.341 0.730 25139 9335 1 16 . 1 1 154 154 ASP CB C 154 40.349 40.349 40.999 -0.650 25139 9336 1 16 . 1 1 154 154 ASP H H 154 7.930 7.930 7.822 0.108 25139 9337 1 16 . 1 1 155 155 HIS N N 155 117.821 117.821 116.690 1.131 25139 9338 1 16 . 1 1 155 155 HIS CA C 155 57.756 57.756 54.790 2.966 25139 9339 1 16 . 1 1 155 155 HIS CB C 155 30.180 30.180 31.839 -1.659 25139 9340 1 16 . 1 1 155 155 HIS H H 155 7.680 7.680 7.579 0.101 25139 9341 1 16 . 1 1 156 156 HIS N N 156 119.180 119.180 121.056 -1.876 25139 9342 1 16 . 1 1 156 156 HIS CA C 156 57.931 57.931 56.900 1.031 25139 9343 1 16 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.020 0.280 25139 9344 1 16 . 1 1 156 156 HIS H H 156 7.868 7.868 8.415 -0.547 25139 9345 1 17 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.204 0.700 25139 9346 1 17 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.859 0.363 25139 9347 1 17 . 1 1 49 49 ASP N N 49 119.661 119.661 119.408 0.253 25139 9348 1 17 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.393 -0.116 25139 9349 1 17 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.166 -0.104 25139 9350 1 17 . 1 1 49 49 ASP H H 49 8.462 8.462 7.708 0.754 25139 9351 1 17 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.266 -0.214 25139 9352 1 17 . 1 1 51 51 LEU C C 51 178.514 178.514 179.244 -0.730 25139 9353 1 17 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.030 1.019 25139 9354 1 17 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.115 0.078 25139 9355 1 17 . 1 1 52 52 ASN N N 52 113.819 113.819 117.004 -3.185 25139 9356 1 17 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.642 0.193 25139 9357 1 17 . 1 1 52 52 ASN C C 52 175.964 175.964 176.441 -0.477 25139 9358 1 17 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.015 -0.919 25139 9359 1 17 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.039 -0.157 25139 9360 1 17 . 1 1 52 52 ASN H H 52 7.853 7.853 7.995 -0.142 25139 9361 1 17 . 1 1 53 53 SER N N 53 114.357 114.357 113.316 1.041 25139 9362 1 17 . 1 1 53 53 SER CA C 53 59.908 59.908 59.232 0.676 25139 9363 1 17 . 1 1 53 53 SER CB C 53 64.395 64.395 63.806 0.589 25139 9364 1 17 . 1 1 53 53 SER H H 53 8.023 8.023 7.835 0.188 25139 9365 1 17 . 1 1 54 54 PHE N N 54 121.037 121.037 120.817 0.220 25139 9366 1 17 . 1 1 54 54 PHE C C 54 175.522 175.522 176.094 -0.572 25139 9367 1 17 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.201 0.863 25139 9368 1 17 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.254 -0.201 25139 9369 1 17 . 1 1 54 54 PHE H H 54 7.731 7.731 7.684 0.047 25139 9370 1 17 . 1 1 55 55 THR N N 55 116.535 116.535 117.778 -1.243 25139 9371 1 17 . 1 1 55 55 THR HA H 55 4.654 4.654 4.735 -0.081 25139 9372 1 17 . 1 1 55 55 THR C C 55 173.301 173.301 174.048 -0.747 25139 9373 1 17 . 1 1 55 55 THR CA C 55 61.420 61.420 60.670 0.750 25139 9374 1 17 . 1 1 55 55 THR CB C 55 71.388 71.388 71.846 -0.458 25139 9375 1 17 . 1 1 55 55 THR H H 55 8.929 8.929 8.878 0.051 25139 9376 1 17 . 1 1 56 56 ALA N N 56 129.359 129.359 128.020 1.339 25139 9377 1 17 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.599 0.716 25139 9378 1 17 . 1 1 56 56 ALA C C 56 178.305 178.305 177.767 0.538 25139 9379 1 17 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.048 0.822 25139 9380 1 17 . 1 1 56 56 ALA CB C 56 19.324 19.324 17.791 1.533 25139 9381 1 17 . 1 1 56 56 ALA H H 56 8.907 8.907 8.702 0.205 25139 9382 1 17 . 1 1 57 57 GLY N N 57 106.331 106.331 105.928 0.403 25139 9383 1 17 . 1 1 57 57 GLY CA C 57 44.611 44.611 44.965 -0.354 25139 9384 1 17 . 1 1 57 57 GLY H H 57 7.978 7.978 7.525 0.453 25139 9385 1 17 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.382 -0.058 25139 9386 1 17 . 1 1 59 59 PRO C C 59 177.466 177.466 177.605 -0.139 25139 9387 1 17 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.394 1.090 25139 9388 1 17 . 1 1 59 59 PRO CB C 59 31.735 31.735 31.979 -0.244 25139 9389 1 17 . 1 1 60 60 GLY N N 60 109.688 109.688 109.859 -0.171 25139 9390 1 17 . 1 1 60 60 GLY C C 60 173.555 173.555 172.924 0.631 25139 9391 1 17 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.855 0.686 25139 9392 1 17 . 1 1 60 60 GLY H H 60 8.402 8.402 8.792 -0.390 25139 9393 1 17 . 1 1 61 61 PHE N N 61 122.491 122.491 121.615 0.876 25139 9394 1 17 . 1 1 61 61 PHE C C 61 175.146 175.146 174.730 0.416 25139 9395 1 17 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.778 1.504 25139 9396 1 17 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.156 -2.457 25139 9397 1 17 . 1 1 61 61 PHE H H 61 7.957 7.957 7.515 0.442 25139 9398 1 17 . 1 1 62 62 VAL N N 62 121.128 121.128 118.082 3.046 25139 9399 1 17 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.346 -0.261 25139 9400 1 17 . 1 1 62 62 VAL C C 62 174.937 174.937 174.650 0.287 25139 9401 1 17 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.526 0.181 25139 9402 1 17 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.587 0.845 25139 9403 1 17 . 1 1 62 62 VAL H H 62 7.994 7.994 8.851 -0.857 25139 9404 1 17 . 1 1 63 63 LEU N N 63 124.386 124.386 122.693 1.693 25139 9405 1 17 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.214 -0.898 25139 9406 1 17 . 1 1 63 63 LEU C C 63 175.278 175.278 176.485 -1.207 25139 9407 1 17 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.317 0.971 25139 9408 1 17 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.530 1.588 25139 9409 1 17 . 1 1 63 63 LEU H H 63 7.572 7.572 8.329 -0.757 25139 9410 1 17 . 1 1 64 64 ASP N N 64 126.746 126.746 129.846 -3.100 25139 9411 1 17 . 1 1 64 64 ASP C C 64 177.801 177.801 176.506 1.295 25139 9412 1 17 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.106 -2.385 25139 9413 1 17 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.216 0.182 25139 9414 1 17 . 1 1 64 64 ASP H H 64 8.552 8.552 8.397 0.155 25139 9415 1 17 . 1 1 65 65 THR C C 65 175.002 175.002 175.523 -0.521 25139 9416 1 17 . 1 1 65 65 THR CB C 65 67.919 67.919 68.683 -0.764 25139 9417 1 17 . 1 1 66 66 GLN N N 66 120.804 120.804 119.229 1.575 25139 9418 1 17 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.198 -0.321 25139 9419 1 17 . 1 1 66 66 GLN C C 66 178.901 178.901 176.178 2.723 25139 9420 1 17 . 1 1 66 66 GLN CA C 66 59.416 59.416 57.870 1.546 25139 9421 1 17 . 1 1 66 66 GLN CB C 66 27.924 27.924 27.720 0.204 25139 9422 1 17 . 1 1 66 66 GLN H H 66 8.447 8.447 8.245 0.202 25139 9423 1 17 . 1 1 67 67 ALA N N 67 121.267 121.267 121.519 -0.252 25139 9424 1 17 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.323 -0.366 25139 9425 1 17 . 1 1 67 67 ALA C C 67 176.777 176.777 178.750 -1.973 25139 9426 1 17 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.646 0.678 25139 9427 1 17 . 1 1 67 67 ALA CB C 67 18.620 18.620 19.363 -0.743 25139 9428 1 17 . 1 1 67 67 ALA H H 67 7.791 7.791 7.436 0.355 25139 9429 1 17 . 1 1 68 68 SER N N 68 113.339 113.339 114.329 -0.990 25139 9430 1 17 . 1 1 68 68 SER HA H 68 4.061 4.061 4.128 -0.067 25139 9431 1 17 . 1 1 68 68 SER C C 68 175.875 175.875 176.282 -0.407 25139 9432 1 17 . 1 1 68 68 SER CA C 68 62.970 62.970 62.050 0.920 25139 9433 1 17 . 1 1 68 68 SER CB C 68 61.330 61.330 63.653 -2.323 25139 9434 1 17 . 1 1 68 68 SER H H 68 7.785 7.785 7.919 -0.134 25139 9435 1 17 . 1 1 69 69 VAL N N 69 125.140 125.140 116.970 8.170 25139 9436 1 17 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.226 -0.150 25139 9437 1 17 . 1 1 69 69 VAL C C 69 176.384 176.384 176.787 -0.403 25139 9438 1 17 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.444 1.287 25139 9439 1 17 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.606 -0.117 25139 9440 1 17 . 1 1 69 69 VAL H H 69 8.572 8.572 7.822 0.750 25139 9441 1 17 . 1 1 70 70 SER N N 70 116.704 116.704 113.583 3.121 25139 9442 1 17 . 1 1 70 70 SER HA H 70 4.229 4.229 4.221 0.008 25139 9443 1 17 . 1 1 70 70 SER C C 70 174.101 174.101 175.104 -1.003 25139 9444 1 17 . 1 1 70 70 SER CA C 70 61.627 61.627 59.816 1.811 25139 9445 1 17 . 1 1 70 70 SER H H 70 7.951 7.951 7.978 -0.027 25139 9446 1 17 . 1 1 71 71 ASN N N 71 117.576 117.576 117.290 0.286 25139 9447 1 17 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.695 0.107 25139 9448 1 17 . 1 1 71 71 ASN C C 71 174.332 174.332 174.841 -0.509 25139 9449 1 17 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.717 -0.278 25139 9450 1 17 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.956 0.510 25139 9451 1 17 . 1 1 71 71 ASN H H 71 7.131 7.131 7.460 -0.329 25139 9452 1 17 . 1 1 72 72 GLY N N 72 103.925 103.925 105.445 -1.520 25139 9453 1 17 . 1 1 72 72 GLY C C 72 174.710 174.710 173.487 1.223 25139 9454 1 17 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.446 0.103 25139 9455 1 17 . 1 1 72 72 GLY H H 72 7.338 7.338 7.331 0.007 25139 9456 1 17 . 1 1 73 73 ALA N N 73 124.942 124.942 123.609 1.333 25139 9457 1 17 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.481 -0.309 25139 9458 1 17 . 1 1 73 73 ALA C C 73 175.896 175.896 176.049 -0.153 25139 9459 1 17 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.888 0.785 25139 9460 1 17 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.137 -0.080 25139 9461 1 17 . 1 1 73 73 ALA H H 73 8.032 8.032 7.715 0.317 25139 9462 1 17 . 1 1 74 74 THR N N 74 113.423 113.423 116.103 -2.680 25139 9463 1 17 . 1 1 74 74 THR HA H 74 4.678 4.678 4.582 0.096 25139 9464 1 17 . 1 1 74 74 THR C C 74 173.339 173.339 173.222 0.117 25139 9465 1 17 . 1 1 74 74 THR CA C 74 61.545 61.545 61.355 0.190 25139 9466 1 17 . 1 1 74 74 THR CB C 74 71.319 71.319 71.196 0.123 25139 9467 1 17 . 1 1 74 74 THR H H 74 8.530 8.530 8.304 0.226 25139 9468 1 17 . 1 1 75 75 PHE N N 75 128.180 128.180 130.206 -2.026 25139 9469 1 17 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.910 -0.306 25139 9470 1 17 . 1 1 75 75 PHE C C 75 174.623 174.623 174.884 -0.261 25139 9471 1 17 . 1 1 75 75 PHE CA C 75 57.616 57.616 56.138 1.478 25139 9472 1 17 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.464 0.211 25139 9473 1 17 . 1 1 75 75 PHE H H 75 9.146 9.146 9.122 0.024 25139 9474 1 17 . 1 1 76 76 LEU N N 76 127.849 127.849 125.420 2.429 25139 9475 1 17 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.479 -0.128 25139 9476 1 17 . 1 1 76 76 LEU C C 76 176.339 176.339 176.448 -0.109 25139 9477 1 17 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.575 0.408 25139 9478 1 17 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.276 0.054 25139 9479 1 17 . 1 1 76 76 LEU H H 76 8.635 8.635 8.077 0.558 25139 9480 1 17 . 1 1 77 77 GLU N N 77 115.131 115.131 119.610 -4.479 25139 9481 1 17 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.417 -0.009 25139 9482 1 17 . 1 1 77 77 GLU C C 77 174.734 174.734 174.392 0.342 25139 9483 1 17 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.504 0.849 25139 9484 1 17 . 1 1 77 77 GLU CB C 77 33.207 33.207 33.151 0.056 25139 9485 1 17 . 1 1 77 77 GLU H H 77 7.252 7.252 7.499 -0.247 25139 9486 1 17 . 1 1 78 78 SER N N 78 118.016 118.016 119.576 -1.560 25139 9487 1 17 . 1 1 78 78 SER HA H 78 5.561 5.561 5.163 0.398 25139 9488 1 17 . 1 1 78 78 SER C C 78 171.968 171.968 173.160 -1.192 25139 9489 1 17 . 1 1 78 78 SER CA C 78 54.061 54.061 54.820 -0.759 25139 9490 1 17 . 1 1 78 78 SER CB C 78 64.074 64.074 62.707 1.367 25139 9491 1 17 . 1 1 78 78 SER H H 78 9.033 9.033 8.699 0.334 25139 9492 1 17 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.724 -1.124 25139 9493 1 17 . 1 1 79 79 PRO CB C 79 32.410 32.410 31.936 0.473 25139 9494 1 17 . 1 1 80 80 THR N N 80 118.079 118.079 112.136 5.943 25139 9495 1 17 . 1 1 80 80 THR HA H 80 4.342 4.342 3.801 0.541 25139 9496 1 17 . 1 1 80 80 THR C C 80 174.494 174.494 174.321 0.173 25139 9497 1 17 . 1 1 80 80 THR CA C 80 61.453 61.453 62.819 -1.366 25139 9498 1 17 . 1 1 80 80 THR CB C 80 67.797 67.797 68.209 -0.412 25139 9499 1 17 . 1 1 80 80 THR H H 80 8.670 8.670 7.839 0.831 25139 9500 1 17 . 1 1 81 81 VAL N N 81 117.395 117.395 113.415 3.980 25139 9501 1 17 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.935 0.672 25139 9502 1 17 . 1 1 81 81 VAL C C 81 175.518 175.518 176.337 -0.819 25139 9503 1 17 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.014 -2.901 25139 9504 1 17 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.429 2.166 25139 9505 1 17 . 1 1 81 81 VAL H H 81 7.448 7.448 7.396 0.052 25139 9506 1 17 . 1 1 82 82 ARG N N 82 117.852 117.852 119.756 -1.904 25139 9507 1 17 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.520 0.001 25139 9508 1 17 . 1 1 82 82 ARG C C 82 176.992 176.992 175.746 1.246 25139 9509 1 17 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.869 0.516 25139 9510 1 17 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.487 1.115 25139 9511 1 17 . 1 1 82 82 ARG H H 82 8.710 8.710 8.677 0.033 25139 9512 1 17 . 1 1 83 83 ARG N N 83 117.035 117.035 118.287 -1.252 25139 9513 1 17 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.664 0.658 25139 9514 1 17 . 1 1 83 83 ARG C C 83 177.379 177.379 176.831 0.548 25139 9515 1 17 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.456 -0.772 25139 9516 1 17 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.820 -0.779 25139 9517 1 17 . 1 1 83 83 ARG H H 83 7.292 7.292 7.685 -0.393 25139 9518 1 17 . 1 1 84 84 GLY N N 84 114.911 114.911 110.376 4.535 25139 9519 1 17 . 1 1 84 84 GLY C C 84 176.940 176.940 175.287 1.653 25139 9520 1 17 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.904 1.768 25139 9521 1 17 . 1 1 84 84 GLY H H 84 9.255 9.255 8.913 0.342 25139 9522 1 17 . 1 1 85 85 TRP N N 85 121.810 121.810 120.697 1.113 25139 9523 1 17 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.348 -0.181 25139 9524 1 17 . 1 1 85 85 TRP C C 85 178.272 178.272 177.438 0.834 25139 9525 1 17 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.406 1.639 25139 9526 1 17 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.306 -0.089 25139 9527 1 17 . 1 1 85 85 TRP H H 85 9.963 9.963 7.820 2.143 25139 9528 1 17 . 1 1 86 86 ASP N N 86 116.400 116.400 120.793 -4.393 25139 9529 1 17 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.492 -0.099 25139 9530 1 17 . 1 1 86 86 ASP C C 86 178.803 178.803 177.784 1.019 25139 9531 1 17 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.789 0.265 25139 9532 1 17 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.215 0.518 25139 9533 1 17 . 1 1 86 86 ASP H H 86 6.934 6.934 7.659 -0.725 25139 9534 1 17 . 1 1 87 87 CYS N N 87 122.454 122.454 119.157 3.297 25139 9535 1 17 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.261 -0.011 25139 9536 1 17 . 1 1 87 87 CYS C C 87 174.956 174.956 176.628 -1.672 25139 9537 1 17 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.315 -4.168 25139 9538 1 17 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.224 11.261 25139 9539 1 17 . 1 1 87 87 CYS H H 87 7.603 7.603 7.471 0.132 25139 9540 1 17 . 1 1 88 88 VAL N N 88 119.192 119.192 120.587 -1.395 25139 9541 1 17 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.358 -0.900 25139 9542 1 17 . 1 1 88 88 VAL C C 88 177.413 177.413 176.498 0.915 25139 9543 1 17 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.004 1.972 25139 9544 1 17 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.295 -1.053 25139 9545 1 17 . 1 1 88 88 VAL H H 88 7.192 7.192 7.157 0.035 25139 9546 1 17 . 1 1 89 89 ARG N N 89 118.185 118.185 119.386 -1.201 25139 9547 1 17 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.902 -0.222 25139 9548 1 17 . 1 1 89 89 ARG C C 89 178.677 178.677 178.008 0.669 25139 9549 1 17 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.158 0.797 25139 9550 1 17 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.238 0.553 25139 9551 1 17 . 1 1 89 89 ARG H H 89 7.971 7.971 7.686 0.285 25139 9552 1 17 . 1 1 90 90 ALA N N 90 120.815 120.815 122.216 -1.401 25139 9553 1 17 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.150 -0.075 25139 9554 1 17 . 1 1 90 90 ALA C C 90 177.416 177.416 178.871 -1.455 25139 9555 1 17 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.585 -0.331 25139 9556 1 17 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.186 -0.750 25139 9557 1 17 . 1 1 90 90 ALA H H 90 7.453 7.453 7.535 -0.082 25139 9558 1 17 . 1 1 91 91 CYS N N 91 120.380 120.380 116.169 4.211 25139 9559 1 17 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.193 0.178 25139 9560 1 17 . 1 1 91 91 CYS C C 91 176.654 176.654 175.968 0.686 25139 9561 1 17 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.748 -4.053 25139 9562 1 17 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.193 12.511 25139 9563 1 17 . 1 1 91 91 CYS H H 91 7.944 7.944 7.503 0.441 25139 9564 1 17 . 1 1 92 92 CYS N N 92 116.270 116.270 119.066 -2.796 25139 9565 1 17 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.509 -0.105 25139 9566 1 17 . 1 1 92 92 CYS C C 92 175.628 175.628 176.595 -0.967 25139 9567 1 17 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.495 -2.789 25139 9568 1 17 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.912 15.237 25139 9569 1 17 . 1 1 92 92 CYS H H 92 8.315 8.315 7.686 0.629 25139 9570 1 17 . 1 1 93 93 THR N N 93 107.283 107.283 109.681 -2.398 25139 9571 1 17 . 1 1 93 93 THR HA H 93 4.481 4.481 4.245 0.236 25139 9572 1 17 . 1 1 93 93 THR C C 93 173.606 173.606 175.503 -1.897 25139 9573 1 17 . 1 1 93 93 THR CA C 93 61.402 61.402 64.058 -2.656 25139 9574 1 17 . 1 1 93 93 THR CB C 93 69.046 69.046 68.757 0.289 25139 9575 1 17 . 1 1 93 93 THR H H 93 7.445 7.445 7.332 0.113 25139 9576 1 17 . 1 1 94 94 THR N N 94 121.432 121.432 121.277 0.155 25139 9577 1 17 . 1 1 94 94 THR HA H 94 4.398 4.398 4.464 -0.066 25139 9578 1 17 . 1 1 94 94 THR C C 94 173.493 173.493 175.141 -1.648 25139 9579 1 17 . 1 1 94 94 THR CA C 94 62.726 62.726 62.733 -0.007 25139 9580 1 17 . 1 1 94 94 THR CB C 94 69.704 69.704 68.554 1.150 25139 9581 1 17 . 1 1 94 94 THR H H 94 7.553 7.553 7.989 -0.436 25139 9582 1 17 . 1 1 95 95 GLN N N 95 129.410 129.410 128.381 1.029 25139 9583 1 17 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.017 -0.073 25139 9584 1 17 . 1 1 95 95 GLN C C 95 176.293 176.293 176.501 -0.208 25139 9585 1 17 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.643 -0.603 25139 9586 1 17 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.958 -0.702 25139 9587 1 17 . 1 1 95 95 GLN H H 95 8.812 8.812 8.949 -0.137 25139 9588 1 17 . 1 1 96 96 ASN N N 96 115.015 115.015 114.529 0.486 25139 9589 1 17 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.828 -0.629 25139 9590 1 17 . 1 1 96 96 ASN C C 96 172.260 172.260 173.712 -1.452 25139 9591 1 17 . 1 1 96 96 ASN CA C 96 55.567 55.567 53.152 2.415 25139 9592 1 17 . 1 1 96 96 ASN CB C 96 36.837 36.837 39.095 -2.258 25139 9593 1 17 . 1 1 96 96 ASN H H 96 8.791 8.791 8.133 0.658 25139 9594 1 17 . 1 1 97 97 CYS N N 97 115.830 115.830 120.837 -5.007 25139 9595 1 17 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.486 -0.385 25139 9596 1 17 . 1 1 97 97 CYS C C 97 175.025 175.025 174.019 1.006 25139 9597 1 17 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.633 -1.484 25139 9598 1 17 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.995 16.239 25139 9599 1 17 . 1 1 97 97 CYS H H 97 7.651 7.651 7.904 -0.253 25139 9600 1 17 . 1 1 98 98 ASN N N 98 125.148 125.148 125.109 0.039 25139 9601 1 17 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.064 0.069 25139 9602 1 17 . 1 1 98 98 ASN C C 98 171.892 171.892 174.097 -2.205 25139 9603 1 17 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.617 -0.423 25139 9604 1 17 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.641 -1.693 25139 9605 1 17 . 1 1 98 98 ASN H H 98 8.736 8.736 8.504 0.232 25139 9606 1 17 . 1 1 99 99 LEU N N 99 120.898 120.898 121.192 -0.294 25139 9607 1 17 . 1 1 99 99 LEU C C 99 173.084 173.084 174.010 -0.926 25139 9608 1 17 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.967 2.153 25139 9609 1 17 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.393 -1.065 25139 9610 1 17 . 1 1 99 99 LEU H H 99 8.200 8.200 8.040 0.160 25139 9611 1 17 . 1 1 100 100 ALA N N 100 128.085 128.085 130.170 -2.085 25139 9612 1 17 . 1 1 100 100 ALA C C 100 174.938 174.938 175.551 -0.613 25139 9613 1 17 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.534 -0.787 25139 9614 1 17 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.489 0.225 25139 9615 1 17 . 1 1 100 100 ALA H H 100 9.156 9.156 9.187 -0.031 25139 9616 1 17 . 1 1 101 101 LEU N N 101 128.723 128.723 127.944 0.779 25139 9617 1 17 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.085 0.057 25139 9618 1 17 . 1 1 101 101 LEU C C 101 174.379 174.379 175.311 -0.932 25139 9619 1 17 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.904 -1.051 25139 9620 1 17 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.300 1.006 25139 9621 1 17 . 1 1 101 101 LEU H H 101 9.578 9.578 8.747 0.831 25139 9622 1 17 . 1 1 102 102 VAL N N 102 119.417 119.417 120.692 -1.275 25139 9623 1 17 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.281 0.247 25139 9624 1 17 . 1 1 102 102 VAL C C 102 173.660 173.660 174.111 -0.451 25139 9625 1 17 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.097 -0.478 25139 9626 1 17 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.093 -1.820 25139 9627 1 17 . 1 1 102 102 VAL H H 102 9.297 9.297 9.415 -0.118 25139 9628 1 17 . 1 1 103 103 GLU N N 103 124.427 124.427 124.642 -0.215 25139 9629 1 17 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.896 -1.031 25139 9630 1 17 . 1 1 103 103 GLU C C 103 176.319 176.319 175.505 0.814 25139 9631 1 17 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.778 -0.677 25139 9632 1 17 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.982 0.219 25139 9633 1 17 . 1 1 103 103 GLU H H 103 7.749 7.749 8.335 -0.586 25139 9634 1 17 . 1 1 104 104 LEU N N 104 127.294 127.294 126.010 1.284 25139 9635 1 17 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.565 -0.245 25139 9636 1 17 . 1 1 104 104 LEU C C 104 176.593 176.593 177.521 -0.928 25139 9637 1 17 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.390 2.694 25139 9638 1 17 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.659 -0.268 25139 9639 1 17 . 1 1 104 104 LEU H H 104 8.323 8.323 8.415 -0.092 25139 9640 1 17 . 1 1 105 105 GLN N N 105 121.361 121.361 115.126 6.235 25139 9641 1 17 . 1 1 105 105 GLN C C 105 172.868 172.868 174.460 -1.592 25139 9642 1 17 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.513 -3.107 25139 9643 1 17 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.289 3.440 25139 9644 1 17 . 1 1 105 105 GLN H H 105 8.095 8.095 8.477 -0.382 25139 9645 1 17 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.321 0.088 25139 9646 1 17 . 1 1 106 106 PRO C C 106 177.770 177.770 176.597 1.173 25139 9647 1 17 . 1 1 106 106 PRO CA C 106 64.485 64.485 65.175 -0.690 25139 9648 1 17 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.126 -0.358 25139 9649 1 17 . 1 1 107 107 ASP N N 107 116.484 116.484 114.270 2.214 25139 9650 1 17 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.574 -0.134 25139 9651 1 17 . 1 1 107 107 ASP C C 107 176.749 176.749 176.220 0.529 25139 9652 1 17 . 1 1 107 107 ASP CA C 107 55.455 55.455 54.645 0.811 25139 9653 1 17 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.467 -0.579 25139 9654 1 17 . 1 1 107 107 ASP H H 107 8.638 8.638 8.299 0.339 25139 9655 1 17 . 1 1 108 108 ARG N N 108 117.895 117.895 120.746 -2.851 25139 9656 1 17 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.665 -0.175 25139 9657 1 17 . 1 1 108 108 ARG C C 108 176.111 176.111 177.393 -1.282 25139 9658 1 17 . 1 1 108 108 ARG CA C 108 55.265 55.265 54.961 0.304 25139 9659 1 17 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.346 0.730 25139 9660 1 17 . 1 1 108 108 ARG H H 108 7.905 7.905 8.015 -0.110 25139 9661 1 17 . 1 1 109 109 GLY N N 109 108.307 108.307 108.284 0.023 25139 9662 1 17 . 1 1 109 109 GLY C C 109 173.949 173.949 174.340 -0.391 25139 9663 1 17 . 1 1 109 109 GLY CA C 109 44.551 44.551 46.074 -1.523 25139 9664 1 17 . 1 1 109 109 GLY H H 109 7.753 7.753 8.409 -0.656 25139 9665 1 17 . 1 1 110 110 GLU N N 110 120.035 120.035 123.054 -3.019 25139 9666 1 17 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.476 -0.385 25139 9667 1 17 . 1 1 110 110 GLU C C 110 177.045 177.045 176.741 0.304 25139 9668 1 17 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.048 2.234 25139 9669 1 17 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.142 -1.469 25139 9670 1 17 . 1 1 110 110 GLU H H 110 8.509 8.509 8.195 0.314 25139 9671 1 17 . 1 1 111 111 ASP N N 111 121.160 121.160 122.140 -0.980 25139 9672 1 17 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.521 0.049 25139 9673 1 17 . 1 1 111 111 ASP C C 111 175.089 175.089 175.122 -0.033 25139 9674 1 17 . 1 1 111 111 ASP CA C 111 54.591 54.591 55.857 -1.266 25139 9675 1 17 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.455 0.977 25139 9676 1 17 . 1 1 111 111 ASP H H 111 8.916 8.916 8.286 0.630 25139 9677 1 17 . 1 1 112 112 ALA N N 112 122.130 122.130 117.872 4.258 25139 9678 1 17 . 1 1 112 112 ALA C C 112 178.120 178.120 175.722 2.398 25139 9679 1 17 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.284 2.975 25139 9680 1 17 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.782 -2.011 25139 9681 1 17 . 1 1 112 112 ALA H H 112 7.361 7.361 7.357 0.004 25139 9682 1 17 . 1 1 113 113 ILE N N 113 113.780 113.780 113.575 0.205 25139 9683 1 17 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.884 0.002 25139 9684 1 17 . 1 1 113 113 ILE C C 113 174.258 174.258 174.884 -0.626 25139 9685 1 17 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.256 0.256 25139 9686 1 17 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.809 0.039 25139 9687 1 17 . 1 1 113 113 ILE H H 113 7.667 7.667 8.431 -0.764 25139 9688 1 17 . 1 1 114 114 ALA N N 114 122.673 122.673 125.160 -2.487 25139 9689 1 17 . 1 1 114 114 ALA C C 114 176.984 176.984 176.827 0.157 25139 9690 1 17 . 1 1 114 114 ALA CA C 114 51.564 51.564 52.811 -1.247 25139 9691 1 17 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.585 0.997 25139 9692 1 17 . 1 1 114 114 ALA H H 114 8.904 8.904 8.755 0.149 25139 9693 1 17 . 1 1 115 115 ALA N N 115 116.486 116.486 118.129 -1.643 25139 9694 1 17 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.510 -0.155 25139 9695 1 17 . 1 1 115 115 ALA C C 115 174.138 174.138 174.438 -0.300 25139 9696 1 17 . 1 1 115 115 ALA CA C 115 52.320 52.320 51.116 1.204 25139 9697 1 17 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.036 1.947 25139 9698 1 17 . 1 1 115 115 ALA H H 115 7.182 7.182 7.350 -0.168 25139 9699 1 17 . 1 1 116 116 CYS N N 116 120.099 120.099 120.365 -0.266 25139 9700 1 17 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.317 0.014 25139 9701 1 17 . 1 1 116 116 CYS C C 116 176.609 176.609 172.663 3.946 25139 9702 1 17 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.582 -2.633 25139 9703 1 17 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.711 11.673 25139 9704 1 17 . 1 1 116 116 CYS H H 116 8.298 8.298 8.223 0.075 25139 9705 1 17 . 1 1 117 117 PHE N N 117 126.406 126.406 125.731 0.675 25139 9706 1 17 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.220 -0.021 25139 9707 1 17 . 1 1 117 117 PHE C C 117 173.385 173.385 174.051 -0.666 25139 9708 1 17 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.142 0.112 25139 9709 1 17 . 1 1 117 117 PHE CB C 117 41.681 41.681 42.075 -0.394 25139 9710 1 17 . 1 1 117 117 PHE H H 117 9.712 9.712 9.118 0.594 25139 9711 1 17 . 1 1 118 118 LEU N N 118 122.119 122.119 123.861 -1.742 25139 9712 1 17 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.532 -0.366 25139 9713 1 17 . 1 1 118 118 LEU C C 118 175.097 175.097 176.099 -1.002 25139 9714 1 17 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.321 -0.417 25139 9715 1 17 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.632 -1.334 25139 9716 1 17 . 1 1 118 118 LEU H H 118 8.719 8.719 9.338 -0.619 25139 9717 1 17 . 1 1 119 119 ILE N N 119 125.324 125.324 122.718 2.606 25139 9718 1 17 . 1 1 119 119 ILE HA H 119 4.877 4.877 5.001 -0.124 25139 9719 1 17 . 1 1 119 119 ILE C C 119 173.825 173.825 175.579 -1.754 25139 9720 1 17 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.827 -0.720 25139 9721 1 17 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.103 -0.594 25139 9722 1 17 . 1 1 119 119 ILE H H 119 8.986 8.986 8.987 -0.001 25139 9723 1 17 . 1 1 120 120 ASN N N 120 121.534 121.534 124.046 -2.512 25139 9724 1 17 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.786 0.604 25139 9725 1 17 . 1 1 120 120 ASN C C 120 176.098 176.098 175.760 0.338 25139 9726 1 17 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.002 -3.545 25139 9727 1 17 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.799 1.119 25139 9728 1 17 . 1 1 120 120 ASN H H 120 8.694 8.694 9.016 -0.322 25139 9729 1 17 . 1 1 121 121 CYS N N 121 122.779 122.779 115.292 7.487 25139 9730 1 17 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.034 0.449 25139 9731 1 17 . 1 1 121 121 CYS C C 121 173.195 173.195 173.632 -0.437 25139 9732 1 17 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.978 -4.214 25139 9733 1 17 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.375 16.331 25139 9734 1 17 . 1 1 121 121 CYS H H 121 10.668 10.668 8.464 2.204 25139 9735 1 17 . 1 1 122 122 LEU N N 122 121.063 121.063 117.911 3.152 25139 9736 1 17 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.526 -0.161 25139 9737 1 17 . 1 1 122 122 LEU C C 122 176.743 176.743 176.054 0.689 25139 9738 1 17 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.174 0.490 25139 9739 1 17 . 1 1 122 122 LEU CB C 122 44.234 44.234 44.978 -0.744 25139 9740 1 17 . 1 1 122 122 LEU H H 122 8.256 8.256 7.378 0.878 25139 9741 1 17 . 1 1 123 123 TYR N N 123 123.081 123.081 124.091 -1.010 25139 9742 1 17 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.756 -0.713 25139 9743 1 17 . 1 1 123 123 TYR C C 123 173.633 173.633 174.901 -1.268 25139 9744 1 17 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.053 -0.165 25139 9745 1 17 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.778 -0.697 25139 9746 1 17 . 1 1 123 123 TYR H H 123 8.990 8.990 8.911 0.079 25139 9747 1 17 . 1 1 124 124 GLU N N 124 128.742 128.742 126.179 2.563 25139 9748 1 17 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.715 -0.165 25139 9749 1 17 . 1 1 124 124 GLU C C 124 174.835 174.835 175.534 -0.699 25139 9750 1 17 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.449 0.183 25139 9751 1 17 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.310 -0.415 25139 9752 1 17 . 1 1 124 124 GLU H H 124 9.135 9.135 8.745 0.390 25139 9753 1 17 . 1 1 125 125 GLN N N 125 108.066 108.066 109.043 -0.977 25139 9754 1 17 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.843 -0.122 25139 9755 1 17 . 1 1 125 125 GLN C C 125 174.627 174.627 174.544 0.083 25139 9756 1 17 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.783 0.256 25139 9757 1 17 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.725 -0.397 25139 9758 1 17 . 1 1 125 125 GLN H H 125 8.390 8.390 8.422 -0.032 25139 9759 1 17 . 1 1 126 126 ASN N N 126 118.528 118.528 117.292 1.236 25139 9760 1 17 . 1 1 126 126 ASN C C 126 173.713 173.713 174.569 -0.856 25139 9761 1 17 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.621 -0.432 25139 9762 1 17 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.803 0.998 25139 9763 1 17 . 1 1 126 126 ASN H H 126 8.092 8.092 7.898 0.194 25139 9764 1 17 . 1 1 127 127 PHE N N 127 124.680 124.680 122.529 2.151 25139 9765 1 17 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.811 0.226 25139 9766 1 17 . 1 1 127 127 PHE C C 127 177.125 177.125 176.551 0.574 25139 9767 1 17 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.873 0.539 25139 9768 1 17 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.493 0.751 25139 9769 1 17 . 1 1 127 127 PHE H H 127 9.026 9.026 8.871 0.155 25139 9770 1 17 . 1 1 128 128 VAL N N 128 119.455 119.455 119.519 -0.064 25139 9771 1 17 . 1 1 128 128 VAL C C 128 175.886 175.886 175.737 0.149 25139 9772 1 17 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.639 -0.720 25139 9773 1 17 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.406 1.788 25139 9774 1 17 . 1 1 128 128 VAL H H 128 8.364 8.364 7.640 0.724 25139 9775 1 17 . 1 1 129 129 CYS N N 129 116.130 116.130 120.532 -4.402 25139 9776 1 17 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.910 -0.433 25139 9777 1 17 . 1 1 129 129 CYS C C 129 170.569 170.569 174.643 -4.074 25139 9778 1 17 . 1 1 129 129 CYS CA C 129 56.150 56.150 60.450 -4.300 25139 9779 1 17 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.644 17.973 25139 9780 1 17 . 1 1 129 129 CYS H H 129 5.390 5.390 7.316 -1.926 25139 9781 1 17 . 1 1 130 130 LYS N N 130 120.071 120.071 123.371 -3.300 25139 9782 1 17 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.568 -0.007 25139 9783 1 17 . 1 1 130 130 LYS C C 130 176.853 176.853 174.851 2.002 25139 9784 1 17 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.340 -0.453 25139 9785 1 17 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.070 1.572 25139 9786 1 17 . 1 1 130 130 LYS H H 130 8.066 8.066 8.749 -0.683 25139 9787 1 17 . 1 1 131 131 PHE N N 131 118.415 118.415 120.154 -1.739 25139 9788 1 17 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.498 -0.891 25139 9789 1 17 . 1 1 131 131 PHE C C 131 174.013 174.013 175.201 -1.188 25139 9790 1 17 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.532 1.179 25139 9791 1 17 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.792 0.288 25139 9792 1 17 . 1 1 131 131 PHE H H 131 8.714 8.714 8.475 0.239 25139 9793 1 17 . 1 1 132 132 ALA N N 132 124.209 124.209 123.171 1.038 25139 9794 1 17 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.081 -0.464 25139 9795 1 17 . 1 1 132 132 ALA C C 132 174.352 174.352 174.404 -0.052 25139 9796 1 17 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.400 2.041 25139 9797 1 17 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.828 -0.363 25139 9798 1 17 . 1 1 132 132 ALA H H 132 9.295 9.295 8.888 0.407 25139 9799 1 17 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.372 -0.488 25139 9800 1 17 . 1 1 133 133 PRO C C 133 173.923 173.923 176.629 -2.706 25139 9801 1 17 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.760 0.311 25139 9802 1 17 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.347 -0.744 25139 9803 1 17 . 1 1 134 134 ARG N N 134 126.071 126.071 123.907 2.164 25139 9804 1 17 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.845 -0.590 25139 9805 1 17 . 1 1 134 134 ARG C C 134 177.065 177.065 174.770 2.295 25139 9806 1 17 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.554 2.610 25139 9807 1 17 . 1 1 134 134 ARG CB C 134 32.183 32.183 32.874 -0.691 25139 9808 1 17 . 1 1 134 134 ARG H H 134 8.672 8.672 8.517 0.155 25139 9809 1 17 . 1 1 135 135 GLU N N 135 125.683 125.683 119.330 6.353 25139 9810 1 17 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.439 -0.086 25139 9811 1 17 . 1 1 135 135 GLU C C 135 178.081 178.081 175.842 2.239 25139 9812 1 17 . 1 1 135 135 GLU CA C 135 57.651 57.651 55.903 1.748 25139 9813 1 17 . 1 1 135 135 GLU CB C 135 29.996 29.996 31.445 -1.449 25139 9814 1 17 . 1 1 135 135 GLU H H 135 8.603 8.603 8.497 0.106 25139 9815 1 17 . 1 1 136 136 GLY N N 136 110.031 110.031 107.593 2.438 25139 9816 1 17 . 1 1 136 136 GLY C C 136 173.079 173.079 172.356 0.723 25139 9817 1 17 . 1 1 136 136 GLY CA C 136 45.778 45.778 45.425 0.353 25139 9818 1 17 . 1 1 136 136 GLY H H 136 9.036 9.036 8.552 0.484 25139 9819 1 17 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.680 -0.005 25139 9820 1 17 . 1 1 137 137 PHE C C 137 174.936 174.936 174.886 0.050 25139 9821 1 17 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.228 -0.144 25139 9822 1 17 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.407 2.289 25139 9823 1 17 . 1 1 138 138 ILE N N 138 117.417 117.417 114.261 3.156 25139 9824 1 17 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.651 -0.144 25139 9825 1 17 . 1 1 138 138 ILE C C 138 173.858 173.858 173.482 0.376 25139 9826 1 17 . 1 1 138 138 ILE CA C 138 60.620 60.620 60.343 0.278 25139 9827 1 17 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.595 1.002 25139 9828 1 17 . 1 1 138 138 ILE H H 138 8.777 8.777 8.857 -0.080 25139 9829 1 17 . 1 1 139 139 ASN N N 139 117.201 117.201 117.073 0.128 25139 9830 1 17 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.420 0.639 25139 9831 1 17 . 1 1 139 139 ASN C C 139 173.721 173.721 173.982 -0.261 25139 9832 1 17 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.913 -1.683 25139 9833 1 17 . 1 1 139 139 ASN CB C 139 43.861 43.861 41.972 1.889 25139 9834 1 17 . 1 1 139 139 ASN H H 139 8.872 8.872 8.124 0.748 25139 9835 1 17 . 1 1 140 140 TYR N N 140 123.991 123.991 120.427 3.564 25139 9836 1 17 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.662 0.516 25139 9837 1 17 . 1 1 140 140 TYR C C 140 174.791 174.791 175.911 -1.120 25139 9838 1 17 . 1 1 140 140 TYR CA C 140 57.072 57.072 59.106 -2.034 25139 9839 1 17 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.025 2.645 25139 9840 1 17 . 1 1 140 140 TYR H H 140 9.526 9.526 8.732 0.794 25139 9841 1 17 . 1 1 141 141 LEU N N 141 122.779 122.779 123.518 -0.739 25139 9842 1 17 . 1 1 141 141 LEU C C 141 175.404 175.404 177.756 -2.352 25139 9843 1 17 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.910 2.193 25139 9844 1 17 . 1 1 141 141 LEU CB C 141 45.161 45.161 44.965 0.196 25139 9845 1 17 . 1 1 141 141 LEU H H 141 9.010 9.010 9.060 -0.050 25139 9846 1 17 . 1 1 142 142 THR N N 142 113.189 113.189 112.943 0.246 25139 9847 1 17 . 1 1 142 142 THR HA H 142 4.061 4.061 4.232 -0.171 25139 9848 1 17 . 1 1 142 142 THR C C 142 175.940 175.940 176.237 -0.297 25139 9849 1 17 . 1 1 142 142 THR CA C 142 61.389 61.389 60.386 1.003 25139 9850 1 17 . 1 1 142 142 THR CB C 142 69.779 69.779 70.336 -0.557 25139 9851 1 17 . 1 1 142 142 THR H H 142 7.737 7.737 8.157 -0.420 25139 9852 1 17 . 1 1 143 143 ARG N N 143 120.975 120.975 120.635 0.340 25139 9853 1 17 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.016 -0.078 25139 9854 1 17 . 1 1 143 143 ARG C C 143 178.690 178.690 178.066 0.624 25139 9855 1 17 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.609 1.139 25139 9856 1 17 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.132 1.013 25139 9857 1 17 . 1 1 143 143 ARG H H 143 8.149 8.149 8.217 -0.068 25139 9858 1 17 . 1 1 144 144 GLU N N 144 116.997 116.997 118.361 -1.364 25139 9859 1 17 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.283 -0.174 25139 9860 1 17 . 1 1 144 144 GLU C C 144 178.442 178.442 178.110 0.332 25139 9861 1 17 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.872 0.991 25139 9862 1 17 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.938 -0.355 25139 9863 1 17 . 1 1 144 144 GLU H H 144 8.622 8.622 7.686 0.936 25139 9864 1 17 . 1 1 145 145 VAL N N 145 111.213 111.213 116.805 -5.592 25139 9865 1 17 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.092 0.319 25139 9866 1 17 . 1 1 145 145 VAL C C 145 176.965 176.965 177.085 -0.120 25139 9867 1 17 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.664 -1.070 25139 9868 1 17 . 1 1 145 145 VAL CB C 145 32.082 32.082 31.578 0.504 25139 9869 1 17 . 1 1 145 145 VAL H H 145 7.227 7.227 7.577 -0.350 25139 9870 1 17 . 1 1 146 146 TYR N N 146 123.512 123.512 122.350 1.162 25139 9871 1 17 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.046 -0.166 25139 9872 1 17 . 1 1 146 146 TYR C C 146 176.377 176.377 176.811 -0.434 25139 9873 1 17 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.654 -0.117 25139 9874 1 17 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.590 -0.251 25139 9875 1 17 . 1 1 146 146 TYR H H 146 8.492 8.492 8.899 -0.407 25139 9876 1 17 . 1 1 147 147 ARG N N 147 116.680 116.680 117.672 -0.992 25139 9877 1 17 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.872 -0.058 25139 9878 1 17 . 1 1 147 147 ARG C C 147 178.858 178.858 177.907 0.951 25139 9879 1 17 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.363 0.333 25139 9880 1 17 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.642 0.023 25139 9881 1 17 . 1 1 147 147 ARG H H 147 8.053 8.053 8.393 -0.340 25139 9882 1 17 . 1 1 148 148 SER N N 148 115.306 115.306 113.708 1.598 25139 9883 1 17 . 1 1 148 148 SER HA H 148 3.998 3.998 4.476 -0.478 25139 9884 1 17 . 1 1 148 148 SER C C 148 175.786 175.786 176.353 -0.567 25139 9885 1 17 . 1 1 148 148 SER CA C 148 62.006 62.006 60.076 1.930 25139 9886 1 17 . 1 1 148 148 SER H H 148 7.139 7.139 7.363 -0.224 25139 9887 1 17 . 1 1 149 149 TYR N N 149 123.207 123.207 123.928 -0.721 25139 9888 1 17 . 1 1 149 149 TYR C C 149 175.831 175.831 176.813 -0.982 25139 9889 1 17 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.161 -0.561 25139 9890 1 17 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.355 0.426 25139 9891 1 17 . 1 1 149 149 TYR H H 149 7.253 7.253 8.006 -0.753 25139 9892 1 17 . 1 1 150 150 ARG N N 150 118.708 118.708 115.359 3.349 25139 9893 1 17 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.791 -0.445 25139 9894 1 17 . 1 1 150 150 ARG C C 150 177.644 177.644 178.216 -0.572 25139 9895 1 17 . 1 1 150 150 ARG CA C 150 57.323 57.323 56.641 0.682 25139 9896 1 17 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.146 -0.292 25139 9897 1 17 . 1 1 150 150 ARG H H 150 8.441 8.441 7.614 0.827 25139 9898 1 17 . 1 1 151 151 GLN N N 151 116.551 116.551 115.618 0.933 25139 9899 1 17 . 1 1 151 151 GLN HA H 151 3.957 3.957 3.908 0.049 25139 9900 1 17 . 1 1 151 151 GLN C C 151 177.987 177.987 176.575 1.412 25139 9901 1 17 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.279 1.062 25139 9902 1 17 . 1 1 151 151 GLN CB C 151 28.464 28.464 29.112 -0.648 25139 9903 1 17 . 1 1 151 151 GLN H H 151 7.332 7.332 7.335 -0.003 25139 9904 1 17 . 1 1 152 152 LEU N N 152 118.877 118.877 114.515 4.362 25139 9905 1 17 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.468 -0.289 25139 9906 1 17 . 1 1 152 152 LEU C C 152 179.070 179.070 177.314 1.756 25139 9907 1 17 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.199 0.883 25139 9908 1 17 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.297 -0.609 25139 9909 1 17 . 1 1 152 152 LEU H H 152 7.106 7.106 7.068 0.038 25139 9910 1 17 . 1 1 153 153 VAL N N 153 119.076 119.076 113.291 5.785 25139 9911 1 17 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.875 -1.015 25139 9912 1 17 . 1 1 153 153 VAL C C 153 177.421 177.421 175.827 1.594 25139 9913 1 17 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.982 2.601 25139 9914 1 17 . 1 1 153 153 VAL CB C 153 31.518 31.518 32.606 -1.088 25139 9915 1 17 . 1 1 153 153 VAL H H 153 7.427 7.427 7.188 0.239 25139 9916 1 17 . 1 1 154 154 ASP N N 154 119.888 119.888 120.947 -1.059 25139 9917 1 17 . 1 1 154 154 ASP C C 154 177.422 177.422 175.440 1.982 25139 9918 1 17 . 1 1 154 154 ASP CA C 154 56.071 56.071 53.425 2.646 25139 9919 1 17 . 1 1 154 154 ASP CB C 154 40.349 40.349 43.872 -3.523 25139 9920 1 17 . 1 1 154 154 ASP H H 154 7.930 7.930 7.340 0.590 25139 9921 1 17 . 1 1 155 155 HIS N N 155 117.821 117.821 118.802 -0.981 25139 9922 1 17 . 1 1 155 155 HIS CA C 155 57.756 57.756 57.011 0.745 25139 9923 1 17 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.387 -0.207 25139 9924 1 17 . 1 1 155 155 HIS H H 155 7.680 7.680 8.547 -0.867 25139 9925 1 17 . 1 1 156 156 HIS N N 156 119.180 119.180 117.731 1.449 25139 9926 1 17 . 1 1 156 156 HIS CA C 156 57.931 57.931 55.659 2.272 25139 9927 1 17 . 1 1 156 156 HIS CB C 156 30.300 30.300 31.884 -1.584 25139 9928 1 17 . 1 1 156 156 HIS H H 156 7.868 7.868 7.653 0.215 25139 9929 1 18 . 1 1 48 48 ALA CA C 48 52.904 52.904 53.040 -0.136 25139 9930 1 18 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.974 0.248 25139 9931 1 18 . 1 1 49 49 ASP N N 49 119.661 119.661 116.215 3.446 25139 9932 1 18 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.261 0.016 25139 9933 1 18 . 1 1 49 49 ASP CB C 49 41.062 41.062 38.750 2.312 25139 9934 1 18 . 1 1 49 49 ASP H H 49 8.462 8.462 8.373 0.089 25139 9935 1 18 . 1 1 51 51 LEU HA H 51 4.052 4.052 3.953 0.099 25139 9936 1 18 . 1 1 51 51 LEU C C 51 178.514 178.514 178.608 -0.094 25139 9937 1 18 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.088 0.961 25139 9938 1 18 . 1 1 51 51 LEU CB C 51 41.193 41.193 40.732 0.461 25139 9939 1 18 . 1 1 52 52 ASN N N 52 113.819 113.819 119.016 -5.197 25139 9940 1 18 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.515 0.320 25139 9941 1 18 . 1 1 52 52 ASN C C 52 175.964 175.964 176.033 -0.069 25139 9942 1 18 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.200 -1.104 25139 9943 1 18 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.831 0.052 25139 9944 1 18 . 1 1 52 52 ASN H H 52 7.853 7.853 8.273 -0.420 25139 9945 1 18 . 1 1 53 53 SER N N 53 114.357 114.357 113.298 1.059 25139 9946 1 18 . 1 1 53 53 SER CA C 53 59.908 59.908 59.628 0.280 25139 9947 1 18 . 1 1 53 53 SER CB C 53 64.395 64.395 63.493 0.902 25139 9948 1 18 . 1 1 53 53 SER H H 53 8.023 8.023 8.535 -0.512 25139 9949 1 18 . 1 1 54 54 PHE N N 54 121.037 121.037 119.100 1.937 25139 9950 1 18 . 1 1 54 54 PHE C C 54 175.522 175.522 175.720 -0.198 25139 9951 1 18 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.839 1.225 25139 9952 1 18 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.527 -0.474 25139 9953 1 18 . 1 1 54 54 PHE H H 54 7.731 7.731 7.773 -0.042 25139 9954 1 18 . 1 1 55 55 THR N N 55 116.535 116.535 118.489 -1.954 25139 9955 1 18 . 1 1 55 55 THR HA H 55 4.654 4.654 4.693 -0.039 25139 9956 1 18 . 1 1 55 55 THR C C 55 173.301 173.301 172.981 0.320 25139 9957 1 18 . 1 1 55 55 THR CA C 55 61.420 61.420 61.084 0.336 25139 9958 1 18 . 1 1 55 55 THR CB C 55 71.388 71.388 71.436 -0.048 25139 9959 1 18 . 1 1 55 55 THR H H 55 8.929 8.929 9.336 -0.407 25139 9960 1 18 . 1 1 56 56 ALA N N 56 129.359 129.359 128.980 0.379 25139 9961 1 18 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.173 0.142 25139 9962 1 18 . 1 1 56 56 ALA C C 56 178.305 178.305 177.198 1.107 25139 9963 1 18 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.649 1.222 25139 9964 1 18 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.420 -0.096 25139 9965 1 18 . 1 1 56 56 ALA H H 56 8.907 8.907 8.613 0.294 25139 9966 1 18 . 1 1 57 57 GLY N N 57 106.331 106.331 109.124 -2.793 25139 9967 1 18 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.329 1.282 25139 9968 1 18 . 1 1 57 57 GLY H H 57 7.978 7.978 8.254 -0.276 25139 9969 1 18 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.288 0.036 25139 9970 1 18 . 1 1 59 59 PRO C C 59 177.466 177.466 177.866 -0.400 25139 9971 1 18 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.146 1.338 25139 9972 1 18 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.226 -0.491 25139 9973 1 18 . 1 1 60 60 GLY N N 60 109.688 109.688 109.597 0.091 25139 9974 1 18 . 1 1 60 60 GLY C C 60 173.555 173.555 173.383 0.172 25139 9975 1 18 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.132 0.409 25139 9976 1 18 . 1 1 60 60 GLY H H 60 8.402 8.402 8.410 -0.008 25139 9977 1 18 . 1 1 61 61 PHE N N 61 122.491 122.491 122.601 -0.110 25139 9978 1 18 . 1 1 61 61 PHE C C 61 175.146 175.146 174.842 0.304 25139 9979 1 18 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.799 1.483 25139 9980 1 18 . 1 1 61 61 PHE CB C 61 38.699 38.699 39.495 -0.796 25139 9981 1 18 . 1 1 61 61 PHE H H 61 7.957 7.957 7.402 0.555 25139 9982 1 18 . 1 1 62 62 VAL N N 62 121.128 121.128 119.040 2.088 25139 9983 1 18 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.547 -0.462 25139 9984 1 18 . 1 1 62 62 VAL C C 62 174.937 174.937 174.807 0.130 25139 9985 1 18 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.948 0.760 25139 9986 1 18 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.826 0.606 25139 9987 1 18 . 1 1 62 62 VAL H H 62 7.994 7.994 8.673 -0.679 25139 9988 1 18 . 1 1 63 63 LEU N N 63 124.386 124.386 122.697 1.689 25139 9989 1 18 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.623 -1.307 25139 9990 1 18 . 1 1 63 63 LEU C C 63 175.278 175.278 177.115 -1.837 25139 9991 1 18 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.996 0.292 25139 9992 1 18 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.678 1.440 25139 9993 1 18 . 1 1 63 63 LEU H H 63 7.572 7.572 8.745 -1.173 25139 9994 1 18 . 1 1 64 64 ASP N N 64 126.746 126.746 123.004 3.742 25139 9995 1 18 . 1 1 64 64 ASP C C 64 177.801 177.801 177.275 0.526 25139 9996 1 18 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.938 -3.217 25139 9997 1 18 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.469 -1.071 25139 9998 1 18 . 1 1 64 64 ASP H H 64 8.552 8.552 8.510 0.042 25139 9999 1 18 . 1 1 65 65 THR C C 65 175.002 175.002 175.216 -0.214 25139 10000 1 18 . 1 1 65 65 THR CB C 65 67.919 67.919 66.805 1.114 25139 10001 1 18 . 1 1 66 66 GLN N N 66 120.804 120.804 120.463 0.341 25139 10002 1 18 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.994 -0.117 25139 10003 1 18 . 1 1 66 66 GLN C C 66 178.901 178.901 177.599 1.302 25139 10004 1 18 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.499 0.917 25139 10005 1 18 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.340 -0.416 25139 10006 1 18 . 1 1 66 66 GLN H H 66 8.447 8.447 8.244 0.203 25139 10007 1 18 . 1 1 67 67 ALA N N 67 121.267 121.267 121.619 -0.352 25139 10008 1 18 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.107 -0.150 25139 10009 1 18 . 1 1 67 67 ALA C C 67 176.777 176.777 178.466 -1.689 25139 10010 1 18 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.532 -0.208 25139 10011 1 18 . 1 1 67 67 ALA CB C 67 18.620 18.620 17.868 0.752 25139 10012 1 18 . 1 1 67 67 ALA H H 67 7.791 7.791 7.777 0.014 25139 10013 1 18 . 1 1 68 68 SER N N 68 113.339 113.339 112.881 0.458 25139 10014 1 18 . 1 1 68 68 SER HA H 68 4.061 4.061 4.153 -0.092 25139 10015 1 18 . 1 1 68 68 SER C C 68 175.875 175.875 176.584 -0.709 25139 10016 1 18 . 1 1 68 68 SER CA C 68 62.970 62.970 60.237 2.733 25139 10017 1 18 . 1 1 68 68 SER CB C 68 61.330 61.330 63.005 -1.675 25139 10018 1 18 . 1 1 68 68 SER H H 68 7.785 7.785 7.890 -0.105 25139 10019 1 18 . 1 1 69 69 VAL N N 69 125.140 125.140 117.803 7.337 25139 10020 1 18 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.228 -0.152 25139 10021 1 18 . 1 1 69 69 VAL C C 69 176.384 176.384 176.963 -0.579 25139 10022 1 18 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.449 1.282 25139 10023 1 18 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.326 0.163 25139 10024 1 18 . 1 1 69 69 VAL H H 69 8.572 8.572 7.877 0.695 25139 10025 1 18 . 1 1 70 70 SER N N 70 116.704 116.704 114.119 2.585 25139 10026 1 18 . 1 1 70 70 SER HA H 70 4.229 4.229 4.247 -0.018 25139 10027 1 18 . 1 1 70 70 SER C C 70 174.101 174.101 175.526 -1.425 25139 10028 1 18 . 1 1 70 70 SER CA C 70 61.627 61.627 59.288 2.339 25139 10029 1 18 . 1 1 70 70 SER H H 70 7.951 7.951 7.729 0.222 25139 10030 1 18 . 1 1 71 71 ASN N N 71 117.576 117.576 117.239 0.337 25139 10031 1 18 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.662 0.140 25139 10032 1 18 . 1 1 71 71 ASN C C 71 174.332 174.332 174.844 -0.512 25139 10033 1 18 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.696 -0.257 25139 10034 1 18 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.673 0.794 25139 10035 1 18 . 1 1 71 71 ASN H H 71 7.131 7.131 7.525 -0.394 25139 10036 1 18 . 1 1 72 72 GLY N N 72 103.925 103.925 105.512 -1.587 25139 10037 1 18 . 1 1 72 72 GLY C C 72 174.710 174.710 173.593 1.117 25139 10038 1 18 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.615 -0.066 25139 10039 1 18 . 1 1 72 72 GLY H H 72 7.338 7.338 7.423 -0.085 25139 10040 1 18 . 1 1 73 73 ALA N N 73 124.942 124.942 123.561 1.381 25139 10041 1 18 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.501 -0.329 25139 10042 1 18 . 1 1 73 73 ALA C C 73 175.896 175.896 176.376 -0.480 25139 10043 1 18 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.904 0.769 25139 10044 1 18 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.032 0.024 25139 10045 1 18 . 1 1 73 73 ALA H H 73 8.032 8.032 7.952 0.080 25139 10046 1 18 . 1 1 74 74 THR N N 74 113.423 113.423 116.508 -3.085 25139 10047 1 18 . 1 1 74 74 THR HA H 74 4.678 4.678 4.603 0.075 25139 10048 1 18 . 1 1 74 74 THR C C 74 173.339 173.339 173.116 0.223 25139 10049 1 18 . 1 1 74 74 THR CA C 74 61.545 61.545 61.672 -0.127 25139 10050 1 18 . 1 1 74 74 THR CB C 74 71.319 71.319 71.149 0.170 25139 10051 1 18 . 1 1 74 74 THR H H 74 8.530 8.530 8.340 0.190 25139 10052 1 18 . 1 1 75 75 PHE N N 75 128.180 128.180 130.077 -1.897 25139 10053 1 18 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.870 -0.266 25139 10054 1 18 . 1 1 75 75 PHE C C 75 174.623 174.623 175.103 -0.480 25139 10055 1 18 . 1 1 75 75 PHE CA C 75 57.616 57.616 56.542 1.074 25139 10056 1 18 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.672 0.003 25139 10057 1 18 . 1 1 75 75 PHE H H 75 9.146 9.146 9.176 -0.030 25139 10058 1 18 . 1 1 76 76 LEU N N 76 127.849 127.849 126.216 1.633 25139 10059 1 18 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.672 -0.321 25139 10060 1 18 . 1 1 76 76 LEU C C 76 176.339 176.339 176.607 -0.268 25139 10061 1 18 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.585 0.398 25139 10062 1 18 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.573 -0.243 25139 10063 1 18 . 1 1 76 76 LEU H H 76 8.635 8.635 8.474 0.161 25139 10064 1 18 . 1 1 77 77 GLU N N 77 115.131 115.131 120.350 -5.219 25139 10065 1 18 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.638 -0.230 25139 10066 1 18 . 1 1 77 77 GLU C C 77 174.734 174.734 174.833 -0.099 25139 10067 1 18 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.376 0.977 25139 10068 1 18 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.838 0.369 25139 10069 1 18 . 1 1 77 77 GLU H H 77 7.252 7.252 7.855 -0.603 25139 10070 1 18 . 1 1 78 78 SER N N 78 118.016 118.016 118.857 -0.841 25139 10071 1 18 . 1 1 78 78 SER HA H 78 5.561 5.561 5.503 0.058 25139 10072 1 18 . 1 1 78 78 SER C C 78 171.968 171.968 172.758 -0.790 25139 10073 1 18 . 1 1 78 78 SER CA C 78 54.061 54.061 55.363 -1.302 25139 10074 1 18 . 1 1 78 78 SER CB C 78 64.074 64.074 63.586 0.488 25139 10075 1 18 . 1 1 78 78 SER H H 78 9.033 9.033 8.697 0.336 25139 10076 1 18 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.777 -0.177 25139 10077 1 18 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.733 -0.323 25139 10078 1 18 . 1 1 80 80 THR N N 80 118.079 118.079 115.532 2.547 25139 10079 1 18 . 1 1 80 80 THR HA H 80 4.342 4.342 4.325 0.017 25139 10080 1 18 . 1 1 80 80 THR C C 80 174.494 174.494 174.488 0.006 25139 10081 1 18 . 1 1 80 80 THR CA C 80 61.453 61.453 60.734 0.719 25139 10082 1 18 . 1 1 80 80 THR CB C 80 67.797 67.797 68.555 -0.758 25139 10083 1 18 . 1 1 80 80 THR H H 80 8.670 8.670 8.281 0.389 25139 10084 1 18 . 1 1 81 81 VAL N N 81 117.395 117.395 118.119 -0.724 25139 10085 1 18 . 1 1 81 81 VAL HA H 81 4.607 4.607 4.018 0.589 25139 10086 1 18 . 1 1 81 81 VAL C C 81 175.518 175.518 176.150 -0.632 25139 10087 1 18 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.842 -2.728 25139 10088 1 18 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.183 2.412 25139 10089 1 18 . 1 1 81 81 VAL H H 81 7.448 7.448 7.428 0.020 25139 10090 1 18 . 1 1 82 82 ARG N N 82 117.852 117.852 120.783 -2.931 25139 10091 1 18 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.614 -0.093 25139 10092 1 18 . 1 1 82 82 ARG C C 82 176.992 176.992 175.663 1.329 25139 10093 1 18 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.480 0.905 25139 10094 1 18 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.566 1.036 25139 10095 1 18 . 1 1 82 82 ARG H H 82 8.710 8.710 8.712 -0.002 25139 10096 1 18 . 1 1 83 83 ARG N N 83 117.035 117.035 118.260 -1.225 25139 10097 1 18 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.639 0.683 25139 10098 1 18 . 1 1 83 83 ARG C C 83 177.379 177.379 176.885 0.494 25139 10099 1 18 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.438 -0.754 25139 10100 1 18 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.874 -0.833 25139 10101 1 18 . 1 1 83 83 ARG H H 83 7.292 7.292 7.648 -0.356 25139 10102 1 18 . 1 1 84 84 GLY N N 84 114.911 114.911 110.567 4.344 25139 10103 1 18 . 1 1 84 84 GLY C C 84 176.940 176.940 175.199 1.741 25139 10104 1 18 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.552 2.120 25139 10105 1 18 . 1 1 84 84 GLY H H 84 9.255 9.255 8.879 0.376 25139 10106 1 18 . 1 1 85 85 TRP N N 85 121.810 121.810 119.734 2.076 25139 10107 1 18 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.208 -0.041 25139 10108 1 18 . 1 1 85 85 TRP C C 85 178.272 178.272 177.477 0.795 25139 10109 1 18 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.160 0.885 25139 10110 1 18 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.114 0.103 25139 10111 1 18 . 1 1 85 85 TRP H H 85 9.963 9.963 7.871 2.092 25139 10112 1 18 . 1 1 86 86 ASP N N 86 116.400 116.400 120.029 -3.629 25139 10113 1 18 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.438 -0.045 25139 10114 1 18 . 1 1 86 86 ASP C C 86 178.803 178.803 178.083 0.720 25139 10115 1 18 . 1 1 86 86 ASP CA C 86 57.054 57.054 57.041 0.013 25139 10116 1 18 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.134 0.599 25139 10117 1 18 . 1 1 86 86 ASP H H 86 6.934 6.934 7.620 -0.686 25139 10118 1 18 . 1 1 87 87 CYS N N 87 122.454 122.454 119.473 2.981 25139 10119 1 18 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.237 0.013 25139 10120 1 18 . 1 1 87 87 CYS C C 87 174.956 174.956 176.585 -1.629 25139 10121 1 18 . 1 1 87 87 CYS CA C 87 57.147 57.147 60.917 -3.770 25139 10122 1 18 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.235 11.249 25139 10123 1 18 . 1 1 87 87 CYS H H 87 7.603 7.603 7.467 0.136 25139 10124 1 18 . 1 1 88 88 VAL N N 88 119.192 119.192 120.468 -1.276 25139 10125 1 18 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.212 -0.754 25139 10126 1 18 . 1 1 88 88 VAL C C 88 177.413 177.413 177.982 -0.569 25139 10127 1 18 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.741 1.235 25139 10128 1 18 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.611 -0.369 25139 10129 1 18 . 1 1 88 88 VAL H H 88 7.192 7.192 7.675 -0.483 25139 10130 1 18 . 1 1 89 89 ARG N N 89 118.185 118.185 118.817 -0.632 25139 10131 1 18 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.988 -0.308 25139 10132 1 18 . 1 1 89 89 ARG C C 89 178.677 178.677 178.115 0.562 25139 10133 1 18 . 1 1 89 89 ARG CA C 89 59.955 59.955 59.185 0.770 25139 10134 1 18 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.333 0.458 25139 10135 1 18 . 1 1 89 89 ARG H H 89 7.971 7.971 8.230 -0.259 25139 10136 1 18 . 1 1 90 90 ALA N N 90 120.815 120.815 122.629 -1.814 25139 10137 1 18 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.115 -0.040 25139 10138 1 18 . 1 1 90 90 ALA C C 90 177.416 177.416 178.868 -1.452 25139 10139 1 18 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.766 -0.512 25139 10140 1 18 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.183 -0.747 25139 10141 1 18 . 1 1 90 90 ALA H H 90 7.453 7.453 7.404 0.049 25139 10142 1 18 . 1 1 91 91 CYS N N 91 120.380 120.380 115.982 4.398 25139 10143 1 18 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.272 0.099 25139 10144 1 18 . 1 1 91 91 CYS C C 91 176.654 176.654 176.014 0.640 25139 10145 1 18 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.861 -4.166 25139 10146 1 18 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.278 12.426 25139 10147 1 18 . 1 1 91 91 CYS H H 91 7.944 7.944 7.497 0.447 25139 10148 1 18 . 1 1 92 92 CYS N N 92 116.270 116.270 118.080 -1.810 25139 10149 1 18 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.508 -0.104 25139 10150 1 18 . 1 1 92 92 CYS C C 92 175.628 175.628 176.461 -0.833 25139 10151 1 18 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.898 -2.192 25139 10152 1 18 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.024 15.125 25139 10153 1 18 . 1 1 92 92 CYS H H 92 8.315 8.315 7.716 0.599 25139 10154 1 18 . 1 1 93 93 THR N N 93 107.283 107.283 111.438 -4.155 25139 10155 1 18 . 1 1 93 93 THR HA H 93 4.481 4.481 4.305 0.176 25139 10156 1 18 . 1 1 93 93 THR C C 93 173.606 173.606 175.535 -1.929 25139 10157 1 18 . 1 1 93 93 THR CA C 93 61.402 61.402 63.135 -1.733 25139 10158 1 18 . 1 1 93 93 THR CB C 93 69.046 69.046 69.571 -0.525 25139 10159 1 18 . 1 1 93 93 THR H H 93 7.445 7.445 7.608 -0.163 25139 10160 1 18 . 1 1 94 94 THR N N 94 121.432 121.432 120.833 0.599 25139 10161 1 18 . 1 1 94 94 THR HA H 94 4.398 4.398 4.493 -0.095 25139 10162 1 18 . 1 1 94 94 THR C C 94 173.493 173.493 174.948 -1.455 25139 10163 1 18 . 1 1 94 94 THR CA C 94 62.726 62.726 63.089 -0.363 25139 10164 1 18 . 1 1 94 94 THR CB C 94 69.704 69.704 68.741 0.963 25139 10165 1 18 . 1 1 94 94 THR H H 94 7.553 7.553 8.025 -0.472 25139 10166 1 18 . 1 1 95 95 GLN N N 95 129.410 129.410 127.855 1.555 25139 10167 1 18 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.022 -0.078 25139 10168 1 18 . 1 1 95 95 GLN C C 95 176.293 176.293 176.021 0.272 25139 10169 1 18 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.851 -0.811 25139 10170 1 18 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.721 -0.465 25139 10171 1 18 . 1 1 95 95 GLN H H 95 8.812 8.812 8.717 0.095 25139 10172 1 18 . 1 1 96 96 ASN N N 96 115.015 115.015 114.725 0.290 25139 10173 1 18 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.831 -0.632 25139 10174 1 18 . 1 1 96 96 ASN C C 96 172.260 172.260 173.951 -1.691 25139 10175 1 18 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.707 2.860 25139 10176 1 18 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.696 -1.859 25139 10177 1 18 . 1 1 96 96 ASN H H 96 8.791 8.791 8.063 0.728 25139 10178 1 18 . 1 1 97 97 CYS N N 97 115.830 115.830 120.098 -4.268 25139 10179 1 18 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.512 -0.411 25139 10180 1 18 . 1 1 97 97 CYS C C 97 175.025 175.025 174.113 0.912 25139 10181 1 18 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.773 -1.625 25139 10182 1 18 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.121 16.113 25139 10183 1 18 . 1 1 97 97 CYS H H 97 7.651 7.651 7.799 -0.148 25139 10184 1 18 . 1 1 98 98 ASN N N 98 125.148 125.148 125.370 -0.222 25139 10185 1 18 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.085 0.048 25139 10186 1 18 . 1 1 98 98 ASN C C 98 171.892 171.892 174.204 -2.312 25139 10187 1 18 . 1 1 98 98 ASN CA C 98 53.194 53.194 54.050 -0.855 25139 10188 1 18 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.230 -1.282 25139 10189 1 18 . 1 1 98 98 ASN H H 98 8.736 8.736 8.466 0.270 25139 10190 1 18 . 1 1 99 99 LEU N N 99 120.898 120.898 120.245 0.653 25139 10191 1 18 . 1 1 99 99 LEU C C 99 173.084 173.084 174.010 -0.926 25139 10192 1 18 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.493 2.627 25139 10193 1 18 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.928 -1.600 25139 10194 1 18 . 1 1 99 99 LEU H H 99 8.200 8.200 8.187 0.013 25139 10195 1 18 . 1 1 100 100 ALA N N 100 128.085 128.085 129.086 -1.001 25139 10196 1 18 . 1 1 100 100 ALA C C 100 174.938 174.938 175.375 -0.437 25139 10197 1 18 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.360 -0.613 25139 10198 1 18 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.426 0.288 25139 10199 1 18 . 1 1 100 100 ALA H H 100 9.156 9.156 9.352 -0.196 25139 10200 1 18 . 1 1 101 101 LEU N N 101 128.723 128.723 127.633 1.090 25139 10201 1 18 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.190 -0.048 25139 10202 1 18 . 1 1 101 101 LEU C C 101 174.379 174.379 175.147 -0.768 25139 10203 1 18 . 1 1 101 101 LEU CA C 101 53.853 53.853 53.989 -0.136 25139 10204 1 18 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.835 0.472 25139 10205 1 18 . 1 1 101 101 LEU H H 101 9.578 9.578 9.133 0.445 25139 10206 1 18 . 1 1 102 102 VAL N N 102 119.417 119.417 118.781 0.636 25139 10207 1 18 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.058 0.470 25139 10208 1 18 . 1 1 102 102 VAL C C 102 173.660 173.660 174.138 -0.478 25139 10209 1 18 . 1 1 102 102 VAL CA C 102 58.620 58.620 59.169 -0.549 25139 10210 1 18 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.846 -1.573 25139 10211 1 18 . 1 1 102 102 VAL H H 102 9.297 9.297 9.324 -0.027 25139 10212 1 18 . 1 1 103 103 GLU N N 103 124.427 124.427 123.087 1.340 25139 10213 1 18 . 1 1 103 103 GLU HA H 103 3.865 3.865 3.764 0.101 25139 10214 1 18 . 1 1 103 103 GLU C C 103 176.319 176.319 174.481 1.838 25139 10215 1 18 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.622 -0.521 25139 10216 1 18 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.209 0.992 25139 10217 1 18 . 1 1 103 103 GLU H H 103 7.749 7.749 8.256 -0.507 25139 10218 1 18 . 1 1 104 104 LEU N N 104 127.294 127.294 125.212 2.082 25139 10219 1 18 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.453 -0.133 25139 10220 1 18 . 1 1 104 104 LEU C C 104 176.593 176.593 177.108 -0.515 25139 10221 1 18 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.478 2.606 25139 10222 1 18 . 1 1 104 104 LEU CB C 104 42.391 42.391 44.336 -1.945 25139 10223 1 18 . 1 1 104 104 LEU H H 104 8.323 8.323 8.106 0.217 25139 10224 1 18 . 1 1 105 105 GLN N N 105 121.361 121.361 117.575 3.786 25139 10225 1 18 . 1 1 105 105 GLN C C 105 172.868 172.868 174.265 -1.397 25139 10226 1 18 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.116 -2.710 25139 10227 1 18 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.981 1.748 25139 10228 1 18 . 1 1 105 105 GLN H H 105 8.095 8.095 8.675 -0.580 25139 10229 1 18 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.461 -0.052 25139 10230 1 18 . 1 1 106 106 PRO C C 106 177.770 177.770 176.733 1.037 25139 10231 1 18 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.390 0.095 25139 10232 1 18 . 1 1 106 106 PRO CB C 106 31.768 31.768 31.995 -0.227 25139 10233 1 18 . 1 1 107 107 ASP N N 107 116.484 116.484 115.442 1.042 25139 10234 1 18 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.621 -0.181 25139 10235 1 18 . 1 1 107 107 ASP C C 107 176.749 176.749 175.928 0.821 25139 10236 1 18 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.322 0.134 25139 10237 1 18 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.105 -1.217 25139 10238 1 18 . 1 1 107 107 ASP H H 107 8.638 8.638 8.400 0.238 25139 10239 1 18 . 1 1 108 108 ARG N N 108 117.895 117.895 119.682 -1.787 25139 10240 1 18 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.583 -0.093 25139 10241 1 18 . 1 1 108 108 ARG C C 108 176.111 176.111 176.953 -0.842 25139 10242 1 18 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.071 0.194 25139 10243 1 18 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.963 0.113 25139 10244 1 18 . 1 1 108 108 ARG H H 108 7.905 7.905 8.139 -0.234 25139 10245 1 18 . 1 1 109 109 GLY N N 109 108.307 108.307 108.544 -0.237 25139 10246 1 18 . 1 1 109 109 GLY C C 109 173.949 173.949 174.602 -0.653 25139 10247 1 18 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.059 -0.509 25139 10248 1 18 . 1 1 109 109 GLY H H 109 7.753 7.753 8.319 -0.566 25139 10249 1 18 . 1 1 110 110 GLU N N 110 120.035 120.035 114.622 5.413 25139 10250 1 18 . 1 1 110 110 GLU HA H 110 4.091 4.091 3.721 0.370 25139 10251 1 18 . 1 1 110 110 GLU C C 110 177.045 177.045 176.338 0.707 25139 10252 1 18 . 1 1 110 110 GLU CA C 110 58.282 58.282 58.596 -0.314 25139 10253 1 18 . 1 1 110 110 GLU CB C 110 29.673 29.673 28.191 1.482 25139 10254 1 18 . 1 1 110 110 GLU H H 110 8.509 8.509 8.468 0.041 25139 10255 1 18 . 1 1 111 111 ASP N N 111 121.160 121.160 119.610 1.550 25139 10256 1 18 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.466 0.104 25139 10257 1 18 . 1 1 111 111 ASP C C 111 175.089 175.089 175.186 -0.097 25139 10258 1 18 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.160 -1.569 25139 10259 1 18 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.229 1.203 25139 10260 1 18 . 1 1 111 111 ASP H H 111 8.916 8.916 8.489 0.427 25139 10261 1 18 . 1 1 112 112 ALA N N 112 122.130 122.130 117.603 4.527 25139 10262 1 18 . 1 1 112 112 ALA C C 112 178.120 178.120 175.757 2.363 25139 10263 1 18 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.278 2.981 25139 10264 1 18 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.762 -1.992 25139 10265 1 18 . 1 1 112 112 ALA H H 112 7.361 7.361 7.329 0.032 25139 10266 1 18 . 1 1 113 113 ILE N N 113 113.780 113.780 113.967 -0.187 25139 10267 1 18 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.937 -0.051 25139 10268 1 18 . 1 1 113 113 ILE C C 113 174.258 174.258 174.762 -0.504 25139 10269 1 18 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.086 0.426 25139 10270 1 18 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.803 0.045 25139 10271 1 18 . 1 1 113 113 ILE H H 113 7.667 7.667 8.404 -0.737 25139 10272 1 18 . 1 1 114 114 ALA N N 114 122.673 122.673 124.956 -2.283 25139 10273 1 18 . 1 1 114 114 ALA C C 114 176.984 176.984 176.678 0.306 25139 10274 1 18 . 1 1 114 114 ALA CA C 114 51.564 51.564 52.639 -1.075 25139 10275 1 18 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.698 0.884 25139 10276 1 18 . 1 1 114 114 ALA H H 114 8.904 8.904 8.549 0.355 25139 10277 1 18 . 1 1 115 115 ALA N N 115 116.486 116.486 116.491 -0.005 25139 10278 1 18 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.432 -0.077 25139 10279 1 18 . 1 1 115 115 ALA C C 115 174.138 174.138 174.182 -0.044 25139 10280 1 18 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.680 1.640 25139 10281 1 18 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.206 1.777 25139 10282 1 18 . 1 1 115 115 ALA H H 115 7.182 7.182 7.217 -0.035 25139 10283 1 18 . 1 1 116 116 CYS N N 116 120.099 120.099 119.508 0.591 25139 10284 1 18 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.114 0.217 25139 10285 1 18 . 1 1 116 116 CYS C C 116 176.609 176.609 172.494 4.115 25139 10286 1 18 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.133 -2.184 25139 10287 1 18 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.925 11.459 25139 10288 1 18 . 1 1 116 116 CYS H H 116 8.298 8.298 7.826 0.472 25139 10289 1 18 . 1 1 117 117 PHE N N 117 126.406 126.406 125.207 1.199 25139 10290 1 18 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.192 0.007 25139 10291 1 18 . 1 1 117 117 PHE C C 117 173.385 173.385 174.054 -0.669 25139 10292 1 18 . 1 1 117 117 PHE CA C 117 56.254 56.254 55.967 0.287 25139 10293 1 18 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.536 0.145 25139 10294 1 18 . 1 1 117 117 PHE H H 117 9.712 9.712 9.101 0.611 25139 10295 1 18 . 1 1 118 118 LEU N N 118 122.119 122.119 124.486 -2.367 25139 10296 1 18 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.408 -0.242 25139 10297 1 18 . 1 1 118 118 LEU C C 118 175.097 175.097 175.982 -0.885 25139 10298 1 18 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.438 -0.534 25139 10299 1 18 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.538 -1.240 25139 10300 1 18 . 1 1 118 118 LEU H H 118 8.719 8.719 9.420 -0.701 25139 10301 1 18 . 1 1 119 119 ILE N N 119 125.324 125.324 122.800 2.524 25139 10302 1 18 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.911 -0.034 25139 10303 1 18 . 1 1 119 119 ILE C C 119 173.825 173.825 175.607 -1.782 25139 10304 1 18 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.940 -0.833 25139 10305 1 18 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.000 -0.490 25139 10306 1 18 . 1 1 119 119 ILE H H 119 8.986 8.986 9.047 -0.061 25139 10307 1 18 . 1 1 120 120 ASN N N 120 121.534 121.534 124.863 -3.329 25139 10308 1 18 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.810 0.580 25139 10309 1 18 . 1 1 120 120 ASN C C 120 176.098 176.098 175.910 0.188 25139 10310 1 18 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.834 -4.377 25139 10311 1 18 . 1 1 120 120 ASN CB C 120 39.918 39.918 39.187 0.731 25139 10312 1 18 . 1 1 120 120 ASN H H 120 8.694 8.694 9.089 -0.395 25139 10313 1 18 . 1 1 121 121 CYS N N 121 122.779 122.779 116.161 6.618 25139 10314 1 18 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.124 0.359 25139 10315 1 18 . 1 1 121 121 CYS C C 121 173.195 173.195 173.762 -0.567 25139 10316 1 18 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.951 -4.187 25139 10317 1 18 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.406 16.301 25139 10318 1 18 . 1 1 121 121 CYS H H 121 10.668 10.668 8.614 2.054 25139 10319 1 18 . 1 1 122 122 LEU N N 122 121.063 121.063 119.205 1.858 25139 10320 1 18 . 1 1 122 122 LEU HA H 122 5.365 5.365 4.823 0.542 25139 10321 1 18 . 1 1 122 122 LEU C C 122 176.743 176.743 174.948 1.795 25139 10322 1 18 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.649 0.015 25139 10323 1 18 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.051 -0.817 25139 10324 1 18 . 1 1 122 122 LEU H H 122 8.256 8.256 8.018 0.238 25139 10325 1 18 . 1 1 123 123 TYR N N 123 123.081 123.081 122.524 0.557 25139 10326 1 18 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.667 -0.624 25139 10327 1 18 . 1 1 123 123 TYR C C 123 173.633 173.633 174.917 -1.284 25139 10328 1 18 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.090 -0.202 25139 10329 1 18 . 1 1 123 123 TYR CB C 123 41.081 41.081 40.428 0.653 25139 10330 1 18 . 1 1 123 123 TYR H H 123 8.990 8.990 8.724 0.266 25139 10331 1 18 . 1 1 124 124 GLU N N 124 128.742 128.742 125.994 2.748 25139 10332 1 18 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.738 -0.188 25139 10333 1 18 . 1 1 124 124 GLU C C 124 174.835 174.835 175.550 -0.715 25139 10334 1 18 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.307 0.325 25139 10335 1 18 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.110 -0.215 25139 10336 1 18 . 1 1 124 124 GLU H H 124 9.135 9.135 8.683 0.452 25139 10337 1 18 . 1 1 125 125 GLN N N 125 108.066 108.066 112.289 -4.223 25139 10338 1 18 . 1 1 125 125 GLN HA H 125 3.721 3.721 4.085 -0.364 25139 10339 1 18 . 1 1 125 125 GLN C C 125 174.627 174.627 175.988 -1.361 25139 10340 1 18 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.510 0.529 25139 10341 1 18 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.550 -0.222 25139 10342 1 18 . 1 1 125 125 GLN H H 125 8.390 8.390 8.379 0.011 25139 10343 1 18 . 1 1 126 126 ASN N N 126 118.528 118.528 117.745 0.783 25139 10344 1 18 . 1 1 126 126 ASN C C 126 173.713 173.713 175.489 -1.776 25139 10345 1 18 . 1 1 126 126 ASN CA C 126 52.189 52.189 53.871 -1.682 25139 10346 1 18 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.022 1.779 25139 10347 1 18 . 1 1 126 126 ASN H H 126 8.092 8.092 8.051 0.041 25139 10348 1 18 . 1 1 127 127 PHE N N 127 124.680 124.680 118.079 6.601 25139 10349 1 18 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.474 0.563 25139 10350 1 18 . 1 1 127 127 PHE C C 127 177.125 177.125 176.256 0.869 25139 10351 1 18 . 1 1 127 127 PHE CA C 127 58.413 58.413 58.312 0.101 25139 10352 1 18 . 1 1 127 127 PHE CB C 127 39.244 39.244 37.920 1.324 25139 10353 1 18 . 1 1 127 127 PHE H H 127 9.026 9.026 7.915 1.111 25139 10354 1 18 . 1 1 128 128 VAL N N 128 119.455 119.455 115.451 4.004 25139 10355 1 18 . 1 1 128 128 VAL C C 128 175.886 175.886 175.726 0.160 25139 10356 1 18 . 1 1 128 128 VAL CA C 128 60.919 60.919 62.020 -1.101 25139 10357 1 18 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.220 2.974 25139 10358 1 18 . 1 1 128 128 VAL H H 128 8.364 8.364 7.736 0.628 25139 10359 1 18 . 1 1 129 129 CYS N N 129 116.130 116.130 121.159 -5.029 25139 10360 1 18 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.971 -0.494 25139 10361 1 18 . 1 1 129 129 CYS C C 129 170.569 170.569 174.411 -3.842 25139 10362 1 18 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.297 -3.147 25139 10363 1 18 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.309 18.308 25139 10364 1 18 . 1 1 129 129 CYS H H 129 5.390 5.390 6.619 -1.229 25139 10365 1 18 . 1 1 130 130 LYS N N 130 120.071 120.071 125.335 -5.264 25139 10366 1 18 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.178 0.383 25139 10367 1 18 . 1 1 130 130 LYS C C 130 176.853 176.853 174.399 2.454 25139 10368 1 18 . 1 1 130 130 LYS CA C 130 53.887 53.887 53.931 -0.044 25139 10369 1 18 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.773 0.869 25139 10370 1 18 . 1 1 130 130 LYS H H 130 8.066 8.066 8.222 -0.156 25139 10371 1 18 . 1 1 131 131 PHE N N 131 118.415 118.415 119.989 -1.574 25139 10372 1 18 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.416 -0.809 25139 10373 1 18 . 1 1 131 131 PHE C C 131 174.013 174.013 175.209 -1.196 25139 10374 1 18 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.127 1.584 25139 10375 1 18 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.251 0.829 25139 10376 1 18 . 1 1 131 131 PHE H H 131 8.714 8.714 8.226 0.488 25139 10377 1 18 . 1 1 132 132 ALA N N 132 124.209 124.209 122.773 1.436 25139 10378 1 18 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.004 -0.387 25139 10379 1 18 . 1 1 132 132 ALA C C 132 174.352 174.352 174.320 0.032 25139 10380 1 18 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.585 1.856 25139 10381 1 18 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.820 -0.356 25139 10382 1 18 . 1 1 132 132 ALA H H 132 9.295 9.295 9.035 0.260 25139 10383 1 18 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.302 -0.419 25139 10384 1 18 . 1 1 133 133 PRO C C 133 173.923 173.923 176.488 -2.565 25139 10385 1 18 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.621 0.450 25139 10386 1 18 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.292 -0.689 25139 10387 1 18 . 1 1 134 134 ARG N N 134 126.071 126.071 122.503 3.568 25139 10388 1 18 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.659 -0.404 25139 10389 1 18 . 1 1 134 134 ARG C C 134 177.065 177.065 177.649 -0.584 25139 10390 1 18 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.685 2.479 25139 10391 1 18 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.544 -1.361 25139 10392 1 18 . 1 1 134 134 ARG H H 134 8.672 8.672 8.598 0.074 25139 10393 1 18 . 1 1 135 135 GLU N N 135 125.683 125.683 122.488 3.195 25139 10394 1 18 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.298 0.055 25139 10395 1 18 . 1 1 135 135 GLU C C 135 178.081 178.081 177.017 1.064 25139 10396 1 18 . 1 1 135 135 GLU CA C 135 57.651 57.651 58.218 -0.567 25139 10397 1 18 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.872 0.124 25139 10398 1 18 . 1 1 135 135 GLU H H 135 8.603 8.603 9.035 -0.432 25139 10399 1 18 . 1 1 136 136 GLY N N 136 110.031 110.031 107.123 2.908 25139 10400 1 18 . 1 1 136 136 GLY C C 136 173.079 173.079 173.574 -0.495 25139 10401 1 18 . 1 1 136 136 GLY CA C 136 45.778 45.778 45.188 0.591 25139 10402 1 18 . 1 1 136 136 GLY H H 136 9.036 9.036 8.268 0.768 25139 10403 1 18 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.525 1.150 25139 10404 1 18 . 1 1 137 137 PHE C C 137 174.936 174.936 175.253 -0.317 25139 10405 1 18 . 1 1 137 137 PHE CA C 137 56.084 56.084 58.416 -2.332 25139 10406 1 18 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.461 5.235 25139 10407 1 18 . 1 1 138 138 ILE N N 138 117.417 117.417 114.241 3.176 25139 10408 1 18 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.698 -0.191 25139 10409 1 18 . 1 1 138 138 ILE C C 138 173.858 173.858 173.448 0.410 25139 10410 1 18 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.679 0.941 25139 10411 1 18 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.087 1.510 25139 10412 1 18 . 1 1 138 138 ILE H H 138 8.777 8.777 7.963 0.814 25139 10413 1 18 . 1 1 139 139 ASN N N 139 117.201 117.201 116.721 0.480 25139 10414 1 18 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.483 0.576 25139 10415 1 18 . 1 1 139 139 ASN C C 139 173.721 173.721 173.743 -0.022 25139 10416 1 18 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.834 -1.604 25139 10417 1 18 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.569 1.292 25139 10418 1 18 . 1 1 139 139 ASN H H 139 8.872 8.872 8.287 0.585 25139 10419 1 18 . 1 1 140 140 TYR N N 140 123.991 123.991 118.768 5.223 25139 10420 1 18 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.953 0.225 25139 10421 1 18 . 1 1 140 140 TYR C C 140 174.791 174.791 175.167 -0.376 25139 10422 1 18 . 1 1 140 140 TYR CA C 140 57.072 57.072 57.824 -0.752 25139 10423 1 18 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.179 1.491 25139 10424 1 18 . 1 1 140 140 TYR H H 140 9.526 9.526 9.044 0.482 25139 10425 1 18 . 1 1 141 141 LEU N N 141 122.779 122.779 120.695 2.084 25139 10426 1 18 . 1 1 141 141 LEU C C 141 175.404 175.404 177.573 -2.169 25139 10427 1 18 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.813 2.289 25139 10428 1 18 . 1 1 141 141 LEU CB C 141 45.161 45.161 46.093 -0.932 25139 10429 1 18 . 1 1 141 141 LEU H H 141 9.010 9.010 9.070 -0.060 25139 10430 1 18 . 1 1 142 142 THR N N 142 113.189 113.189 113.091 0.098 25139 10431 1 18 . 1 1 142 142 THR HA H 142 4.061 4.061 4.309 -0.248 25139 10432 1 18 . 1 1 142 142 THR C C 142 175.940 175.940 176.341 -0.401 25139 10433 1 18 . 1 1 142 142 THR CA C 142 61.389 61.389 60.776 0.613 25139 10434 1 18 . 1 1 142 142 THR CB C 142 69.779 69.779 70.295 -0.516 25139 10435 1 18 . 1 1 142 142 THR H H 142 7.737 7.737 8.287 -0.550 25139 10436 1 18 . 1 1 143 143 ARG N N 143 120.975 120.975 120.959 0.016 25139 10437 1 18 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.979 -0.041 25139 10438 1 18 . 1 1 143 143 ARG C C 143 178.690 178.690 176.986 1.704 25139 10439 1 18 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.491 1.257 25139 10440 1 18 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.257 0.888 25139 10441 1 18 . 1 1 143 143 ARG H H 143 8.149 8.149 8.443 -0.294 25139 10442 1 18 . 1 1 144 144 GLU N N 144 116.997 116.997 117.969 -0.972 25139 10443 1 18 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.302 -0.193 25139 10444 1 18 . 1 1 144 144 GLU C C 144 178.442 178.442 177.625 0.817 25139 10445 1 18 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.109 1.754 25139 10446 1 18 . 1 1 144 144 GLU CB C 144 29.582 29.582 29.760 -0.178 25139 10447 1 18 . 1 1 144 144 GLU H H 144 8.622 8.622 7.482 1.140 25139 10448 1 18 . 1 1 145 145 VAL N N 145 111.213 111.213 118.480 -7.267 25139 10449 1 18 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.877 0.534 25139 10450 1 18 . 1 1 145 145 VAL C C 145 176.965 176.965 176.340 0.625 25139 10451 1 18 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.501 0.093 25139 10452 1 18 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.627 -0.545 25139 10453 1 18 . 1 1 145 145 VAL H H 145 7.227 7.227 7.521 -0.294 25139 10454 1 18 . 1 1 146 146 TYR N N 146 123.512 123.512 121.690 1.822 25139 10455 1 18 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.032 -0.152 25139 10456 1 18 . 1 1 146 146 TYR C C 146 176.377 176.377 176.948 -0.571 25139 10457 1 18 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.822 0.715 25139 10458 1 18 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.453 -0.114 25139 10459 1 18 . 1 1 146 146 TYR H H 146 8.492 8.492 8.665 -0.173 25139 10460 1 18 . 1 1 147 147 ARG N N 147 116.680 116.680 117.475 -0.795 25139 10461 1 18 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.755 0.059 25139 10462 1 18 . 1 1 147 147 ARG C C 147 178.858 178.858 177.963 0.895 25139 10463 1 18 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.952 -0.256 25139 10464 1 18 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.755 -0.090 25139 10465 1 18 . 1 1 147 147 ARG H H 147 8.053 8.053 8.651 -0.598 25139 10466 1 18 . 1 1 148 148 SER N N 148 115.306 115.306 114.885 0.421 25139 10467 1 18 . 1 1 148 148 SER HA H 148 3.998 3.998 4.403 -0.405 25139 10468 1 18 . 1 1 148 148 SER C C 148 175.786 175.786 175.889 -0.103 25139 10469 1 18 . 1 1 148 148 SER CA C 148 62.006 62.006 60.828 1.178 25139 10470 1 18 . 1 1 148 148 SER H H 148 7.139 7.139 7.481 -0.342 25139 10471 1 18 . 1 1 149 149 TYR N N 149 123.207 123.207 122.349 0.858 25139 10472 1 18 . 1 1 149 149 TYR C C 149 175.831 175.831 177.857 -2.026 25139 10473 1 18 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.478 -0.878 25139 10474 1 18 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.499 0.282 25139 10475 1 18 . 1 1 149 149 TYR H H 149 7.253 7.253 7.344 -0.091 25139 10476 1 18 . 1 1 150 150 ARG N N 150 118.708 118.708 117.038 1.670 25139 10477 1 18 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.957 -0.611 25139 10478 1 18 . 1 1 150 150 ARG C C 150 177.644 177.644 178.010 -0.366 25139 10479 1 18 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.401 -0.077 25139 10480 1 18 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.533 -0.679 25139 10481 1 18 . 1 1 150 150 ARG H H 150 8.441 8.441 7.619 0.822 25139 10482 1 18 . 1 1 151 151 GLN N N 151 116.551 116.551 115.495 1.056 25139 10483 1 18 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.141 -0.184 25139 10484 1 18 . 1 1 151 151 GLN C C 151 177.987 177.987 176.776 1.211 25139 10485 1 18 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.656 0.685 25139 10486 1 18 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.872 -0.408 25139 10487 1 18 . 1 1 151 151 GLN H H 151 7.332 7.332 7.465 -0.133 25139 10488 1 18 . 1 1 152 152 LEU N N 152 118.877 118.877 113.505 5.372 25139 10489 1 18 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.577 -0.398 25139 10490 1 18 . 1 1 152 152 LEU C C 152 179.070 179.070 177.387 1.683 25139 10491 1 18 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.021 1.061 25139 10492 1 18 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.399 -0.711 25139 10493 1 18 . 1 1 152 152 LEU H H 152 7.106 7.106 7.253 -0.147 25139 10494 1 18 . 1 1 153 153 VAL N N 153 119.076 119.076 112.124 6.952 25139 10495 1 18 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.955 -1.095 25139 10496 1 18 . 1 1 153 153 VAL C C 153 177.421 177.421 175.498 1.923 25139 10497 1 18 . 1 1 153 153 VAL CA C 153 64.583 64.583 61.428 3.155 25139 10498 1 18 . 1 1 153 153 VAL CB C 153 31.518 31.518 32.738 -1.220 25139 10499 1 18 . 1 1 153 153 VAL H H 153 7.427 7.427 7.167 0.260 25139 10500 1 18 . 1 1 154 154 ASP N N 154 119.888 119.888 120.373 -0.485 25139 10501 1 18 . 1 1 154 154 ASP C C 154 177.422 177.422 174.829 2.593 25139 10502 1 18 . 1 1 154 154 ASP CA C 154 56.071 56.071 52.768 3.303 25139 10503 1 18 . 1 1 154 154 ASP CB C 154 40.349 40.349 43.713 -3.364 25139 10504 1 18 . 1 1 154 154 ASP H H 154 7.930 7.930 7.335 0.595 25139 10505 1 18 . 1 1 155 155 HIS N N 155 117.821 117.821 119.093 -1.272 25139 10506 1 18 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.271 2.485 25139 10507 1 18 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.478 -0.298 25139 10508 1 18 . 1 1 155 155 HIS H H 155 7.680 7.680 8.133 -0.453 25139 10509 1 18 . 1 1 156 156 HIS N N 156 119.180 119.180 120.036 -0.856 25139 10510 1 18 . 1 1 156 156 HIS CA C 156 57.931 57.931 54.743 3.188 25139 10511 1 18 . 1 1 156 156 HIS CB C 156 30.300 30.300 28.495 1.805 25139 10512 1 18 . 1 1 156 156 HIS H H 156 7.868 7.868 7.980 -0.112 25139 10513 1 19 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.302 0.602 25139 10514 1 19 . 1 1 48 48 ALA CB C 48 19.222 19.222 19.180 0.042 25139 10515 1 19 . 1 1 49 49 ASP N N 49 119.661 119.661 119.402 0.259 25139 10516 1 19 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.468 -0.191 25139 10517 1 19 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.762 -0.700 25139 10518 1 19 . 1 1 49 49 ASP H H 49 8.462 8.462 7.895 0.567 25139 10519 1 19 . 1 1 51 51 LEU HA H 51 4.052 4.052 3.859 0.193 25139 10520 1 19 . 1 1 51 51 LEU C C 51 178.514 178.514 178.478 0.036 25139 10521 1 19 . 1 1 51 51 LEU CA C 51 58.049 58.049 57.250 0.799 25139 10522 1 19 . 1 1 51 51 LEU CB C 51 41.193 41.193 40.701 0.492 25139 10523 1 19 . 1 1 52 52 ASN N N 52 113.819 113.819 118.204 -4.385 25139 10524 1 19 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.597 0.238 25139 10525 1 19 . 1 1 52 52 ASN C C 52 175.964 175.964 176.103 -0.139 25139 10526 1 19 . 1 1 52 52 ASN CA C 52 54.096 54.096 55.050 -0.954 25139 10527 1 19 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.177 -0.294 25139 10528 1 19 . 1 1 52 52 ASN H H 52 7.853 7.853 8.464 -0.611 25139 10529 1 19 . 1 1 53 53 SER N N 53 114.357 114.357 113.703 0.654 25139 10530 1 19 . 1 1 53 53 SER CA C 53 59.908 59.908 59.728 0.180 25139 10531 1 19 . 1 1 53 53 SER CB C 53 64.395 64.395 63.391 1.004 25139 10532 1 19 . 1 1 53 53 SER H H 53 8.023 8.023 8.016 0.007 25139 10533 1 19 . 1 1 54 54 PHE N N 54 121.037 121.037 119.125 1.912 25139 10534 1 19 . 1 1 54 54 PHE C C 54 175.522 175.522 176.200 -0.678 25139 10535 1 19 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.873 1.191 25139 10536 1 19 . 1 1 54 54 PHE CB C 54 43.053 43.053 43.130 -0.077 25139 10537 1 19 . 1 1 54 54 PHE H H 54 7.731 7.731 7.627 0.104 25139 10538 1 19 . 1 1 55 55 THR N N 55 116.535 116.535 117.593 -1.058 25139 10539 1 19 . 1 1 55 55 THR HA H 55 4.654 4.654 4.741 -0.087 25139 10540 1 19 . 1 1 55 55 THR C C 55 173.301 173.301 173.985 -0.684 25139 10541 1 19 . 1 1 55 55 THR CA C 55 61.420 61.420 60.663 0.757 25139 10542 1 19 . 1 1 55 55 THR CB C 55 71.388 71.388 71.896 -0.508 25139 10543 1 19 . 1 1 55 55 THR H H 55 8.929 8.929 9.099 -0.170 25139 10544 1 19 . 1 1 56 56 ALA N N 56 129.359 129.359 128.533 0.826 25139 10545 1 19 . 1 1 56 56 ALA HA H 56 4.315 4.315 3.735 0.580 25139 10546 1 19 . 1 1 56 56 ALA C C 56 178.305 178.305 177.962 0.343 25139 10547 1 19 . 1 1 56 56 ALA CA C 56 52.871 52.871 51.908 0.962 25139 10548 1 19 . 1 1 56 56 ALA CB C 56 19.324 19.324 17.781 1.543 25139 10549 1 19 . 1 1 56 56 ALA H H 56 8.907 8.907 8.861 0.046 25139 10550 1 19 . 1 1 57 57 GLY N N 57 106.331 106.331 108.218 -1.887 25139 10551 1 19 . 1 1 57 57 GLY CA C 57 44.611 44.611 45.156 -0.545 25139 10552 1 19 . 1 1 57 57 GLY H H 57 7.978 7.978 7.799 0.179 25139 10553 1 19 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.396 -0.072 25139 10554 1 19 . 1 1 59 59 PRO C C 59 177.466 177.466 177.961 -0.495 25139 10555 1 19 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.043 1.441 25139 10556 1 19 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.119 -0.384 25139 10557 1 19 . 1 1 60 60 GLY N N 60 109.688 109.688 109.169 0.519 25139 10558 1 19 . 1 1 60 60 GLY C C 60 173.555 173.555 173.136 0.419 25139 10559 1 19 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.021 0.520 25139 10560 1 19 . 1 1 60 60 GLY H H 60 8.402 8.402 8.704 -0.302 25139 10561 1 19 . 1 1 61 61 PHE N N 61 122.491 122.491 121.455 1.036 25139 10562 1 19 . 1 1 61 61 PHE C C 61 175.146 175.146 174.540 0.606 25139 10563 1 19 . 1 1 61 61 PHE CA C 61 58.282 58.282 57.022 1.260 25139 10564 1 19 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.911 -2.212 25139 10565 1 19 . 1 1 61 61 PHE H H 61 7.957 7.957 7.303 0.654 25139 10566 1 19 . 1 1 62 62 VAL N N 62 121.128 121.128 116.209 4.919 25139 10567 1 19 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.315 -0.230 25139 10568 1 19 . 1 1 62 62 VAL C C 62 174.937 174.937 174.547 0.390 25139 10569 1 19 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.032 0.675 25139 10570 1 19 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.988 0.444 25139 10571 1 19 . 1 1 62 62 VAL H H 62 7.994 7.994 9.067 -1.073 25139 10572 1 19 . 1 1 63 63 LEU N N 63 124.386 124.386 122.783 1.603 25139 10573 1 19 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.701 -1.385 25139 10574 1 19 . 1 1 63 63 LEU C C 63 175.278 175.278 177.478 -2.200 25139 10575 1 19 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.945 0.343 25139 10576 1 19 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.755 1.363 25139 10577 1 19 . 1 1 63 63 LEU H H 63 7.572 7.572 8.760 -1.188 25139 10578 1 19 . 1 1 64 64 ASP N N 64 126.746 126.746 124.972 1.774 25139 10579 1 19 . 1 1 64 64 ASP C C 64 177.801 177.801 176.988 0.813 25139 10580 1 19 . 1 1 64 64 ASP CA C 64 51.721 51.721 55.404 -3.683 25139 10581 1 19 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.976 -0.578 25139 10582 1 19 . 1 1 64 64 ASP H H 64 8.552 8.552 8.582 -0.030 25139 10583 1 19 . 1 1 65 65 THR C C 65 175.002 175.002 175.206 -0.204 25139 10584 1 19 . 1 1 65 65 THR CB C 65 67.919 67.919 66.715 1.204 25139 10585 1 19 . 1 1 66 66 GLN N N 66 120.804 120.804 120.725 0.079 25139 10586 1 19 . 1 1 66 66 GLN HA H 66 3.877 3.877 3.984 -0.107 25139 10587 1 19 . 1 1 66 66 GLN C C 66 178.901 178.901 177.573 1.328 25139 10588 1 19 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.470 0.946 25139 10589 1 19 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.348 -0.424 25139 10590 1 19 . 1 1 66 66 GLN H H 66 8.447 8.447 8.170 0.277 25139 10591 1 19 . 1 1 67 67 ALA N N 67 121.267 121.267 121.602 -0.335 25139 10592 1 19 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.106 -0.149 25139 10593 1 19 . 1 1 67 67 ALA C C 67 176.777 176.777 178.318 -1.541 25139 10594 1 19 . 1 1 67 67 ALA CA C 67 54.324 54.324 54.475 -0.151 25139 10595 1 19 . 1 1 67 67 ALA CB C 67 18.620 18.620 17.860 0.760 25139 10596 1 19 . 1 1 67 67 ALA H H 67 7.791 7.791 7.756 0.035 25139 10597 1 19 . 1 1 68 68 SER N N 68 113.339 113.339 112.737 0.602 25139 10598 1 19 . 1 1 68 68 SER HA H 68 4.061 4.061 4.120 -0.059 25139 10599 1 19 . 1 1 68 68 SER C C 68 175.875 175.875 176.548 -0.673 25139 10600 1 19 . 1 1 68 68 SER CA C 68 62.970 62.970 60.158 2.812 25139 10601 1 19 . 1 1 68 68 SER CB C 68 61.330 61.330 63.057 -1.727 25139 10602 1 19 . 1 1 68 68 SER H H 68 7.785 7.785 7.817 -0.032 25139 10603 1 19 . 1 1 69 69 VAL N N 69 125.140 125.140 116.527 8.613 25139 10604 1 19 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.253 -0.177 25139 10605 1 19 . 1 1 69 69 VAL C C 69 176.384 176.384 177.016 -0.632 25139 10606 1 19 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.630 1.101 25139 10607 1 19 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.462 0.027 25139 10608 1 19 . 1 1 69 69 VAL H H 69 8.572 8.572 7.797 0.775 25139 10609 1 19 . 1 1 70 70 SER N N 70 116.704 116.704 114.425 2.279 25139 10610 1 19 . 1 1 70 70 SER HA H 70 4.229 4.229 4.286 -0.057 25139 10611 1 19 . 1 1 70 70 SER C C 70 174.101 174.101 175.273 -1.172 25139 10612 1 19 . 1 1 70 70 SER CA C 70 61.627 61.627 59.618 2.009 25139 10613 1 19 . 1 1 70 70 SER H H 70 7.951 7.951 7.777 0.174 25139 10614 1 19 . 1 1 71 71 ASN N N 71 117.576 117.576 117.232 0.344 25139 10615 1 19 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.658 0.144 25139 10616 1 19 . 1 1 71 71 ASN C C 71 174.332 174.332 174.801 -0.469 25139 10617 1 19 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.729 -0.290 25139 10618 1 19 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.022 0.445 25139 10619 1 19 . 1 1 71 71 ASN H H 71 7.131 7.131 7.521 -0.390 25139 10620 1 19 . 1 1 72 72 GLY N N 72 103.925 103.925 105.444 -1.519 25139 10621 1 19 . 1 1 72 72 GLY C C 72 174.710 174.710 173.507 1.203 25139 10622 1 19 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.464 0.085 25139 10623 1 19 . 1 1 72 72 GLY H H 72 7.338 7.338 7.373 -0.035 25139 10624 1 19 . 1 1 73 73 ALA N N 73 124.942 124.942 123.286 1.656 25139 10625 1 19 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.502 -0.330 25139 10626 1 19 . 1 1 73 73 ALA C C 73 175.896 175.896 176.339 -0.443 25139 10627 1 19 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.878 0.795 25139 10628 1 19 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.062 -0.006 25139 10629 1 19 . 1 1 73 73 ALA H H 73 8.032 8.032 7.726 0.306 25139 10630 1 19 . 1 1 74 74 THR N N 74 113.423 113.423 116.967 -3.544 25139 10631 1 19 . 1 1 74 74 THR HA H 74 4.678 4.678 4.589 0.089 25139 10632 1 19 . 1 1 74 74 THR C C 74 173.339 173.339 173.246 0.093 25139 10633 1 19 . 1 1 74 74 THR CA C 74 61.545 61.545 60.611 0.934 25139 10634 1 19 . 1 1 74 74 THR CB C 74 71.319 71.319 71.281 0.038 25139 10635 1 19 . 1 1 74 74 THR H H 74 8.530 8.530 8.286 0.244 25139 10636 1 19 . 1 1 75 75 PHE N N 75 128.180 128.180 129.551 -1.371 25139 10637 1 19 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.872 -0.268 25139 10638 1 19 . 1 1 75 75 PHE C C 75 174.623 174.623 174.890 -0.267 25139 10639 1 19 . 1 1 75 75 PHE CA C 75 57.616 57.616 56.674 0.942 25139 10640 1 19 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.701 -0.026 25139 10641 1 19 . 1 1 75 75 PHE H H 75 9.146 9.146 9.144 0.002 25139 10642 1 19 . 1 1 76 76 LEU N N 76 127.849 127.849 126.002 1.847 25139 10643 1 19 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.755 -0.404 25139 10644 1 19 . 1 1 76 76 LEU C C 76 176.339 176.339 176.380 -0.041 25139 10645 1 19 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.364 0.619 25139 10646 1 19 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.778 -0.447 25139 10647 1 19 . 1 1 76 76 LEU H H 76 8.635 8.635 8.520 0.115 25139 10648 1 19 . 1 1 77 77 GLU N N 77 115.131 115.131 120.801 -5.670 25139 10649 1 19 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.615 -0.207 25139 10650 1 19 . 1 1 77 77 GLU C C 77 174.734 174.734 174.843 -0.109 25139 10651 1 19 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.466 0.887 25139 10652 1 19 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.755 0.452 25139 10653 1 19 . 1 1 77 77 GLU H H 77 7.252 7.252 7.896 -0.644 25139 10654 1 19 . 1 1 78 78 SER N N 78 118.016 118.016 119.344 -1.328 25139 10655 1 19 . 1 1 78 78 SER HA H 78 5.561 5.561 5.336 0.225 25139 10656 1 19 . 1 1 78 78 SER C C 78 171.968 171.968 172.822 -0.854 25139 10657 1 19 . 1 1 78 78 SER CA C 78 54.061 54.061 55.146 -1.085 25139 10658 1 19 . 1 1 78 78 SER CB C 78 64.074 64.074 63.509 0.565 25139 10659 1 19 . 1 1 78 78 SER H H 78 9.033 9.033 8.736 0.297 25139 10660 1 19 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.826 -0.226 25139 10661 1 19 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.368 0.042 25139 10662 1 19 . 1 1 80 80 THR N N 80 118.079 118.079 113.720 4.359 25139 10663 1 19 . 1 1 80 80 THR HA H 80 4.342 4.342 4.360 -0.018 25139 10664 1 19 . 1 1 80 80 THR C C 80 174.494 174.494 174.443 0.051 25139 10665 1 19 . 1 1 80 80 THR CA C 80 61.453 61.453 59.864 1.589 25139 10666 1 19 . 1 1 80 80 THR CB C 80 67.797 67.797 68.844 -1.047 25139 10667 1 19 . 1 1 80 80 THR H H 80 8.670 8.670 8.156 0.514 25139 10668 1 19 . 1 1 81 81 VAL N N 81 117.395 117.395 119.580 -2.185 25139 10669 1 19 . 1 1 81 81 VAL HA H 81 4.607 4.607 4.118 0.489 25139 10670 1 19 . 1 1 81 81 VAL C C 81 175.518 175.518 176.107 -0.589 25139 10671 1 19 . 1 1 81 81 VAL CA C 81 59.114 59.114 61.966 -2.852 25139 10672 1 19 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.364 2.231 25139 10673 1 19 . 1 1 81 81 VAL H H 81 7.448 7.448 7.458 -0.010 25139 10674 1 19 . 1 1 82 82 ARG N N 82 117.852 117.852 120.624 -2.772 25139 10675 1 19 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.473 0.048 25139 10676 1 19 . 1 1 82 82 ARG C C 82 176.992 176.992 175.698 1.294 25139 10677 1 19 . 1 1 82 82 ARG CA C 82 56.385 56.385 56.411 -0.027 25139 10678 1 19 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.725 0.877 25139 10679 1 19 . 1 1 82 82 ARG H H 82 8.710 8.710 8.627 0.083 25139 10680 1 19 . 1 1 83 83 ARG N N 83 117.035 117.035 118.016 -0.981 25139 10681 1 19 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.627 0.695 25139 10682 1 19 . 1 1 83 83 ARG C C 83 177.379 177.379 176.905 0.474 25139 10683 1 19 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.358 -0.674 25139 10684 1 19 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.786 -0.745 25139 10685 1 19 . 1 1 83 83 ARG H H 83 7.292 7.292 7.675 -0.383 25139 10686 1 19 . 1 1 84 84 GLY N N 84 114.911 114.911 110.202 4.709 25139 10687 1 19 . 1 1 84 84 GLY C C 84 176.940 176.940 175.210 1.730 25139 10688 1 19 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.782 1.890 25139 10689 1 19 . 1 1 84 84 GLY H H 84 9.255 9.255 8.947 0.308 25139 10690 1 19 . 1 1 85 85 TRP N N 85 121.810 121.810 120.601 1.209 25139 10691 1 19 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.216 -0.049 25139 10692 1 19 . 1 1 85 85 TRP C C 85 178.272 178.272 177.228 1.044 25139 10693 1 19 . 1 1 85 85 TRP CA C 85 60.045 60.045 58.965 1.080 25139 10694 1 19 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.108 0.108 25139 10695 1 19 . 1 1 85 85 TRP H H 85 9.963 9.963 7.702 2.261 25139 10696 1 19 . 1 1 86 86 ASP N N 86 116.400 116.400 120.064 -3.664 25139 10697 1 19 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.410 -0.017 25139 10698 1 19 . 1 1 86 86 ASP C C 86 178.803 178.803 178.112 0.691 25139 10699 1 19 . 1 1 86 86 ASP CA C 86 57.054 57.054 57.309 -0.255 25139 10700 1 19 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.346 0.387 25139 10701 1 19 . 1 1 86 86 ASP H H 86 6.934 6.934 7.603 -0.669 25139 10702 1 19 . 1 1 87 87 CYS N N 87 122.454 122.454 119.382 3.072 25139 10703 1 19 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.208 0.042 25139 10704 1 19 . 1 1 87 87 CYS C C 87 174.956 174.956 176.737 -1.781 25139 10705 1 19 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.366 -4.219 25139 10706 1 19 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.049 11.437 25139 10707 1 19 . 1 1 87 87 CYS H H 87 7.603 7.603 7.523 0.080 25139 10708 1 19 . 1 1 88 88 VAL N N 88 119.192 119.192 120.461 -1.269 25139 10709 1 19 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.215 -0.757 25139 10710 1 19 . 1 1 88 88 VAL C C 88 177.413 177.413 177.708 -0.295 25139 10711 1 19 . 1 1 88 88 VAL CA C 88 66.976 66.976 66.171 0.805 25139 10712 1 19 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.043 -0.801 25139 10713 1 19 . 1 1 88 88 VAL H H 88 7.192 7.192 7.629 -0.437 25139 10714 1 19 . 1 1 89 89 ARG N N 89 118.185 118.185 118.723 -0.538 25139 10715 1 19 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.988 -0.308 25139 10716 1 19 . 1 1 89 89 ARG C C 89 178.677 178.677 178.005 0.672 25139 10717 1 19 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.933 1.022 25139 10718 1 19 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.343 0.448 25139 10719 1 19 . 1 1 89 89 ARG H H 89 7.971 7.971 8.059 -0.088 25139 10720 1 19 . 1 1 90 90 ALA N N 90 120.815 120.815 122.968 -2.153 25139 10721 1 19 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.171 -0.096 25139 10722 1 19 . 1 1 90 90 ALA C C 90 177.416 177.416 178.779 -1.363 25139 10723 1 19 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.676 -0.422 25139 10724 1 19 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.209 -0.773 25139 10725 1 19 . 1 1 90 90 ALA H H 90 7.453 7.453 7.437 0.016 25139 10726 1 19 . 1 1 91 91 CYS N N 91 120.380 120.380 115.883 4.497 25139 10727 1 19 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.303 0.068 25139 10728 1 19 . 1 1 91 91 CYS C C 91 176.654 176.654 175.946 0.708 25139 10729 1 19 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.875 -4.180 25139 10730 1 19 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.233 12.471 25139 10731 1 19 . 1 1 91 91 CYS H H 91 7.944 7.944 7.564 0.380 25139 10732 1 19 . 1 1 92 92 CYS N N 92 116.270 116.270 118.934 -2.664 25139 10733 1 19 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.407 -0.003 25139 10734 1 19 . 1 1 92 92 CYS C C 92 175.628 175.628 176.534 -0.906 25139 10735 1 19 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.989 -2.284 25139 10736 1 19 . 1 1 92 92 CYS CB C 92 42.149 42.149 27.266 14.883 25139 10737 1 19 . 1 1 92 92 CYS H H 92 8.315 8.315 7.629 0.686 25139 10738 1 19 . 1 1 93 93 THR N N 93 107.283 107.283 111.119 -3.836 25139 10739 1 19 . 1 1 93 93 THR HA H 93 4.481 4.481 4.227 0.254 25139 10740 1 19 . 1 1 93 93 THR C C 93 173.606 173.606 175.750 -2.144 25139 10741 1 19 . 1 1 93 93 THR CA C 93 61.402 61.402 63.881 -2.479 25139 10742 1 19 . 1 1 93 93 THR CB C 93 69.046 69.046 69.049 -0.003 25139 10743 1 19 . 1 1 93 93 THR H H 93 7.445 7.445 7.588 -0.143 25139 10744 1 19 . 1 1 94 94 THR N N 94 121.432 121.432 119.824 1.608 25139 10745 1 19 . 1 1 94 94 THR HA H 94 4.398 4.398 4.515 -0.117 25139 10746 1 19 . 1 1 94 94 THR C C 94 173.493 173.493 174.783 -1.290 25139 10747 1 19 . 1 1 94 94 THR CA C 94 62.726 62.726 62.407 0.319 25139 10748 1 19 . 1 1 94 94 THR CB C 94 69.704 69.704 68.618 1.086 25139 10749 1 19 . 1 1 94 94 THR H H 94 7.553 7.553 7.894 -0.341 25139 10750 1 19 . 1 1 95 95 GLN N N 95 129.410 129.410 128.484 0.926 25139 10751 1 19 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.065 -0.121 25139 10752 1 19 . 1 1 95 95 GLN C C 95 176.293 176.293 176.802 -0.509 25139 10753 1 19 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.652 -0.612 25139 10754 1 19 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.833 -0.577 25139 10755 1 19 . 1 1 95 95 GLN H H 95 8.812 8.812 8.938 -0.126 25139 10756 1 19 . 1 1 96 96 ASN N N 96 115.015 115.015 115.212 -0.197 25139 10757 1 19 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.766 -0.567 25139 10758 1 19 . 1 1 96 96 ASN C C 96 172.260 172.260 173.540 -1.280 25139 10759 1 19 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.924 2.643 25139 10760 1 19 . 1 1 96 96 ASN CB C 96 36.837 36.837 39.117 -2.280 25139 10761 1 19 . 1 1 96 96 ASN H H 96 8.791 8.791 8.172 0.619 25139 10762 1 19 . 1 1 97 97 CYS N N 97 115.830 115.830 120.064 -4.234 25139 10763 1 19 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.520 -0.419 25139 10764 1 19 . 1 1 97 97 CYS C C 97 175.025 175.025 173.559 1.466 25139 10765 1 19 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.753 -1.605 25139 10766 1 19 . 1 1 97 97 CYS CB C 97 43.234 43.234 26.935 16.299 25139 10767 1 19 . 1 1 97 97 CYS H H 97 7.651 7.651 7.775 -0.124 25139 10768 1 19 . 1 1 98 98 ASN N N 98 125.148 125.148 124.674 0.474 25139 10769 1 19 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.060 0.073 25139 10770 1 19 . 1 1 98 98 ASN C C 98 171.892 171.892 174.147 -2.255 25139 10771 1 19 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.281 -0.087 25139 10772 1 19 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.026 -1.078 25139 10773 1 19 . 1 1 98 98 ASN H H 98 8.736 8.736 8.368 0.368 25139 10774 1 19 . 1 1 99 99 LEU N N 99 120.898 120.898 120.890 0.008 25139 10775 1 19 . 1 1 99 99 LEU C C 99 173.084 173.084 174.105 -1.021 25139 10776 1 19 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.787 2.333 25139 10777 1 19 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.378 -1.050 25139 10778 1 19 . 1 1 99 99 LEU H H 99 8.200 8.200 8.065 0.135 25139 10779 1 19 . 1 1 100 100 ALA N N 100 128.085 128.085 130.057 -1.972 25139 10780 1 19 . 1 1 100 100 ALA C C 100 174.938 174.938 175.491 -0.553 25139 10781 1 19 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.486 -0.739 25139 10782 1 19 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.762 -0.048 25139 10783 1 19 . 1 1 100 100 ALA H H 100 9.156 9.156 9.203 -0.047 25139 10784 1 19 . 1 1 101 101 LEU N N 101 128.723 128.723 128.432 0.291 25139 10785 1 19 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.120 0.022 25139 10786 1 19 . 1 1 101 101 LEU C C 101 174.379 174.379 175.361 -0.982 25139 10787 1 19 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.695 -0.842 25139 10788 1 19 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.316 0.990 25139 10789 1 19 . 1 1 101 101 LEU H H 101 9.578 9.578 8.933 0.645 25139 10790 1 19 . 1 1 102 102 VAL N N 102 119.417 119.417 118.950 0.467 25139 10791 1 19 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.325 0.203 25139 10792 1 19 . 1 1 102 102 VAL C C 102 173.660 173.660 174.105 -0.445 25139 10793 1 19 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.825 -0.205 25139 10794 1 19 . 1 1 102 102 VAL CB C 102 34.273 34.273 36.002 -1.729 25139 10795 1 19 . 1 1 102 102 VAL H H 102 9.297 9.297 9.403 -0.106 25139 10796 1 19 . 1 1 103 103 GLU N N 103 124.427 124.427 123.023 1.404 25139 10797 1 19 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.583 -0.718 25139 10798 1 19 . 1 1 103 103 GLU C C 103 176.319 176.319 175.570 0.749 25139 10799 1 19 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.245 -0.144 25139 10800 1 19 . 1 1 103 103 GLU CB C 103 32.201 32.201 32.301 -0.100 25139 10801 1 19 . 1 1 103 103 GLU H H 103 7.749 7.749 8.172 -0.423 25139 10802 1 19 . 1 1 104 104 LEU N N 104 127.294 127.294 125.686 1.608 25139 10803 1 19 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.537 -0.217 25139 10804 1 19 . 1 1 104 104 LEU C C 104 176.593 176.593 177.757 -1.164 25139 10805 1 19 . 1 1 104 104 LEU CA C 104 56.084 56.084 52.992 3.092 25139 10806 1 19 . 1 1 104 104 LEU CB C 104 42.391 42.391 42.701 -0.310 25139 10807 1 19 . 1 1 104 104 LEU H H 104 8.323 8.323 8.478 -0.155 25139 10808 1 19 . 1 1 105 105 GLN N N 105 121.361 121.361 114.039 7.322 25139 10809 1 19 . 1 1 105 105 GLN C C 105 172.868 172.868 174.380 -1.512 25139 10810 1 19 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.491 -3.085 25139 10811 1 19 . 1 1 105 105 GLN CB C 105 29.729 29.729 26.594 3.135 25139 10812 1 19 . 1 1 105 105 GLN H H 105 8.095 8.095 8.331 -0.236 25139 10813 1 19 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.405 0.004 25139 10814 1 19 . 1 1 106 106 PRO C C 106 177.770 177.770 176.737 1.033 25139 10815 1 19 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.555 -0.070 25139 10816 1 19 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.058 -0.290 25139 10817 1 19 . 1 1 107 107 ASP N N 107 116.484 116.484 115.108 1.376 25139 10818 1 19 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.553 -0.113 25139 10819 1 19 . 1 1 107 107 ASP C C 107 176.749 176.749 176.140 0.609 25139 10820 1 19 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.401 0.054 25139 10821 1 19 . 1 1 107 107 ASP CB C 107 39.888 39.888 40.789 -0.901 25139 10822 1 19 . 1 1 107 107 ASP H H 107 8.638 8.638 8.336 0.302 25139 10823 1 19 . 1 1 108 108 ARG N N 108 117.895 117.895 120.681 -2.786 25139 10824 1 19 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.694 -0.204 25139 10825 1 19 . 1 1 108 108 ARG C C 108 176.111 176.111 177.023 -0.912 25139 10826 1 19 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.391 -0.126 25139 10827 1 19 . 1 1 108 108 ARG CB C 108 31.076 31.076 30.646 0.430 25139 10828 1 19 . 1 1 108 108 ARG H H 108 7.905 7.905 8.378 -0.473 25139 10829 1 19 . 1 1 109 109 GLY N N 109 108.307 108.307 108.972 -0.665 25139 10830 1 19 . 1 1 109 109 GLY C C 109 173.949 173.949 174.717 -0.768 25139 10831 1 19 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.843 -1.292 25139 10832 1 19 . 1 1 109 109 GLY H H 109 7.753 7.753 8.220 -0.467 25139 10833 1 19 . 1 1 110 110 GLU N N 110 120.035 120.035 123.163 -3.128 25139 10834 1 19 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.606 -0.515 25139 10835 1 19 . 1 1 110 110 GLU C C 110 177.045 177.045 176.682 0.363 25139 10836 1 19 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.279 2.003 25139 10837 1 19 . 1 1 110 110 GLU CB C 110 29.673 29.673 31.630 -1.957 25139 10838 1 19 . 1 1 110 110 GLU H H 110 8.509 8.509 8.176 0.333 25139 10839 1 19 . 1 1 111 111 ASP N N 111 121.160 121.160 119.379 1.781 25139 10840 1 19 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.521 0.049 25139 10841 1 19 . 1 1 111 111 ASP C C 111 175.089 175.089 175.433 -0.344 25139 10842 1 19 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.201 -1.610 25139 10843 1 19 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.529 0.903 25139 10844 1 19 . 1 1 111 111 ASP H H 111 8.916 8.916 8.423 0.493 25139 10845 1 19 . 1 1 112 112 ALA N N 112 122.130 122.130 119.341 2.789 25139 10846 1 19 . 1 1 112 112 ALA C C 112 178.120 178.120 175.739 2.381 25139 10847 1 19 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.401 2.858 25139 10848 1 19 . 1 1 112 112 ALA CB C 112 19.770 19.770 22.070 -2.300 25139 10849 1 19 . 1 1 112 112 ALA H H 112 7.361 7.361 7.374 -0.013 25139 10850 1 19 . 1 1 113 113 ILE N N 113 113.780 113.780 114.588 -0.808 25139 10851 1 19 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.894 -0.008 25139 10852 1 19 . 1 1 113 113 ILE C C 113 174.258 174.258 174.647 -0.389 25139 10853 1 19 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.267 0.245 25139 10854 1 19 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.841 0.007 25139 10855 1 19 . 1 1 113 113 ILE H H 113 7.667 7.667 8.454 -0.787 25139 10856 1 19 . 1 1 114 114 ALA N N 114 122.673 122.673 125.356 -2.683 25139 10857 1 19 . 1 1 114 114 ALA C C 114 176.984 176.984 176.737 0.247 25139 10858 1 19 . 1 1 114 114 ALA CA C 114 51.564 51.564 52.819 -1.255 25139 10859 1 19 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.691 0.891 25139 10860 1 19 . 1 1 114 114 ALA H H 114 8.904 8.904 8.800 0.104 25139 10861 1 19 . 1 1 115 115 ALA N N 115 116.486 116.486 117.203 -0.717 25139 10862 1 19 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.453 -0.098 25139 10863 1 19 . 1 1 115 115 ALA C C 115 174.138 174.138 174.267 -0.129 25139 10864 1 19 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.911 1.409 25139 10865 1 19 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.520 1.463 25139 10866 1 19 . 1 1 115 115 ALA H H 115 7.182 7.182 7.246 -0.064 25139 10867 1 19 . 1 1 116 116 CYS N N 116 120.099 120.099 119.975 0.124 25139 10868 1 19 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.332 -0.001 25139 10869 1 19 . 1 1 116 116 CYS C C 116 176.609 176.609 172.436 4.173 25139 10870 1 19 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.508 -2.558 25139 10871 1 19 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.857 11.527 25139 10872 1 19 . 1 1 116 116 CYS H H 116 8.298 8.298 7.792 0.506 25139 10873 1 19 . 1 1 117 117 PHE N N 117 126.406 126.406 125.549 0.857 25139 10874 1 19 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.148 0.051 25139 10875 1 19 . 1 1 117 117 PHE C C 117 173.385 173.385 174.250 -0.865 25139 10876 1 19 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.035 0.219 25139 10877 1 19 . 1 1 117 117 PHE CB C 117 41.681 41.681 42.105 -0.424 25139 10878 1 19 . 1 1 117 117 PHE H H 117 9.712 9.712 9.049 0.663 25139 10879 1 19 . 1 1 118 118 LEU N N 118 122.119 122.119 122.891 -0.772 25139 10880 1 19 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.468 -0.302 25139 10881 1 19 . 1 1 118 118 LEU C C 118 175.097 175.097 176.093 -0.996 25139 10882 1 19 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.058 -0.154 25139 10883 1 19 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.635 -1.337 25139 10884 1 19 . 1 1 118 118 LEU H H 118 8.719 8.719 9.505 -0.786 25139 10885 1 19 . 1 1 119 119 ILE N N 119 125.324 125.324 122.249 3.075 25139 10886 1 19 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.895 -0.018 25139 10887 1 19 . 1 1 119 119 ILE C C 119 173.825 173.825 175.317 -1.492 25139 10888 1 19 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.880 -0.773 25139 10889 1 19 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.270 -0.760 25139 10890 1 19 . 1 1 119 119 ILE H H 119 8.986 8.986 9.066 -0.080 25139 10891 1 19 . 1 1 120 120 ASN N N 120 121.534 121.534 124.564 -3.030 25139 10892 1 19 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.717 0.673 25139 10893 1 19 . 1 1 120 120 ASN C C 120 176.098 176.098 176.085 0.013 25139 10894 1 19 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.422 -3.965 25139 10895 1 19 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.839 1.079 25139 10896 1 19 . 1 1 120 120 ASN H H 120 8.694 8.694 9.082 -0.388 25139 10897 1 19 . 1 1 121 121 CYS N N 121 122.779 122.779 116.071 6.708 25139 10898 1 19 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.086 0.397 25139 10899 1 19 . 1 1 121 121 CYS C C 121 173.195 173.195 173.609 -0.414 25139 10900 1 19 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.857 -4.093 25139 10901 1 19 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.497 16.210 25139 10902 1 19 . 1 1 121 121 CYS H H 121 10.668 10.668 8.558 2.110 25139 10903 1 19 . 1 1 122 122 LEU N N 122 121.063 121.063 117.793 3.270 25139 10904 1 19 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.439 -0.074 25139 10905 1 19 . 1 1 122 122 LEU C C 122 176.743 176.743 175.787 0.956 25139 10906 1 19 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.127 0.537 25139 10907 1 19 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.298 -1.064 25139 10908 1 19 . 1 1 122 122 LEU H H 122 8.256 8.256 7.786 0.470 25139 10909 1 19 . 1 1 123 123 TYR N N 123 123.081 123.081 123.580 -0.499 25139 10910 1 19 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.779 -0.736 25139 10911 1 19 . 1 1 123 123 TYR C C 123 173.633 173.633 174.905 -1.272 25139 10912 1 19 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.190 -0.302 25139 10913 1 19 . 1 1 123 123 TYR CB C 123 41.081 41.081 42.034 -0.953 25139 10914 1 19 . 1 1 123 123 TYR H H 123 8.990 8.990 8.922 0.068 25139 10915 1 19 . 1 1 124 124 GLU N N 124 128.742 128.742 126.709 2.033 25139 10916 1 19 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.731 -0.181 25139 10917 1 19 . 1 1 124 124 GLU C C 124 174.835 174.835 175.469 -0.634 25139 10918 1 19 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.522 0.110 25139 10919 1 19 . 1 1 124 124 GLU CB C 124 26.895 26.895 28.250 -1.355 25139 10920 1 19 . 1 1 124 124 GLU H H 124 9.135 9.135 8.754 0.381 25139 10921 1 19 . 1 1 125 125 GLN N N 125 108.066 108.066 109.628 -1.562 25139 10922 1 19 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.935 -0.214 25139 10923 1 19 . 1 1 125 125 GLN C C 125 174.627 174.627 174.609 0.018 25139 10924 1 19 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.535 0.504 25139 10925 1 19 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.159 0.169 25139 10926 1 19 . 1 1 125 125 GLN H H 125 8.390 8.390 8.486 -0.096 25139 10927 1 19 . 1 1 126 126 ASN N N 126 118.528 118.528 117.573 0.955 25139 10928 1 19 . 1 1 126 126 ASN C C 126 173.713 173.713 174.755 -1.042 25139 10929 1 19 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.617 -0.428 25139 10930 1 19 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.717 1.084 25139 10931 1 19 . 1 1 126 126 ASN H H 126 8.092 8.092 8.043 0.049 25139 10932 1 19 . 1 1 127 127 PHE N N 127 124.680 124.680 122.106 2.574 25139 10933 1 19 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.754 0.283 25139 10934 1 19 . 1 1 127 127 PHE C C 127 177.125 177.125 176.474 0.651 25139 10935 1 19 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.177 1.236 25139 10936 1 19 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.011 1.233 25139 10937 1 19 . 1 1 127 127 PHE H H 127 9.026 9.026 8.908 0.118 25139 10938 1 19 . 1 1 128 128 VAL N N 128 119.455 119.455 117.672 1.783 25139 10939 1 19 . 1 1 128 128 VAL C C 128 175.886 175.886 176.136 -0.250 25139 10940 1 19 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.830 -0.911 25139 10941 1 19 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.389 1.805 25139 10942 1 19 . 1 1 128 128 VAL H H 128 8.364 8.364 7.603 0.761 25139 10943 1 19 . 1 1 129 129 CYS N N 129 116.130 116.130 120.796 -4.666 25139 10944 1 19 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.888 -0.411 25139 10945 1 19 . 1 1 129 129 CYS C C 129 170.569 170.569 173.782 -3.213 25139 10946 1 19 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.901 -3.751 25139 10947 1 19 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.123 18.494 25139 10948 1 19 . 1 1 129 129 CYS H H 129 5.390 5.390 7.147 -1.757 25139 10949 1 19 . 1 1 130 130 LYS N N 130 120.071 120.071 124.623 -4.552 25139 10950 1 19 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.139 0.422 25139 10951 1 19 . 1 1 130 130 LYS C C 130 176.853 176.853 174.379 2.474 25139 10952 1 19 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.579 -0.692 25139 10953 1 19 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.539 1.103 25139 10954 1 19 . 1 1 130 130 LYS H H 130 8.066 8.066 7.680 0.386 25139 10955 1 19 . 1 1 131 131 PHE N N 131 118.415 118.415 120.202 -1.787 25139 10956 1 19 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.364 -0.757 25139 10957 1 19 . 1 1 131 131 PHE C C 131 174.013 174.013 175.182 -1.169 25139 10958 1 19 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.123 1.588 25139 10959 1 19 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.324 0.756 25139 10960 1 19 . 1 1 131 131 PHE H H 131 8.714 8.714 8.253 0.461 25139 10961 1 19 . 1 1 132 132 ALA N N 132 124.209 124.209 122.807 1.402 25139 10962 1 19 . 1 1 132 132 ALA HA H 132 4.617 4.617 4.921 -0.304 25139 10963 1 19 . 1 1 132 132 ALA C C 132 174.352 174.352 174.179 0.173 25139 10964 1 19 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.658 1.783 25139 10965 1 19 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.910 -0.446 25139 10966 1 19 . 1 1 132 132 ALA H H 132 9.295 9.295 9.277 0.018 25139 10967 1 19 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.165 -0.282 25139 10968 1 19 . 1 1 133 133 PRO C C 133 173.923 173.923 176.456 -2.533 25139 10969 1 19 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.630 0.441 25139 10970 1 19 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.403 -0.800 25139 10971 1 19 . 1 1 134 134 ARG N N 134 126.071 126.071 121.347 4.724 25139 10972 1 19 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.707 -0.452 25139 10973 1 19 . 1 1 134 134 ARG C C 134 177.065 177.065 174.361 2.704 25139 10974 1 19 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.972 2.192 25139 10975 1 19 . 1 1 134 134 ARG CB C 134 32.183 32.183 34.610 -2.427 25139 10976 1 19 . 1 1 134 134 ARG H H 134 8.672 8.672 8.655 0.017 25139 10977 1 19 . 1 1 135 135 GLU N N 135 125.683 125.683 120.997 4.686 25139 10978 1 19 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.625 -0.272 25139 10979 1 19 . 1 1 135 135 GLU C C 135 178.081 178.081 176.035 2.046 25139 10980 1 19 . 1 1 135 135 GLU CA C 135 57.651 57.651 56.231 1.420 25139 10981 1 19 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.802 -0.806 25139 10982 1 19 . 1 1 135 135 GLU H H 135 8.603 8.603 8.689 -0.086 25139 10983 1 19 . 1 1 136 136 GLY N N 136 110.031 110.031 108.875 1.156 25139 10984 1 19 . 1 1 136 136 GLY C C 136 173.079 173.079 172.344 0.735 25139 10985 1 19 . 1 1 136 136 GLY CA C 136 45.778 45.778 45.126 0.652 25139 10986 1 19 . 1 1 136 136 GLY H H 136 9.036 9.036 8.680 0.356 25139 10987 1 19 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.547 0.128 25139 10988 1 19 . 1 1 137 137 PHE C C 137 174.936 174.936 174.324 0.612 25139 10989 1 19 . 1 1 137 137 PHE CA C 137 56.084 56.084 56.679 -0.595 25139 10990 1 19 . 1 1 137 137 PHE CB C 137 44.696 44.696 42.377 2.319 25139 10991 1 19 . 1 1 138 138 ILE N N 138 117.417 117.417 114.861 2.556 25139 10992 1 19 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.645 -0.138 25139 10993 1 19 . 1 1 138 138 ILE C C 138 173.858 173.858 173.482 0.376 25139 10994 1 19 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.584 1.036 25139 10995 1 19 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.648 0.949 25139 10996 1 19 . 1 1 138 138 ILE H H 138 8.777 8.777 8.667 0.110 25139 10997 1 19 . 1 1 139 139 ASN N N 139 117.201 117.201 116.838 0.363 25139 10998 1 19 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.405 0.654 25139 10999 1 19 . 1 1 139 139 ASN C C 139 173.721 173.721 173.771 -0.050 25139 11000 1 19 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.785 -1.555 25139 11001 1 19 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.146 1.715 25139 11002 1 19 . 1 1 139 139 ASN H H 139 8.872 8.872 8.281 0.591 25139 11003 1 19 . 1 1 140 140 TYR N N 140 123.991 123.991 119.308 4.683 25139 11004 1 19 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.827 0.351 25139 11005 1 19 . 1 1 140 140 TYR C C 140 174.791 174.791 175.710 -0.919 25139 11006 1 19 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.283 -1.211 25139 11007 1 19 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.342 2.328 25139 11008 1 19 . 1 1 140 140 TYR H H 140 9.526 9.526 8.931 0.595 25139 11009 1 19 . 1 1 141 141 LEU N N 141 122.779 122.779 123.106 -0.327 25139 11010 1 19 . 1 1 141 141 LEU C C 141 175.404 175.404 177.588 -2.184 25139 11011 1 19 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.961 2.142 25139 11012 1 19 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.212 -0.051 25139 11013 1 19 . 1 1 141 141 LEU H H 141 9.010 9.010 9.170 -0.160 25139 11014 1 19 . 1 1 142 142 THR N N 142 113.189 113.189 112.531 0.658 25139 11015 1 19 . 1 1 142 142 THR HA H 142 4.061 4.061 4.409 -0.348 25139 11016 1 19 . 1 1 142 142 THR C C 142 175.940 175.940 176.337 -0.397 25139 11017 1 19 . 1 1 142 142 THR CA C 142 61.389 61.389 60.133 1.256 25139 11018 1 19 . 1 1 142 142 THR CB C 142 69.779 69.779 70.535 -0.756 25139 11019 1 19 . 1 1 142 142 THR H H 142 7.737 7.737 8.074 -0.337 25139 11020 1 19 . 1 1 143 143 ARG N N 143 120.975 120.975 121.025 -0.050 25139 11021 1 19 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.954 -0.016 25139 11022 1 19 . 1 1 143 143 ARG C C 143 178.690 178.690 177.692 0.998 25139 11023 1 19 . 1 1 143 143 ARG CA C 143 59.748 59.748 59.265 0.483 25139 11024 1 19 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.474 0.671 25139 11025 1 19 . 1 1 143 143 ARG H H 143 8.149 8.149 8.240 -0.091 25139 11026 1 19 . 1 1 144 144 GLU N N 144 116.997 116.997 119.224 -2.227 25139 11027 1 19 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.211 -0.102 25139 11028 1 19 . 1 1 144 144 GLU C C 144 178.442 178.442 177.885 0.557 25139 11029 1 19 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.432 1.431 25139 11030 1 19 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.271 -0.689 25139 11031 1 19 . 1 1 144 144 GLU H H 144 8.622 8.622 7.696 0.926 25139 11032 1 19 . 1 1 145 145 VAL N N 145 111.213 111.213 113.780 -2.567 25139 11033 1 19 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.136 0.275 25139 11034 1 19 . 1 1 145 145 VAL C C 145 176.965 176.965 177.073 -0.108 25139 11035 1 19 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.885 -0.291 25139 11036 1 19 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.704 -0.622 25139 11037 1 19 . 1 1 145 145 VAL H H 145 7.227 7.227 7.525 -0.298 25139 11038 1 19 . 1 1 146 146 TYR N N 146 123.512 123.512 121.858 1.654 25139 11039 1 19 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.041 -0.161 25139 11040 1 19 . 1 1 146 146 TYR C C 146 176.377 176.377 176.796 -0.419 25139 11041 1 19 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.151 0.386 25139 11042 1 19 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.699 -0.360 25139 11043 1 19 . 1 1 146 146 TYR H H 146 8.492 8.492 8.791 -0.299 25139 11044 1 19 . 1 1 147 147 ARG N N 147 116.680 116.680 117.183 -0.503 25139 11045 1 19 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.747 0.067 25139 11046 1 19 . 1 1 147 147 ARG C C 147 178.858 178.858 178.277 0.581 25139 11047 1 19 . 1 1 147 147 ARG CA C 147 59.696 59.696 58.586 1.110 25139 11048 1 19 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.110 0.555 25139 11049 1 19 . 1 1 147 147 ARG H H 147 8.053 8.053 8.620 -0.567 25139 11050 1 19 . 1 1 148 148 SER N N 148 115.306 115.306 114.835 0.471 25139 11051 1 19 . 1 1 148 148 SER HA H 148 3.998 3.998 4.248 -0.250 25139 11052 1 19 . 1 1 148 148 SER C C 148 175.786 175.786 176.057 -0.271 25139 11053 1 19 . 1 1 148 148 SER CA C 148 62.006 62.006 60.723 1.283 25139 11054 1 19 . 1 1 148 148 SER H H 148 7.139 7.139 7.494 -0.355 25139 11055 1 19 . 1 1 149 149 TYR N N 149 123.207 123.207 122.090 1.117 25139 11056 1 19 . 1 1 149 149 TYR C C 149 175.831 175.831 176.864 -1.033 25139 11057 1 19 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.320 -0.720 25139 11058 1 19 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.435 0.346 25139 11059 1 19 . 1 1 149 149 TYR H H 149 7.253 7.253 7.557 -0.304 25139 11060 1 19 . 1 1 150 150 ARG N N 150 118.708 118.708 115.596 3.112 25139 11061 1 19 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.855 -0.509 25139 11062 1 19 . 1 1 150 150 ARG C C 150 177.644 177.644 178.165 -0.521 25139 11063 1 19 . 1 1 150 150 ARG CA C 150 57.323 57.323 56.968 0.355 25139 11064 1 19 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.443 -0.589 25139 11065 1 19 . 1 1 150 150 ARG H H 150 8.441 8.441 7.470 0.971 25139 11066 1 19 . 1 1 151 151 GLN N N 151 116.551 116.551 116.754 -0.203 25139 11067 1 19 . 1 1 151 151 GLN HA H 151 3.957 3.957 3.616 0.341 25139 11068 1 19 . 1 1 151 151 GLN C C 151 177.987 177.987 176.312 1.675 25139 11069 1 19 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.211 0.131 25139 11070 1 19 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.448 0.016 25139 11071 1 19 . 1 1 151 151 GLN H H 151 7.332 7.332 7.289 0.043 25139 11072 1 19 . 1 1 152 152 LEU N N 152 118.877 118.877 112.554 6.323 25139 11073 1 19 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.490 -0.311 25139 11074 1 19 . 1 1 152 152 LEU C C 152 179.070 179.070 177.271 1.799 25139 11075 1 19 . 1 1 152 152 LEU CA C 152 57.082 57.082 56.036 1.046 25139 11076 1 19 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.029 -0.341 25139 11077 1 19 . 1 1 152 152 LEU H H 152 7.106 7.106 7.246 -0.140 25139 11078 1 19 . 1 1 153 153 VAL N N 153 119.076 119.076 112.239 6.837 25139 11079 1 19 . 1 1 153 153 VAL HA H 153 2.860 2.860 3.944 -1.084 25139 11080 1 19 . 1 1 153 153 VAL C C 153 177.421 177.421 176.712 0.709 25139 11081 1 19 . 1 1 153 153 VAL CA C 153 64.583 64.583 63.131 1.452 25139 11082 1 19 . 1 1 153 153 VAL CB C 153 31.518 31.518 32.934 -1.416 25139 11083 1 19 . 1 1 153 153 VAL H H 153 7.427 7.427 6.994 0.433 25139 11084 1 19 . 1 1 154 154 ASP N N 154 119.888 119.888 121.423 -1.535 25139 11085 1 19 . 1 1 154 154 ASP C C 154 177.422 177.422 178.613 -1.191 25139 11086 1 19 . 1 1 154 154 ASP CA C 154 56.071 56.071 57.197 -1.126 25139 11087 1 19 . 1 1 154 154 ASP CB C 154 40.349 40.349 40.521 -0.172 25139 11088 1 19 . 1 1 154 154 ASP H H 154 7.930 7.930 8.359 -0.429 25139 11089 1 19 . 1 1 155 155 HIS N N 155 117.821 117.821 116.506 1.315 25139 11090 1 19 . 1 1 155 155 HIS CA C 155 57.756 57.756 57.226 0.530 25139 11091 1 19 . 1 1 155 155 HIS CB C 155 30.180 30.180 29.910 0.270 25139 11092 1 19 . 1 1 155 155 HIS H H 155 7.680 7.680 7.885 -0.205 25139 11093 1 19 . 1 1 156 156 HIS N N 156 119.180 119.180 117.075 2.105 25139 11094 1 19 . 1 1 156 156 HIS CA C 156 57.931 57.931 56.441 1.490 25139 11095 1 19 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.531 -0.231 25139 11096 1 19 . 1 1 156 156 HIS H H 156 7.868 7.868 7.842 0.026 25139 11097 1 20 . 1 1 48 48 ALA CA C 48 52.904 52.904 52.448 0.456 25139 11098 1 20 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.849 0.373 25139 11099 1 20 . 1 1 49 49 ASP N N 49 119.661 119.661 119.183 0.478 25139 11100 1 20 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.419 -0.142 25139 11101 1 20 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.531 -0.469 25139 11102 1 20 . 1 1 49 49 ASP H H 49 8.462 8.462 7.801 0.661 25139 11103 1 20 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.220 -0.168 25139 11104 1 20 . 1 1 51 51 LEU C C 51 178.514 178.514 177.294 1.220 25139 11105 1 20 . 1 1 51 51 LEU CA C 51 58.049 58.049 55.663 2.386 25139 11106 1 20 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.006 0.187 25139 11107 1 20 . 1 1 52 52 ASN N N 52 113.819 113.819 116.937 -3.118 25139 11108 1 20 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.928 -0.093 25139 11109 1 20 . 1 1 52 52 ASN C C 52 175.964 175.964 175.798 0.166 25139 11110 1 20 . 1 1 52 52 ASN CA C 52 54.096 54.096 53.380 0.716 25139 11111 1 20 . 1 1 52 52 ASN CB C 52 38.883 38.883 39.771 -0.888 25139 11112 1 20 . 1 1 52 52 ASN H H 52 7.853 7.853 7.985 -0.132 25139 11113 1 20 . 1 1 53 53 SER N N 53 114.357 114.357 116.027 -1.670 25139 11114 1 20 . 1 1 53 53 SER CA C 53 59.908 59.908 58.883 1.025 25139 11115 1 20 . 1 1 53 53 SER CB C 53 64.395 64.395 64.314 0.081 25139 11116 1 20 . 1 1 53 53 SER H H 53 8.023 8.023 7.952 0.071 25139 11117 1 20 . 1 1 54 54 PHE N N 54 121.037 121.037 119.751 1.286 25139 11118 1 20 . 1 1 54 54 PHE C C 54 175.522 175.522 173.391 2.131 25139 11119 1 20 . 1 1 54 54 PHE CA C 54 58.064 58.064 56.409 1.655 25139 11120 1 20 . 1 1 54 54 PHE CB C 54 43.053 43.053 42.762 0.291 25139 11121 1 20 . 1 1 54 54 PHE H H 54 7.731 7.731 7.551 0.180 25139 11122 1 20 . 1 1 55 55 THR N N 55 116.535 116.535 114.995 1.540 25139 11123 1 20 . 1 1 55 55 THR HA H 55 4.654 4.654 3.959 0.695 25139 11124 1 20 . 1 1 55 55 THR C C 55 173.301 173.301 172.856 0.445 25139 11125 1 20 . 1 1 55 55 THR CA C 55 61.420 61.420 61.006 0.414 25139 11126 1 20 . 1 1 55 55 THR CB C 55 71.388 71.388 71.241 0.147 25139 11127 1 20 . 1 1 55 55 THR H H 55 8.929 8.929 8.798 0.131 25139 11128 1 20 . 1 1 56 56 ALA N N 56 129.359 129.359 127.314 2.045 25139 11129 1 20 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.305 0.010 25139 11130 1 20 . 1 1 56 56 ALA C C 56 178.305 178.305 177.927 0.378 25139 11131 1 20 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.337 0.534 25139 11132 1 20 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.305 0.019 25139 11133 1 20 . 1 1 56 56 ALA H H 56 8.907 8.907 8.156 0.751 25139 11134 1 20 . 1 1 57 57 GLY N N 57 106.331 106.331 109.658 -3.327 25139 11135 1 20 . 1 1 57 57 GLY CA C 57 44.611 44.611 44.385 0.226 25139 11136 1 20 . 1 1 57 57 GLY H H 57 7.978 7.978 8.224 -0.246 25139 11137 1 20 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.391 -0.067 25139 11138 1 20 . 1 1 59 59 PRO C C 59 177.466 177.466 177.328 0.138 25139 11139 1 20 . 1 1 59 59 PRO CA C 59 64.484 64.484 62.662 1.822 25139 11140 1 20 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.117 -0.382 25139 11141 1 20 . 1 1 60 60 GLY N N 60 109.688 109.688 107.589 2.099 25139 11142 1 20 . 1 1 60 60 GLY C C 60 173.555 173.555 172.940 0.615 25139 11143 1 20 . 1 1 60 60 GLY CA C 60 45.541 45.541 44.873 0.668 25139 11144 1 20 . 1 1 60 60 GLY H H 60 8.402 8.402 8.759 -0.357 25139 11145 1 20 . 1 1 61 61 PHE N N 61 122.491 122.491 121.558 0.933 25139 11146 1 20 . 1 1 61 61 PHE C C 61 175.146 175.146 174.833 0.313 25139 11147 1 20 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.763 1.519 25139 11148 1 20 . 1 1 61 61 PHE CB C 61 38.699 38.699 41.676 -2.977 25139 11149 1 20 . 1 1 61 61 PHE H H 61 7.957 7.957 7.255 0.702 25139 11150 1 20 . 1 1 62 62 VAL N N 62 121.128 121.128 116.162 4.966 25139 11151 1 20 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.424 -0.339 25139 11152 1 20 . 1 1 62 62 VAL C C 62 174.937 174.937 174.963 -0.026 25139 11153 1 20 . 1 1 62 62 VAL CA C 62 59.708 59.708 58.623 1.085 25139 11154 1 20 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.606 0.826 25139 11155 1 20 . 1 1 62 62 VAL H H 62 7.994 7.994 9.035 -1.041 25139 11156 1 20 . 1 1 63 63 LEU N N 63 124.386 124.386 123.028 1.358 25139 11157 1 20 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.745 -1.429 25139 11158 1 20 . 1 1 63 63 LEU C C 63 175.278 175.278 176.384 -1.106 25139 11159 1 20 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.690 0.598 25139 11160 1 20 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.415 1.703 25139 11161 1 20 . 1 1 63 63 LEU H H 63 7.572 7.572 8.465 -0.893 25139 11162 1 20 . 1 1 64 64 ASP N N 64 126.746 126.746 128.248 -1.502 25139 11163 1 20 . 1 1 64 64 ASP C C 64 177.801 177.801 176.112 1.689 25139 11164 1 20 . 1 1 64 64 ASP CA C 64 51.721 51.721 52.784 -1.063 25139 11165 1 20 . 1 1 64 64 ASP CB C 64 40.398 40.398 40.601 -0.203 25139 11166 1 20 . 1 1 64 64 ASP H H 64 8.552 8.552 8.306 0.246 25139 11167 1 20 . 1 1 65 65 THR C C 65 175.002 175.002 175.860 -0.858 25139 11168 1 20 . 1 1 65 65 THR CB C 65 67.919 67.919 68.569 -0.650 25139 11169 1 20 . 1 1 66 66 GLN N N 66 120.804 120.804 118.980 1.824 25139 11170 1 20 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.158 -0.281 25139 11171 1 20 . 1 1 66 66 GLN C C 66 178.901 178.901 176.815 2.086 25139 11172 1 20 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.081 1.335 25139 11173 1 20 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.024 -0.100 25139 11174 1 20 . 1 1 66 66 GLN H H 66 8.447 8.447 8.396 0.051 25139 11175 1 20 . 1 1 67 67 ALA N N 67 121.267 121.267 121.465 -0.198 25139 11176 1 20 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.173 -0.216 25139 11177 1 20 . 1 1 67 67 ALA C C 67 176.777 176.777 179.010 -2.233 25139 11178 1 20 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.768 0.556 25139 11179 1 20 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.805 -0.185 25139 11180 1 20 . 1 1 67 67 ALA H H 67 7.791 7.791 7.480 0.311 25139 11181 1 20 . 1 1 68 68 SER N N 68 113.339 113.339 115.081 -1.742 25139 11182 1 20 . 1 1 68 68 SER HA H 68 4.061 4.061 4.260 -0.199 25139 11183 1 20 . 1 1 68 68 SER C C 68 175.875 175.875 176.289 -0.414 25139 11184 1 20 . 1 1 68 68 SER CA C 68 62.970 62.970 60.466 2.504 25139 11185 1 20 . 1 1 68 68 SER CB C 68 61.330 61.330 63.391 -2.061 25139 11186 1 20 . 1 1 68 68 SER H H 68 7.785 7.785 7.679 0.106 25139 11187 1 20 . 1 1 69 69 VAL N N 69 125.140 125.140 117.426 7.714 25139 11188 1 20 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.277 -0.201 25139 11189 1 20 . 1 1 69 69 VAL C C 69 176.384 176.384 176.791 -0.407 25139 11190 1 20 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.609 1.122 25139 11191 1 20 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.499 -0.010 25139 11192 1 20 . 1 1 69 69 VAL H H 69 8.572 8.572 8.002 0.570 25139 11193 1 20 . 1 1 70 70 SER N N 70 116.704 116.704 113.376 3.328 25139 11194 1 20 . 1 1 70 70 SER HA H 70 4.229 4.229 4.275 -0.046 25139 11195 1 20 . 1 1 70 70 SER C C 70 174.101 174.101 175.053 -0.952 25139 11196 1 20 . 1 1 70 70 SER CA C 70 61.627 61.627 59.397 2.230 25139 11197 1 20 . 1 1 70 70 SER H H 70 7.951 7.951 7.942 0.009 25139 11198 1 20 . 1 1 71 71 ASN N N 71 117.576 117.576 117.171 0.405 25139 11199 1 20 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.661 0.141 25139 11200 1 20 . 1 1 71 71 ASN C C 71 174.332 174.332 174.793 -0.461 25139 11201 1 20 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.907 -0.468 25139 11202 1 20 . 1 1 71 71 ASN CB C 71 40.467 40.467 40.225 0.242 25139 11203 1 20 . 1 1 71 71 ASN H H 71 7.131 7.131 7.519 -0.388 25139 11204 1 20 . 1 1 72 72 GLY N N 72 103.925 103.925 105.472 -1.547 25139 11205 1 20 . 1 1 72 72 GLY C C 72 174.710 174.710 173.532 1.178 25139 11206 1 20 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.554 -0.005 25139 11207 1 20 . 1 1 72 72 GLY H H 72 7.338 7.338 7.497 -0.159 25139 11208 1 20 . 1 1 73 73 ALA N N 73 124.942 124.942 123.155 1.787 25139 11209 1 20 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.537 -0.365 25139 11210 1 20 . 1 1 73 73 ALA C C 73 175.896 175.896 176.236 -0.340 25139 11211 1 20 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.938 0.735 25139 11212 1 20 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.091 -0.035 25139 11213 1 20 . 1 1 73 73 ALA H H 73 8.032 8.032 7.849 0.183 25139 11214 1 20 . 1 1 74 74 THR N N 74 113.423 113.423 115.821 -2.398 25139 11215 1 20 . 1 1 74 74 THR HA H 74 4.678 4.678 4.560 0.118 25139 11216 1 20 . 1 1 74 74 THR C C 74 173.339 173.339 173.138 0.201 25139 11217 1 20 . 1 1 74 74 THR CA C 74 61.545 61.545 61.665 -0.120 25139 11218 1 20 . 1 1 74 74 THR CB C 74 71.319 71.319 71.522 -0.203 25139 11219 1 20 . 1 1 74 74 THR H H 74 8.530 8.530 8.307 0.223 25139 11220 1 20 . 1 1 75 75 PHE N N 75 128.180 128.180 130.587 -2.407 25139 11221 1 20 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.923 -0.319 25139 11222 1 20 . 1 1 75 75 PHE C C 75 174.623 174.623 175.288 -0.665 25139 11223 1 20 . 1 1 75 75 PHE CA C 75 57.616 57.616 55.456 2.160 25139 11224 1 20 . 1 1 75 75 PHE CB C 75 38.675 38.675 37.642 1.033 25139 11225 1 20 . 1 1 75 75 PHE H H 75 9.146 9.146 9.105 0.041 25139 11226 1 20 . 1 1 76 76 LEU N N 76 127.849 127.849 125.125 2.724 25139 11227 1 20 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.422 -0.071 25139 11228 1 20 . 1 1 76 76 LEU C C 76 176.339 176.339 176.956 -0.617 25139 11229 1 20 . 1 1 76 76 LEU CA C 76 55.983 55.983 56.076 -0.093 25139 11230 1 20 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.089 0.241 25139 11231 1 20 . 1 1 76 76 LEU H H 76 8.635 8.635 8.062 0.573 25139 11232 1 20 . 1 1 77 77 GLU N N 77 115.131 115.131 119.300 -4.169 25139 11233 1 20 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.489 -0.081 25139 11234 1 20 . 1 1 77 77 GLU C C 77 174.734 174.734 174.999 -0.265 25139 11235 1 20 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.475 0.878 25139 11236 1 20 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.930 0.277 25139 11237 1 20 . 1 1 77 77 GLU H H 77 7.252 7.252 7.695 -0.443 25139 11238 1 20 . 1 1 78 78 SER N N 78 118.016 118.016 118.174 -0.158 25139 11239 1 20 . 1 1 78 78 SER HA H 78 5.561 5.561 5.185 0.376 25139 11240 1 20 . 1 1 78 78 SER C C 78 171.968 171.968 172.196 -0.228 25139 11241 1 20 . 1 1 78 78 SER CA C 78 54.061 54.061 54.440 -0.378 25139 11242 1 20 . 1 1 78 78 SER CB C 78 64.074 64.074 63.510 0.564 25139 11243 1 20 . 1 1 78 78 SER H H 78 9.033 9.033 8.626 0.407 25139 11244 1 20 . 1 1 79 79 PRO CA C 79 62.600 62.600 62.715 -0.115 25139 11245 1 20 . 1 1 79 79 PRO CB C 79 32.410 32.410 33.037 -0.627 25139 11246 1 20 . 1 1 80 80 THR N N 80 118.079 118.079 118.237 -0.158 25139 11247 1 20 . 1 1 80 80 THR HA H 80 4.342 4.342 4.265 0.077 25139 11248 1 20 . 1 1 80 80 THR C C 80 174.494 174.494 174.775 -0.281 25139 11249 1 20 . 1 1 80 80 THR CA C 80 61.453 61.453 60.077 1.376 25139 11250 1 20 . 1 1 80 80 THR CB C 80 67.797 67.797 68.036 -0.239 25139 11251 1 20 . 1 1 80 80 THR H H 80 8.670 8.670 8.465 0.205 25139 11252 1 20 . 1 1 81 81 VAL N N 81 117.395 117.395 117.786 -0.391 25139 11253 1 20 . 1 1 81 81 VAL HA H 81 4.607 4.607 4.022 0.585 25139 11254 1 20 . 1 1 81 81 VAL C C 81 175.518 175.518 175.535 -0.017 25139 11255 1 20 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.524 -3.410 25139 11256 1 20 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.099 2.496 25139 11257 1 20 . 1 1 81 81 VAL H H 81 7.448 7.448 7.388 0.060 25139 11258 1 20 . 1 1 82 82 ARG N N 82 117.852 117.852 118.769 -0.917 25139 11259 1 20 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.906 -0.385 25139 11260 1 20 . 1 1 82 82 ARG C C 82 176.992 176.992 176.200 0.792 25139 11261 1 20 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.331 1.054 25139 11262 1 20 . 1 1 82 82 ARG CB C 82 31.602 31.602 31.315 0.287 25139 11263 1 20 . 1 1 82 82 ARG H H 82 8.710 8.710 8.672 0.038 25139 11264 1 20 . 1 1 83 83 ARG N N 83 117.035 117.035 118.122 -1.087 25139 11265 1 20 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.855 0.467 25139 11266 1 20 . 1 1 83 83 ARG C C 83 177.379 177.379 176.539 0.840 25139 11267 1 20 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.906 -1.222 25139 11268 1 20 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.460 -0.419 25139 11269 1 20 . 1 1 83 83 ARG H H 83 7.292 7.292 7.847 -0.555 25139 11270 1 20 . 1 1 84 84 GLY N N 84 114.911 114.911 110.517 4.394 25139 11271 1 20 . 1 1 84 84 GLY C C 84 176.940 176.940 175.103 1.837 25139 11272 1 20 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.981 1.690 25139 11273 1 20 . 1 1 84 84 GLY H H 84 9.255 9.255 8.343 0.912 25139 11274 1 20 . 1 1 85 85 TRP N N 85 121.810 121.810 120.222 1.588 25139 11275 1 20 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.203 -0.036 25139 11276 1 20 . 1 1 85 85 TRP C C 85 178.272 178.272 177.775 0.497 25139 11277 1 20 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.429 0.616 25139 11278 1 20 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.223 -0.006 25139 11279 1 20 . 1 1 85 85 TRP H H 85 9.963 9.963 8.047 1.916 25139 11280 1 20 . 1 1 86 86 ASP N N 86 116.400 116.400 119.661 -3.261 25139 11281 1 20 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.460 -0.067 25139 11282 1 20 . 1 1 86 86 ASP C C 86 178.803 178.803 178.236 0.567 25139 11283 1 20 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.916 0.138 25139 11284 1 20 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.316 0.416 25139 11285 1 20 . 1 1 86 86 ASP H H 86 6.934 6.934 7.640 -0.706 25139 11286 1 20 . 1 1 87 87 CYS N N 87 122.454 122.454 119.104 3.350 25139 11287 1 20 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.250 0.000 25139 11288 1 20 . 1 1 87 87 CYS C C 87 174.956 174.956 176.800 -1.844 25139 11289 1 20 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.020 -3.873 25139 11290 1 20 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.421 11.064 25139 11291 1 20 . 1 1 87 87 CYS H H 87 7.603 7.603 7.529 0.074 25139 11292 1 20 . 1 1 88 88 VAL N N 88 119.192 119.192 118.970 0.222 25139 11293 1 20 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.541 -1.083 25139 11294 1 20 . 1 1 88 88 VAL C C 88 177.413 177.413 177.262 0.151 25139 11295 1 20 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.509 1.467 25139 11296 1 20 . 1 1 88 88 VAL CB C 88 30.242 30.242 31.052 -0.810 25139 11297 1 20 . 1 1 88 88 VAL H H 88 7.192 7.192 7.416 -0.224 25139 11298 1 20 . 1 1 89 89 ARG N N 89 118.185 118.185 118.546 -0.361 25139 11299 1 20 . 1 1 89 89 ARG HA H 89 3.680 3.680 4.049 -0.369 25139 11300 1 20 . 1 1 89 89 ARG C C 89 178.677 178.677 177.927 0.750 25139 11301 1 20 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.801 1.154 25139 11302 1 20 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.425 0.366 25139 11303 1 20 . 1 1 89 89 ARG H H 89 7.971 7.971 7.882 0.089 25139 11304 1 20 . 1 1 90 90 ALA N N 90 120.815 120.815 122.754 -1.939 25139 11305 1 20 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.189 -0.114 25139 11306 1 20 . 1 1 90 90 ALA C C 90 177.416 177.416 178.775 -1.359 25139 11307 1 20 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.572 -0.318 25139 11308 1 20 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.193 -0.757 25139 11309 1 20 . 1 1 90 90 ALA H H 90 7.453 7.453 7.483 -0.030 25139 11310 1 20 . 1 1 91 91 CYS N N 91 120.380 120.380 115.791 4.589 25139 11311 1 20 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.211 0.160 25139 11312 1 20 . 1 1 91 91 CYS C C 91 176.654 176.654 175.753 0.901 25139 11313 1 20 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.616 -3.921 25139 11314 1 20 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.141 12.563 25139 11315 1 20 . 1 1 91 91 CYS H H 91 7.944 7.944 7.647 0.297 25139 11316 1 20 . 1 1 92 92 CYS N N 92 116.270 116.270 118.801 -2.531 25139 11317 1 20 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.319 0.085 25139 11318 1 20 . 1 1 92 92 CYS C C 92 175.628 175.628 176.520 -0.892 25139 11319 1 20 . 1 1 92 92 CYS CA C 92 58.706 58.706 61.171 -2.465 25139 11320 1 20 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.852 15.297 25139 11321 1 20 . 1 1 92 92 CYS H H 92 8.315 8.315 7.657 0.658 25139 11322 1 20 . 1 1 93 93 THR N N 93 107.283 107.283 109.893 -2.610 25139 11323 1 20 . 1 1 93 93 THR HA H 93 4.481 4.481 4.216 0.265 25139 11324 1 20 . 1 1 93 93 THR C C 93 173.606 173.606 175.514 -1.908 25139 11325 1 20 . 1 1 93 93 THR CA C 93 61.402 61.402 64.102 -2.700 25139 11326 1 20 . 1 1 93 93 THR CB C 93 69.046 69.046 68.739 0.307 25139 11327 1 20 . 1 1 93 93 THR H H 93 7.445 7.445 7.347 0.098 25139 11328 1 20 . 1 1 94 94 THR N N 94 121.432 121.432 121.456 -0.024 25139 11329 1 20 . 1 1 94 94 THR HA H 94 4.398 4.398 4.458 -0.060 25139 11330 1 20 . 1 1 94 94 THR C C 94 173.493 173.493 175.101 -1.608 25139 11331 1 20 . 1 1 94 94 THR CA C 94 62.726 62.726 63.192 -0.466 25139 11332 1 20 . 1 1 94 94 THR CB C 94 69.704 69.704 68.559 1.145 25139 11333 1 20 . 1 1 94 94 THR H H 94 7.553 7.553 7.893 -0.340 25139 11334 1 20 . 1 1 95 95 GLN N N 95 129.410 129.410 126.687 2.723 25139 11335 1 20 . 1 1 95 95 GLN HA H 95 3.944 3.944 3.944 0.000 25139 11336 1 20 . 1 1 95 95 GLN C C 95 176.293 176.293 175.538 0.755 25139 11337 1 20 . 1 1 95 95 GLN CA C 95 58.040 58.040 59.032 -0.992 25139 11338 1 20 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.625 -0.369 25139 11339 1 20 . 1 1 95 95 GLN H H 95 8.812 8.812 8.435 0.377 25139 11340 1 20 . 1 1 96 96 ASN N N 96 115.015 115.015 113.905 1.110 25139 11341 1 20 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.918 -0.719 25139 11342 1 20 . 1 1 96 96 ASN C C 96 172.260 172.260 174.088 -1.828 25139 11343 1 20 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.642 2.925 25139 11344 1 20 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.791 -1.954 25139 11345 1 20 . 1 1 96 96 ASN H H 96 8.791 8.791 8.129 0.662 25139 11346 1 20 . 1 1 97 97 CYS N N 97 115.830 115.830 120.897 -5.067 25139 11347 1 20 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.451 -0.350 25139 11348 1 20 . 1 1 97 97 CYS C C 97 175.025 175.025 174.177 0.848 25139 11349 1 20 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.666 -1.518 25139 11350 1 20 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.012 16.222 25139 11351 1 20 . 1 1 97 97 CYS H H 97 7.651 7.651 7.819 -0.168 25139 11352 1 20 . 1 1 98 98 ASN N N 98 125.148 125.148 125.553 -0.405 25139 11353 1 20 . 1 1 98 98 ASN HA H 98 5.133 5.133 4.990 0.143 25139 11354 1 20 . 1 1 98 98 ASN C C 98 171.892 171.892 174.183 -2.291 25139 11355 1 20 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.939 -0.745 25139 11356 1 20 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.935 -1.987 25139 11357 1 20 . 1 1 98 98 ASN H H 98 8.736 8.736 8.311 0.425 25139 11358 1 20 . 1 1 99 99 LEU N N 99 120.898 120.898 120.669 0.229 25139 11359 1 20 . 1 1 99 99 LEU C C 99 173.084 173.084 173.782 -0.698 25139 11360 1 20 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.565 2.555 25139 11361 1 20 . 1 1 99 99 LEU CB C 99 44.328 44.328 46.151 -1.823 25139 11362 1 20 . 1 1 99 99 LEU H H 99 8.200 8.200 8.110 0.090 25139 11363 1 20 . 1 1 100 100 ALA N N 100 128.085 128.085 129.146 -1.061 25139 11364 1 20 . 1 1 100 100 ALA C C 100 174.938 174.938 175.539 -0.601 25139 11365 1 20 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.475 -0.728 25139 11366 1 20 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.351 0.363 25139 11367 1 20 . 1 1 100 100 ALA H H 100 9.156 9.156 9.303 -0.147 25139 11368 1 20 . 1 1 101 101 LEU N N 101 128.723 128.723 127.826 0.897 25139 11369 1 20 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.301 -0.159 25139 11370 1 20 . 1 1 101 101 LEU C C 101 174.379 174.379 175.325 -0.946 25139 11371 1 20 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.262 -0.409 25139 11372 1 20 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.573 0.734 25139 11373 1 20 . 1 1 101 101 LEU H H 101 9.578 9.578 9.159 0.419 25139 11374 1 20 . 1 1 102 102 VAL N N 102 119.417 119.417 119.450 -0.033 25139 11375 1 20 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.028 0.500 25139 11376 1 20 . 1 1 102 102 VAL C C 102 173.660 173.660 173.879 -0.219 25139 11377 1 20 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.677 -0.057 25139 11378 1 20 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.100 -0.827 25139 11379 1 20 . 1 1 102 102 VAL H H 102 9.297 9.297 9.347 -0.050 25139 11380 1 20 . 1 1 103 103 GLU N N 103 124.427 124.427 124.639 -0.212 25139 11381 1 20 . 1 1 103 103 GLU HA H 103 3.865 3.865 3.334 0.531 25139 11382 1 20 . 1 1 103 103 GLU C C 103 176.319 176.319 174.390 1.929 25139 11383 1 20 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.523 -0.422 25139 11384 1 20 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.016 1.185 25139 11385 1 20 . 1 1 103 103 GLU H H 103 7.749 7.749 8.308 -0.559 25139 11386 1 20 . 1 1 104 104 LEU N N 104 127.294 127.294 126.208 1.086 25139 11387 1 20 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.325 -0.005 25139 11388 1 20 . 1 1 104 104 LEU C C 104 176.593 176.593 177.184 -0.591 25139 11389 1 20 . 1 1 104 104 LEU CA C 104 56.084 56.084 54.077 2.007 25139 11390 1 20 . 1 1 104 104 LEU CB C 104 42.391 42.391 43.691 -1.300 25139 11391 1 20 . 1 1 104 104 LEU H H 104 8.323 8.323 8.199 0.124 25139 11392 1 20 . 1 1 105 105 GLN N N 105 121.361 121.361 118.045 3.316 25139 11393 1 20 . 1 1 105 105 GLN C C 105 172.868 172.868 174.668 -1.800 25139 11394 1 20 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.301 -2.895 25139 11395 1 20 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.740 1.989 25139 11396 1 20 . 1 1 105 105 GLN H H 105 8.095 8.095 8.151 -0.056 25139 11397 1 20 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.520 -0.111 25139 11398 1 20 . 1 1 106 106 PRO C C 106 177.770 177.770 176.905 0.865 25139 11399 1 20 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.505 -0.020 25139 11400 1 20 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.142 -0.374 25139 11401 1 20 . 1 1 107 107 ASP N N 107 116.484 116.484 115.206 1.278 25139 11402 1 20 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.618 -0.178 25139 11403 1 20 . 1 1 107 107 ASP C C 107 176.749 176.749 176.277 0.472 25139 11404 1 20 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.332 0.123 25139 11405 1 20 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.259 -1.371 25139 11406 1 20 . 1 1 107 107 ASP H H 107 8.638 8.638 8.548 0.090 25139 11407 1 20 . 1 1 108 108 ARG N N 108 117.895 117.895 119.460 -1.565 25139 11408 1 20 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.713 -0.223 25139 11409 1 20 . 1 1 108 108 ARG C C 108 176.111 176.111 177.084 -0.973 25139 11410 1 20 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.501 -0.236 25139 11411 1 20 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.842 -0.766 25139 11412 1 20 . 1 1 108 108 ARG H H 108 7.905 7.905 8.496 -0.591 25139 11413 1 20 . 1 1 109 109 GLY N N 109 108.307 108.307 107.779 0.528 25139 11414 1 20 . 1 1 109 109 GLY C C 109 173.949 173.949 173.284 0.665 25139 11415 1 20 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.301 -0.750 25139 11416 1 20 . 1 1 109 109 GLY H H 109 7.753 7.753 8.208 -0.455 25139 11417 1 20 . 1 1 110 110 GLU N N 110 120.035 120.035 121.654 -1.619 25139 11418 1 20 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.635 -0.544 25139 11419 1 20 . 1 1 110 110 GLU C C 110 177.045 177.045 176.695 0.350 25139 11420 1 20 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.627 1.655 25139 11421 1 20 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.852 -1.179 25139 11422 1 20 . 1 1 110 110 GLU H H 110 8.509 8.509 8.686 -0.177 25139 11423 1 20 . 1 1 111 111 ASP N N 111 121.160 121.160 121.262 -0.102 25139 11424 1 20 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.505 0.065 25139 11425 1 20 . 1 1 111 111 ASP C C 111 175.089 175.089 175.689 -0.600 25139 11426 1 20 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.347 -1.756 25139 11427 1 20 . 1 1 111 111 ASP CB C 111 42.432 42.432 40.565 1.867 25139 11428 1 20 . 1 1 111 111 ASP H H 111 8.916 8.916 8.639 0.277 25139 11429 1 20 . 1 1 112 112 ALA N N 112 122.130 122.130 118.919 3.211 25139 11430 1 20 . 1 1 112 112 ALA C C 112 178.120 178.120 175.840 2.280 25139 11431 1 20 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.413 2.845 25139 11432 1 20 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.290 -1.520 25139 11433 1 20 . 1 1 112 112 ALA H H 112 7.361 7.361 7.409 -0.048 25139 11434 1 20 . 1 1 113 113 ILE N N 113 113.780 113.780 116.452 -2.672 25139 11435 1 20 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.750 0.136 25139 11436 1 20 . 1 1 113 113 ILE C C 113 174.258 174.258 174.688 -0.430 25139 11437 1 20 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.287 0.225 25139 11438 1 20 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.833 0.015 25139 11439 1 20 . 1 1 113 113 ILE H H 113 7.667 7.667 8.412 -0.745 25139 11440 1 20 . 1 1 114 114 ALA N N 114 122.673 122.673 124.904 -2.231 25139 11441 1 20 . 1 1 114 114 ALA C C 114 176.984 176.984 176.642 0.342 25139 11442 1 20 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.066 -1.502 25139 11443 1 20 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.619 0.963 25139 11444 1 20 . 1 1 114 114 ALA H H 114 8.904 8.904 8.827 0.077 25139 11445 1 20 . 1 1 115 115 ALA N N 115 116.486 116.486 116.008 0.478 25139 11446 1 20 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.506 -0.151 25139 11447 1 20 . 1 1 115 115 ALA C C 115 174.138 174.138 174.235 -0.097 25139 11448 1 20 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.596 1.724 25139 11449 1 20 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.278 1.705 25139 11450 1 20 . 1 1 115 115 ALA H H 115 7.182 7.182 7.158 0.024 25139 11451 1 20 . 1 1 116 116 CYS N N 116 120.099 120.099 119.473 0.626 25139 11452 1 20 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.160 0.171 25139 11453 1 20 . 1 1 116 116 CYS C C 116 176.609 176.609 172.592 4.017 25139 11454 1 20 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.179 -2.230 25139 11455 1 20 . 1 1 116 116 CYS CB C 116 40.384 40.384 29.075 11.309 25139 11456 1 20 . 1 1 116 116 CYS H H 116 8.298 8.298 7.877 0.421 25139 11457 1 20 . 1 1 117 117 PHE N N 117 126.406 126.406 125.659 0.747 25139 11458 1 20 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.202 -0.003 25139 11459 1 20 . 1 1 117 117 PHE C C 117 173.385 173.385 174.463 -1.078 25139 11460 1 20 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.017 0.237 25139 11461 1 20 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.055 0.626 25139 11462 1 20 . 1 1 117 117 PHE H H 117 9.712 9.712 9.084 0.628 25139 11463 1 20 . 1 1 118 118 LEU N N 118 122.119 122.119 124.164 -2.045 25139 11464 1 20 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.418 -0.252 25139 11465 1 20 . 1 1 118 118 LEU C C 118 175.097 175.097 176.511 -1.414 25139 11466 1 20 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.271 -0.367 25139 11467 1 20 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.418 -1.120 25139 11468 1 20 . 1 1 118 118 LEU H H 118 8.719 8.719 9.246 -0.527 25139 11469 1 20 . 1 1 119 119 ILE N N 119 125.324 125.324 122.848 2.476 25139 11470 1 20 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.925 -0.048 25139 11471 1 20 . 1 1 119 119 ILE C C 119 173.825 173.825 175.399 -1.574 25139 11472 1 20 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.978 -0.871 25139 11473 1 20 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.252 -0.742 25139 11474 1 20 . 1 1 119 119 ILE H H 119 8.986 8.986 9.153 -0.167 25139 11475 1 20 . 1 1 120 120 ASN N N 120 121.534 121.534 124.838 -3.304 25139 11476 1 20 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.771 0.619 25139 11477 1 20 . 1 1 120 120 ASN C C 120 176.098 176.098 176.122 -0.024 25139 11478 1 20 . 1 1 120 120 ASN CA C 120 51.457 51.457 54.889 -3.432 25139 11479 1 20 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.806 1.112 25139 11480 1 20 . 1 1 120 120 ASN H H 120 8.694 8.694 9.089 -0.395 25139 11481 1 20 . 1 1 121 121 CYS N N 121 122.779 122.779 114.907 7.872 25139 11482 1 20 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.127 0.356 25139 11483 1 20 . 1 1 121 121 CYS C C 121 173.195 173.195 173.358 -0.163 25139 11484 1 20 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.654 -3.890 25139 11485 1 20 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.695 16.012 25139 11486 1 20 . 1 1 121 121 CYS H H 121 10.668 10.668 8.502 2.166 25139 11487 1 20 . 1 1 122 122 LEU N N 122 121.063 121.063 115.990 5.073 25139 11488 1 20 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.612 -0.247 25139 11489 1 20 . 1 1 122 122 LEU C C 122 176.743 176.743 175.648 1.095 25139 11490 1 20 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.062 0.602 25139 11491 1 20 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.550 -1.316 25139 11492 1 20 . 1 1 122 122 LEU H H 122 8.256 8.256 7.718 0.538 25139 11493 1 20 . 1 1 123 123 TYR N N 123 123.081 123.081 123.437 -0.356 25139 11494 1 20 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.781 -0.738 25139 11495 1 20 . 1 1 123 123 TYR C C 123 173.633 173.633 174.819 -1.186 25139 11496 1 20 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.259 -0.371 25139 11497 1 20 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.923 -0.842 25139 11498 1 20 . 1 1 123 123 TYR H H 123 8.990 8.990 9.043 -0.053 25139 11499 1 20 . 1 1 124 124 GLU N N 124 128.742 128.742 126.430 2.312 25139 11500 1 20 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.692 -0.142 25139 11501 1 20 . 1 1 124 124 GLU C C 124 174.835 174.835 175.425 -0.590 25139 11502 1 20 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.434 0.198 25139 11503 1 20 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.888 -0.993 25139 11504 1 20 . 1 1 124 124 GLU H H 124 9.135 9.135 8.744 0.391 25139 11505 1 20 . 1 1 125 125 GLN N N 125 108.066 108.066 109.944 -1.878 25139 11506 1 20 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.954 -0.233 25139 11507 1 20 . 1 1 125 125 GLN C C 125 174.627 174.627 174.791 -0.164 25139 11508 1 20 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.376 0.663 25139 11509 1 20 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.727 -0.399 25139 11510 1 20 . 1 1 125 125 GLN H H 125 8.390 8.390 8.535 -0.145 25139 11511 1 20 . 1 1 126 126 ASN N N 126 118.528 118.528 117.614 0.914 25139 11512 1 20 . 1 1 126 126 ASN C C 126 173.713 173.713 174.697 -0.984 25139 11513 1 20 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.083 0.106 25139 11514 1 20 . 1 1 126 126 ASN CB C 126 40.801 40.801 40.095 0.706 25139 11515 1 20 . 1 1 126 126 ASN H H 126 8.092 8.092 8.012 0.080 25139 11516 1 20 . 1 1 127 127 PHE N N 127 124.680 124.680 122.235 2.445 25139 11517 1 20 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.784 0.253 25139 11518 1 20 . 1 1 127 127 PHE C C 127 177.125 177.125 176.428 0.697 25139 11519 1 20 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.262 1.151 25139 11520 1 20 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.305 0.939 25139 11521 1 20 . 1 1 127 127 PHE H H 127 9.026 9.026 8.785 0.241 25139 11522 1 20 . 1 1 128 128 VAL N N 128 119.455 119.455 118.969 0.486 25139 11523 1 20 . 1 1 128 128 VAL C C 128 175.886 175.886 175.996 -0.110 25139 11524 1 20 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.484 -0.565 25139 11525 1 20 . 1 1 128 128 VAL CB C 128 33.194 33.194 30.600 2.594 25139 11526 1 20 . 1 1 128 128 VAL H H 128 8.364 8.364 7.667 0.697 25139 11527 1 20 . 1 1 129 129 CYS N N 129 116.130 116.130 120.727 -4.597 25139 11528 1 20 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.886 -0.409 25139 11529 1 20 . 1 1 129 129 CYS C C 129 170.569 170.569 173.666 -3.097 25139 11530 1 20 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.779 -3.629 25139 11531 1 20 . 1 1 129 129 CYS CB C 129 44.617 44.617 26.148 18.469 25139 11532 1 20 . 1 1 129 129 CYS H H 129 5.390 5.390 7.187 -1.797 25139 11533 1 20 . 1 1 130 130 LYS N N 130 120.071 120.071 124.423 -4.352 25139 11534 1 20 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.126 0.435 25139 11535 1 20 . 1 1 130 130 LYS C C 130 176.853 176.853 174.452 2.401 25139 11536 1 20 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.741 -0.854 25139 11537 1 20 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.255 1.387 25139 11538 1 20 . 1 1 130 130 LYS H H 130 8.066 8.066 7.719 0.347 25139 11539 1 20 . 1 1 131 131 PHE N N 131 118.415 118.415 119.992 -1.577 25139 11540 1 20 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.415 -0.808 25139 11541 1 20 . 1 1 131 131 PHE C C 131 174.013 174.013 175.116 -1.103 25139 11542 1 20 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.339 1.372 25139 11543 1 20 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.369 0.711 25139 11544 1 20 . 1 1 131 131 PHE H H 131 8.714 8.714 8.220 0.494 25139 11545 1 20 . 1 1 132 132 ALA N N 132 124.209 124.209 122.782 1.427 25139 11546 1 20 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.031 -0.414 25139 11547 1 20 . 1 1 132 132 ALA C C 132 174.352 174.352 174.312 0.040 25139 11548 1 20 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.654 1.787 25139 11549 1 20 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.863 -0.399 25139 11550 1 20 . 1 1 132 132 ALA H H 132 9.295 9.295 9.069 0.226 25139 11551 1 20 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.398 -0.515 25139 11552 1 20 . 1 1 133 133 PRO C C 133 173.923 173.923 176.531 -2.608 25139 11553 1 20 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.603 0.468 25139 11554 1 20 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.596 -0.993 25139 11555 1 20 . 1 1 134 134 ARG N N 134 126.071 126.071 124.432 1.639 25139 11556 1 20 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.694 -0.439 25139 11557 1 20 . 1 1 134 134 ARG C C 134 177.065 177.065 176.482 0.583 25139 11558 1 20 . 1 1 134 134 ARG CA C 134 57.164 57.164 54.313 2.851 25139 11559 1 20 . 1 1 134 134 ARG CB C 134 32.183 32.183 31.616 0.567 25139 11560 1 20 . 1 1 134 134 ARG H H 134 8.672 8.672 8.165 0.507 25139 11561 1 20 . 1 1 135 135 GLU N N 135 125.683 125.683 119.765 5.918 25139 11562 1 20 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.338 0.015 25139 11563 1 20 . 1 1 135 135 GLU C C 135 178.081 178.081 176.628 1.453 25139 11564 1 20 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.397 0.254 25139 11565 1 20 . 1 1 135 135 GLU CB C 135 29.996 29.996 29.879 0.117 25139 11566 1 20 . 1 1 135 135 GLU H H 135 8.603 8.603 8.883 -0.280 25139 11567 1 20 . 1 1 136 136 GLY N N 136 110.031 110.031 106.667 3.364 25139 11568 1 20 . 1 1 136 136 GLY C C 136 173.079 173.079 174.136 -1.057 25139 11569 1 20 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.889 0.889 25139 11570 1 20 . 1 1 136 136 GLY H H 136 9.036 9.036 8.186 0.850 25139 11571 1 20 . 1 1 137 137 PHE HA H 137 5.675 5.675 4.586 1.089 25139 11572 1 20 . 1 1 137 137 PHE C C 137 174.936 174.936 175.364 -0.428 25139 11573 1 20 . 1 1 137 137 PHE CA C 137 56.084 56.084 59.224 -3.140 25139 11574 1 20 . 1 1 137 137 PHE CB C 137 44.696 44.696 39.827 4.869 25139 11575 1 20 . 1 1 138 138 ILE N N 138 117.417 117.417 113.169 4.248 25139 11576 1 20 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.614 -0.107 25139 11577 1 20 . 1 1 138 138 ILE C C 138 173.858 173.858 173.529 0.329 25139 11578 1 20 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.650 0.970 25139 11579 1 20 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.080 1.517 25139 11580 1 20 . 1 1 138 138 ILE H H 138 8.777 8.777 8.225 0.552 25139 11581 1 20 . 1 1 139 139 ASN N N 139 117.201 117.201 116.790 0.411 25139 11582 1 20 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.450 0.609 25139 11583 1 20 . 1 1 139 139 ASN C C 139 173.721 173.721 173.881 -0.160 25139 11584 1 20 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.526 -1.296 25139 11585 1 20 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.384 1.477 25139 11586 1 20 . 1 1 139 139 ASN H H 139 8.872 8.872 8.318 0.554 25139 11587 1 20 . 1 1 140 140 TYR N N 140 123.991 123.991 119.623 4.368 25139 11588 1 20 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.774 0.404 25139 11589 1 20 . 1 1 140 140 TYR C C 140 174.791 174.791 175.036 -0.245 25139 11590 1 20 . 1 1 140 140 TYR CA C 140 57.072 57.072 57.920 -0.848 25139 11591 1 20 . 1 1 140 140 TYR CB C 140 41.670 41.670 40.289 1.381 25139 11592 1 20 . 1 1 140 140 TYR H H 140 9.526 9.526 8.999 0.527 25139 11593 1 20 . 1 1 141 141 LEU N N 141 122.779 122.779 120.427 2.352 25139 11594 1 20 . 1 1 141 141 LEU C C 141 175.404 175.404 177.448 -2.044 25139 11595 1 20 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.764 2.339 25139 11596 1 20 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.854 -0.693 25139 11597 1 20 . 1 1 141 141 LEU H H 141 9.010 9.010 9.119 -0.109 25139 11598 1 20 . 1 1 142 142 THR N N 142 113.189 113.189 112.147 1.042 25139 11599 1 20 . 1 1 142 142 THR HA H 142 4.061 4.061 4.953 -0.892 25139 11600 1 20 . 1 1 142 142 THR C C 142 175.940 175.940 176.217 -0.277 25139 11601 1 20 . 1 1 142 142 THR CA C 142 61.389 61.389 60.576 0.813 25139 11602 1 20 . 1 1 142 142 THR CB C 142 69.779 69.779 71.266 -1.487 25139 11603 1 20 . 1 1 142 142 THR H H 142 7.737 7.737 8.318 -0.581 25139 11604 1 20 . 1 1 143 143 ARG N N 143 120.975 120.975 120.644 0.331 25139 11605 1 20 . 1 1 143 143 ARG HA H 143 3.938 3.938 4.066 -0.128 25139 11606 1 20 . 1 1 143 143 ARG C C 143 178.690 178.690 177.120 1.570 25139 11607 1 20 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.883 0.865 25139 11608 1 20 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.333 0.812 25139 11609 1 20 . 1 1 143 143 ARG H H 143 8.149 8.149 8.789 -0.640 25139 11610 1 20 . 1 1 144 144 GLU N N 144 116.997 116.997 118.569 -1.572 25139 11611 1 20 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.372 -0.263 25139 11612 1 20 . 1 1 144 144 GLU C C 144 178.442 178.442 177.547 0.895 25139 11613 1 20 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.235 1.628 25139 11614 1 20 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.002 -0.420 25139 11615 1 20 . 1 1 144 144 GLU H H 144 8.622 8.622 7.839 0.783 25139 11616 1 20 . 1 1 145 145 VAL N N 145 111.213 111.213 118.027 -6.814 25139 11617 1 20 . 1 1 145 145 VAL HA H 145 4.411 4.411 4.054 0.357 25139 11618 1 20 . 1 1 145 145 VAL C C 145 176.965 176.965 176.074 0.891 25139 11619 1 20 . 1 1 145 145 VAL CA C 145 62.594 62.594 62.387 0.207 25139 11620 1 20 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.780 -0.698 25139 11621 1 20 . 1 1 145 145 VAL H H 145 7.227 7.227 7.499 -0.272 25139 11622 1 20 . 1 1 146 146 TYR N N 146 123.512 123.512 121.458 2.054 25139 11623 1 20 . 1 1 146 146 TYR HA H 146 3.880 3.880 3.991 -0.111 25139 11624 1 20 . 1 1 146 146 TYR C C 146 176.377 176.377 176.738 -0.361 25139 11625 1 20 . 1 1 146 146 TYR CA C 146 62.537 62.537 61.929 0.608 25139 11626 1 20 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.533 -0.194 25139 11627 1 20 . 1 1 146 146 TYR H H 146 8.492 8.492 8.931 -0.439 25139 11628 1 20 . 1 1 147 147 ARG N N 147 116.680 116.680 117.744 -1.064 25139 11629 1 20 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.829 -0.015 25139 11630 1 20 . 1 1 147 147 ARG C C 147 178.858 178.858 178.472 0.386 25139 11631 1 20 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.696 0.000 25139 11632 1 20 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.796 -0.131 25139 11633 1 20 . 1 1 147 147 ARG H H 147 8.053 8.053 8.672 -0.619 25139 11634 1 20 . 1 1 148 148 SER N N 148 115.306 115.306 114.254 1.052 25139 11635 1 20 . 1 1 148 148 SER HA H 148 3.998 3.998 4.400 -0.402 25139 11636 1 20 . 1 1 148 148 SER C C 148 175.786 175.786 175.157 0.629 25139 11637 1 20 . 1 1 148 148 SER CA C 148 62.006 62.006 59.998 2.008 25139 11638 1 20 . 1 1 148 148 SER H H 148 7.139 7.139 7.408 -0.269 25139 11639 1 20 . 1 1 149 149 TYR N N 149 123.207 123.207 121.800 1.407 25139 11640 1 20 . 1 1 149 149 TYR C C 149 175.831 175.831 177.031 -1.200 25139 11641 1 20 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.038 -0.438 25139 11642 1 20 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.664 0.117 25139 11643 1 20 . 1 1 149 149 TYR H H 149 7.253 7.253 7.367 -0.114 25139 11644 1 20 . 1 1 150 150 ARG N N 150 118.708 118.708 117.681 1.027 25139 11645 1 20 . 1 1 150 150 ARG HA H 150 3.346 3.346 4.032 -0.686 25139 11646 1 20 . 1 1 150 150 ARG C C 150 177.644 177.644 177.767 -0.123 25139 11647 1 20 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.010 0.313 25139 11648 1 20 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.418 -0.564 25139 11649 1 20 . 1 1 150 150 ARG H H 150 8.441 8.441 7.748 0.693 25139 11650 1 20 . 1 1 151 151 GLN N N 151 116.551 116.551 117.599 -1.048 25139 11651 1 20 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.114 -0.157 25139 11652 1 20 . 1 1 151 151 GLN C C 151 177.987 177.987 176.701 1.286 25139 11653 1 20 . 1 1 151 151 GLN CA C 151 58.341 58.341 58.173 0.168 25139 11654 1 20 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.221 0.243 25139 11655 1 20 . 1 1 151 151 GLN H H 151 7.332 7.332 7.727 -0.395 25139 11656 1 20 . 1 1 152 152 LEU N N 152 118.877 118.877 115.288 3.589 25139 11657 1 20 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.707 -0.528 25139 11658 1 20 . 1 1 152 152 LEU C C 152 179.070 179.070 177.028 2.042 25139 11659 1 20 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.269 1.813 25139 11660 1 20 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.585 -0.897 25139 11661 1 20 . 1 1 152 152 LEU H H 152 7.106 7.106 7.413 -0.307 25139 11662 1 20 . 1 1 153 153 VAL N N 153 119.076 119.076 113.774 5.302 25139 11663 1 20 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.089 -1.229 25139 11664 1 20 . 1 1 153 153 VAL C C 153 177.421 177.421 176.525 0.896 25139 11665 1 20 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.182 2.401 25139 11666 1 20 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.426 -1.908 25139 11667 1 20 . 1 1 153 153 VAL H H 153 7.427 7.427 7.195 0.232 25139 11668 1 20 . 1 1 154 154 ASP N N 154 119.888 119.888 122.194 -2.306 25139 11669 1 20 . 1 1 154 154 ASP C C 154 177.422 177.422 176.271 1.151 25139 11670 1 20 . 1 1 154 154 ASP CA C 154 56.071 56.071 53.963 2.108 25139 11671 1 20 . 1 1 154 154 ASP CB C 154 40.349 40.349 41.663 -1.314 25139 11672 1 20 . 1 1 154 154 ASP H H 154 7.930 7.930 7.671 0.259 25139 11673 1 20 . 1 1 155 155 HIS N N 155 117.821 117.821 119.598 -1.777 25139 11674 1 20 . 1 1 155 155 HIS CA C 155 57.756 57.756 56.440 1.316 25139 11675 1 20 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.503 -0.323 25139 11676 1 20 . 1 1 155 155 HIS H H 155 7.680 7.680 8.290 -0.610 25139 11677 1 20 . 1 1 156 156 HIS N N 156 119.180 119.180 118.962 0.218 25139 11678 1 20 . 1 1 156 156 HIS CA C 156 57.931 57.931 54.067 3.864 25139 11679 1 20 . 1 1 156 156 HIS CB C 156 30.300 30.300 31.314 -1.014 25139 11680 1 20 . 1 1 156 156 HIS H H 156 7.868 7.868 8.352 -0.484 25139 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 99 2.676 -0.346 2.667 25139 2 1 1 "Average Difference" HA 91 0.405 0.072 0.400 25139 3 1 1 "Average Difference" C 100 1.185 0.099 1.187 25139 4 1 1 "Average Difference" CA 106 1.625 -0.171 1.624 25139 5 1 1 "Average Difference" CB 99 4.036 -1.010 3.928 25139 6 1 1 "Average Difference" HN 99 0.545 -0.047 0.546 25139 7 1 2 "Average Difference" N 99 2.710 -0.281 2.709 25139 8 1 2 "Average Difference" HA 91 0.391 0.059 0.389 25139 9 1 2 "Average Difference" C 100 1.170 0.107 1.171 25139 10 1 2 "Average Difference" CA 106 1.593 -0.094 1.598 25139 11 1 2 "Average Difference" CB 99 4.044 -1.002 3.938 25139 12 1 2 "Average Difference" HN 99 0.534 -0.074 0.531 25139 13 1 3 "Average Difference" N 99 2.900 -0.494 2.872 25139 14 1 3 "Average Difference" HA 91 0.389 0.050 0.388 25139 15 1 3 "Average Difference" C 100 1.190 0.085 1.193 25139 16 1 3 "Average Difference" CA 106 1.593 -0.070 1.599 25139 17 1 3 "Average Difference" CB 99 4.068 -1.128 3.929 25139 18 1 3 "Average Difference" HN 99 0.544 -0.081 0.541 25139 19 1 4 "Average Difference" N 99 2.827 -0.263 2.829 25139 20 1 4 "Average Difference" HA 91 0.396 0.090 0.388 25139 21 1 4 "Average Difference" C 100 1.225 0.049 1.230 25139 22 1 4 "Average Difference" CA 106 1.653 -0.222 1.646 25139 23 1 4 "Average Difference" CB 99 4.099 -1.059 3.980 25139 24 1 4 "Average Difference" HN 99 0.545 -0.063 0.544 25139 25 1 5 "Average Difference" N 99 2.654 -0.365 2.642 25139 26 1 5 "Average Difference" HA 91 0.381 0.073 0.376 25139 27 1 5 "Average Difference" C 100 1.206 0.027 1.212 25139 28 1 5 "Average Difference" CA 106 1.603 -0.218 1.595 25139 29 1 5 "Average Difference" CB 99 4.011 -0.926 3.922 25139 30 1 5 "Average Difference" HN 99 0.568 -0.041 0.570 25139 31 1 6 "Average Difference" N 99 2.715 -0.189 2.722 25139 32 1 6 "Average Difference" HA 91 0.395 0.062 0.392 25139 33 1 6 "Average Difference" C 100 1.187 0.141 1.184 25139 34 1 6 "Average Difference" CA 106 1.607 -0.087 1.613 25139 35 1 6 "Average Difference" CB 99 4.130 -1.122 3.995 25139 36 1 6 "Average Difference" HN 99 0.538 -0.039 0.540 25139 37 1 7 "Average Difference" N 99 2.943 -0.169 2.953 25139 38 1 7 "Average Difference" HA 91 0.378 0.076 0.372 25139 39 1 7 "Average Difference" C 100 1.200 0.040 1.205 25139 40 1 7 "Average Difference" CA 106 1.541 -0.126 1.543 25139 41 1 7 "Average Difference" CB 99 4.035 -1.052 3.916 25139 42 1 7 "Average Difference" HN 99 0.571 -0.031 0.573 25139 43 1 8 "Average Difference" N 99 2.672 -0.193 2.679 25139 44 1 8 "Average Difference" HA 91 0.372 0.053 0.370 25139 45 1 8 "Average Difference" C 100 1.206 0.055 1.211 25139 46 1 8 "Average Difference" CA 106 1.518 -0.127 1.520 25139 47 1 8 "Average Difference" CB 99 4.038 -1.047 3.919 25139 48 1 8 "Average Difference" HN 99 0.537 -0.052 0.538 25139 49 1 9 "Average Difference" N 99 2.902 -0.364 2.894 25139 50 1 9 "Average Difference" HA 91 0.382 0.076 0.376 25139 51 1 9 "Average Difference" C 100 1.211 0.023 1.217 25139 52 1 9 "Average Difference" CA 106 1.582 -0.136 1.584 25139 53 1 9 "Average Difference" CB 99 4.071 -0.979 3.972 25139 54 1 9 "Average Difference" HN 99 0.556 -0.032 0.558 25139 55 1 10 "Average Difference" N 99 2.648 -0.548 2.604 25139 56 1 10 "Average Difference" HA 91 0.439 0.080 0.434 25139 57 1 10 "Average Difference" C 100 1.199 0.030 1.205 25139 58 1 10 "Average Difference" CA 106 1.664 -0.265 1.651 25139 59 1 10 "Average Difference" CB 99 4.052 -1.014 3.943 25139 60 1 10 "Average Difference" HN 99 0.551 -0.065 0.550 25139 61 1 11 "Average Difference" N 99 2.646 -0.460 2.618 25139 62 1 11 "Average Difference" HA 91 0.404 0.041 0.405 25139 63 1 11 "Average Difference" C 100 1.165 0.092 1.167 25139 64 1 11 "Average Difference" CA 106 1.582 -0.064 1.588 25139 65 1 11 "Average Difference" CB 99 4.117 -1.037 4.004 25139 66 1 11 "Average Difference" HN 99 0.605 -0.092 0.601 25139 67 1 12 "Average Difference" N 99 2.742 -0.466 2.716 25139 68 1 12 "Average Difference" HA 91 0.384 0.044 0.384 25139 69 1 12 "Average Difference" C 100 1.223 0.063 1.227 25139 70 1 12 "Average Difference" CA 106 1.597 -0.077 1.603 25139 71 1 12 "Average Difference" CB 99 4.107 -1.016 3.999 25139 72 1 12 "Average Difference" HN 99 0.565 -0.061 0.565 25139 73 1 13 "Average Difference" N 99 2.735 -0.410 2.718 25139 74 1 13 "Average Difference" HA 91 0.427 0.043 0.427 25139 75 1 13 "Average Difference" C 100 1.232 0.044 1.237 25139 76 1 13 "Average Difference" CA 106 1.529 -0.130 1.531 25139 77 1 13 "Average Difference" CB 99 4.091 -1.019 3.982 25139 78 1 13 "Average Difference" HN 99 0.573 -0.038 0.575 25139 79 1 14 "Average Difference" N 99 2.667 -0.384 2.653 25139 80 1 14 "Average Difference" HA 91 0.382 0.077 0.377 25139 81 1 14 "Average Difference" C 100 1.221 0.101 1.223 25139 82 1 14 "Average Difference" CA 106 1.566 -0.138 1.568 25139 83 1 14 "Average Difference" CB 99 4.069 -0.973 3.971 25139 84 1 14 "Average Difference" HN 99 0.551 -0.040 0.552 25139 85 1 15 "Average Difference" N 99 2.728 -0.327 2.722 25139 86 1 15 "Average Difference" HA 91 0.399 0.071 0.395 25139 87 1 15 "Average Difference" C 100 1.229 0.029 1.234 25139 88 1 15 "Average Difference" CA 106 1.536 -0.160 1.535 25139 89 1 15 "Average Difference" CB 99 4.047 -0.962 3.951 25139 90 1 15 "Average Difference" HN 99 0.548 -0.072 0.546 25139 91 1 16 "Average Difference" N 99 2.708 -0.428 2.688 25139 92 1 16 "Average Difference" HA 91 0.438 0.055 0.437 25139 93 1 16 "Average Difference" C 100 1.246 0.053 1.252 25139 94 1 16 "Average Difference" CA 106 1.649 0.005 1.657 25139 95 1 16 "Average Difference" CB 99 4.138 -1.045 4.025 25139 96 1 16 "Average Difference" HN 99 0.567 -0.066 0.566 25139 97 1 17 "Average Difference" N 99 2.740 -0.386 2.727 25139 98 1 17 "Average Difference" HA 91 0.410 0.045 0.410 25139 99 1 17 "Average Difference" C 100 1.238 0.084 1.241 25139 100 1 17 "Average Difference" CA 106 1.598 -0.079 1.604 25139 101 1 17 "Average Difference" CB 99 4.054 -1.024 3.943 25139 102 1 17 "Average Difference" HN 99 0.565 -0.096 0.559 25139 103 1 18 "Average Difference" N 99 2.897 -0.531 2.863 25139 104 1 18 "Average Difference" HA 91 0.399 0.030 0.400 25139 105 1 18 "Average Difference" C 100 1.237 0.108 1.239 25139 106 1 18 "Average Difference" CA 106 1.625 -0.117 1.629 25139 107 1 18 "Average Difference" CB 99 4.064 -1.130 3.924 25139 108 1 18 "Average Difference" HN 99 0.535 -0.057 0.535 25139 109 1 19 "Average Difference" N 99 2.814 -0.492 2.785 25139 110 1 19 "Average Difference" HA 91 0.392 0.042 0.392 25139 111 1 19 "Average Difference" C 100 1.189 0.122 1.188 25139 112 1 19 "Average Difference" CA 106 1.559 -0.063 1.565 25139 113 1 19 "Average Difference" CB 99 4.042 -1.011 3.933 25139 114 1 19 "Average Difference" HN 99 0.546 -0.053 0.546 25139 115 1 20 "Average Difference" N 99 2.697 -0.414 2.679 25139 116 1 20 "Average Difference" HA 91 0.439 0.066 0.437 25139 117 1 20 "Average Difference" C 100 1.197 0.018 1.203 25139 118 1 20 "Average Difference" CA 106 1.627 -0.221 1.620 25139 119 1 20 "Average Difference" CB 99 4.054 -1.000 3.949 25139 120 1 20 "Average Difference" HN 99 0.547 -0.067 0.546 25139 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 25139 _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 48 48 ALA CA C 48 52.904 52.904 52.318 0.586 25139 2 1 . 1 1 48 48 ALA CB C 48 19.222 19.222 18.677 0.545 25139 3 1 . 1 1 49 49 ASP N N 49 119.661 119.661 119.947 -0.286 25139 4 1 . 1 1 49 49 ASP CA C 49 54.277 54.277 54.322 -0.045 25139 5 1 . 1 1 49 49 ASP CB C 49 41.062 41.062 41.477 -0.415 25139 6 1 . 1 1 49 49 ASP H H 49 8.462 8.462 8.116 0.346 25139 7 1 . 1 1 51 51 LEU HA H 51 4.052 4.052 4.174 -0.122 25139 8 1 . 1 1 51 51 LEU C C 51 178.514 178.514 177.852 0.662 25139 9 1 . 1 1 51 51 LEU CA C 51 58.049 58.049 56.887 1.162 25139 10 1 . 1 1 51 51 LEU CB C 51 41.193 41.193 41.460 -0.267 25139 11 1 . 1 1 52 52 ASN N N 52 113.819 113.819 117.396 -3.577 25139 12 1 . 1 1 52 52 ASN HA H 52 4.835 4.835 4.717 0.118 25139 13 1 . 1 1 52 52 ASN C C 52 175.964 175.964 175.942 0.022 25139 14 1 . 1 1 52 52 ASN CA C 52 54.096 54.096 54.597 -0.501 25139 15 1 . 1 1 52 52 ASN CB C 52 38.883 38.883 38.966 -0.083 25139 16 1 . 1 1 52 52 ASN H H 52 7.853 7.853 8.195 -0.342 25139 17 1 . 1 1 53 53 SER N N 53 114.357 114.357 114.571 -0.214 25139 18 1 . 1 1 53 53 SER CA C 53 59.908 59.908 59.299 0.609 25139 19 1 . 1 1 53 53 SER CB C 53 64.395 64.395 63.707 0.688 25139 20 1 . 1 1 53 53 SER H H 53 8.023 8.023 7.998 0.025 25139 21 1 . 1 1 54 54 PHE N N 54 121.037 121.037 119.554 1.483 25139 22 1 . 1 1 54 54 PHE C C 54 175.522 175.522 175.561 -0.039 25139 23 1 . 1 1 54 54 PHE CA C 54 58.064 58.064 57.208 0.855 25139 24 1 . 1 1 54 54 PHE CB C 54 43.053 43.053 42.747 0.306 25139 25 1 . 1 1 54 54 PHE H H 54 7.731 7.731 7.746 -0.015 25139 26 1 . 1 1 55 55 THR N N 55 116.535 116.535 118.001 -1.466 25139 27 1 . 1 1 55 55 THR HA H 55 4.654 4.654 4.633 0.021 25139 28 1 . 1 1 55 55 THR C C 55 173.301 173.301 173.299 0.002 25139 29 1 . 1 1 55 55 THR CA C 55 61.420 61.420 61.039 0.381 25139 30 1 . 1 1 55 55 THR CB C 55 71.388 71.388 71.277 0.111 25139 31 1 . 1 1 55 55 THR H H 55 8.929 8.929 9.123 -0.194 25139 32 1 . 1 1 56 56 ALA N N 56 129.359 129.359 128.755 0.604 25139 33 1 . 1 1 56 56 ALA HA H 56 4.315 4.315 4.027 0.288 25139 34 1 . 1 1 56 56 ALA C C 56 178.305 178.305 177.390 0.915 25139 35 1 . 1 1 56 56 ALA CA C 56 52.871 52.871 52.049 0.822 25139 36 1 . 1 1 56 56 ALA CB C 56 19.324 19.324 19.049 0.275 25139 37 1 . 1 1 56 56 ALA H H 56 8.907 8.907 8.636 0.271 25139 38 1 . 1 1 57 57 GLY N N 57 106.331 106.331 109.092 -2.761 25139 39 1 . 1 1 57 57 GLY CA C 57 44.611 44.611 43.993 0.618 25139 40 1 . 1 1 57 57 GLY H H 57 7.978 7.978 8.133 -0.155 25139 41 1 . 1 1 59 59 PRO HA H 59 4.324 4.324 4.347 -0.023 25139 42 1 . 1 1 59 59 PRO C C 59 177.466 177.466 177.631 -0.165 25139 43 1 . 1 1 59 59 PRO CA C 59 64.484 64.484 63.017 1.467 25139 44 1 . 1 1 59 59 PRO CB C 59 31.735 31.735 32.142 -0.407 25139 45 1 . 1 1 60 60 GLY N N 60 109.688 109.688 108.411 1.277 25139 46 1 . 1 1 60 60 GLY C C 60 173.555 173.555 173.189 0.366 25139 47 1 . 1 1 60 60 GLY CA C 60 45.541 45.541 45.025 0.516 25139 48 1 . 1 1 60 60 GLY H H 60 8.402 8.402 8.680 -0.278 25139 49 1 . 1 1 61 61 PHE N N 61 122.491 122.491 121.862 0.629 25139 50 1 . 1 1 61 61 PHE C C 61 175.146 175.146 174.668 0.478 25139 51 1 . 1 1 61 61 PHE CA C 61 58.282 58.282 56.732 1.550 25139 52 1 . 1 1 61 61 PHE CB C 61 38.699 38.699 40.720 -2.021 25139 53 1 . 1 1 61 61 PHE H H 61 7.957 7.957 7.274 0.683 25139 54 1 . 1 1 62 62 VAL N N 62 121.128 121.128 117.276 3.851 25139 55 1 . 1 1 62 62 VAL HA H 62 5.085 5.085 5.319 -0.234 25139 56 1 . 1 1 62 62 VAL C C 62 174.937 174.937 174.790 0.147 25139 57 1 . 1 1 62 62 VAL CA C 62 59.708 59.708 59.096 0.612 25139 58 1 . 1 1 62 62 VAL CB C 62 36.432 36.432 35.743 0.689 25139 59 1 . 1 1 62 62 VAL H H 62 7.994 7.994 8.983 -0.989 25139 60 1 . 1 1 63 63 LEU N N 63 124.386 124.386 122.687 1.699 25139 61 1 . 1 1 63 63 LEU HA H 63 3.316 3.316 4.670 -1.354 25139 62 1 . 1 1 63 63 LEU C C 63 175.278 175.278 176.813 -1.535 25139 63 1 . 1 1 63 63 LEU CA C 63 56.288 56.288 55.782 0.506 25139 64 1 . 1 1 63 63 LEU CB C 63 44.118 44.118 42.559 1.559 25139 65 1 . 1 1 63 63 LEU H H 63 7.572 7.572 8.762 -1.190 25139 66 1 . 1 1 64 64 ASP N N 64 126.746 126.746 126.340 0.406 25139 67 1 . 1 1 64 64 ASP C C 64 177.801 177.801 176.629 1.172 25139 68 1 . 1 1 64 64 ASP CA C 64 51.721 51.721 54.234 -2.513 25139 69 1 . 1 1 64 64 ASP CB C 64 40.398 40.398 41.054 -0.656 25139 70 1 . 1 1 64 64 ASP H H 64 8.552 8.552 8.465 0.087 25139 71 1 . 1 1 65 65 THR C C 65 175.002 175.002 175.440 -0.438 25139 72 1 . 1 1 65 65 THR CB C 65 67.919 67.919 67.801 0.118 25139 73 1 . 1 1 66 66 GLN N N 66 120.804 120.804 119.773 1.031 25139 74 1 . 1 1 66 66 GLN HA H 66 3.877 3.877 4.064 -0.187 25139 75 1 . 1 1 66 66 GLN C C 66 178.901 178.901 176.983 1.918 25139 76 1 . 1 1 66 66 GLN CA C 66 59.416 59.416 58.181 1.235 25139 77 1 . 1 1 66 66 GLN CB C 66 27.924 27.924 28.075 -0.151 25139 78 1 . 1 1 66 66 GLN H H 66 8.447 8.447 8.273 0.174 25139 79 1 . 1 1 67 67 ALA N N 67 121.267 121.267 121.586 -0.319 25139 80 1 . 1 1 67 67 ALA HA H 67 3.957 3.957 4.192 -0.235 25139 81 1 . 1 1 67 67 ALA C C 67 176.777 176.777 178.755 -1.978 25139 82 1 . 1 1 67 67 ALA CA C 67 54.324 54.324 53.970 0.354 25139 83 1 . 1 1 67 67 ALA CB C 67 18.620 18.620 18.612 0.008 25139 84 1 . 1 1 67 67 ALA H H 67 7.791 7.791 7.596 0.195 25139 85 1 . 1 1 68 68 SER N N 68 113.339 113.339 113.784 -0.445 25139 86 1 . 1 1 68 68 SER HA H 68 4.061 4.061 4.165 -0.104 25139 87 1 . 1 1 68 68 SER C C 68 175.875 175.875 176.481 -0.606 25139 88 1 . 1 1 68 68 SER CA C 68 62.970 62.970 61.054 1.916 25139 89 1 . 1 1 68 68 SER CB C 68 61.330 61.330 63.533 -2.203 25139 90 1 . 1 1 68 68 SER H H 68 7.785 7.785 7.693 0.092 25139 91 1 . 1 1 69 69 VAL N N 69 125.140 125.140 117.202 7.938 25139 92 1 . 1 1 69 69 VAL HA H 69 4.076 4.076 4.191 -0.115 25139 93 1 . 1 1 69 69 VAL C C 69 176.384 176.384 176.788 -0.404 25139 94 1 . 1 1 69 69 VAL CA C 69 65.731 65.731 64.512 1.219 25139 95 1 . 1 1 69 69 VAL CB C 69 31.489 31.489 31.372 0.117 25139 96 1 . 1 1 69 69 VAL H H 69 8.572 8.572 7.962 0.610 25139 97 1 . 1 1 70 70 SER N N 70 116.704 116.704 113.809 2.895 25139 98 1 . 1 1 70 70 SER HA H 70 4.229 4.229 4.250 -0.021 25139 99 1 . 1 1 70 70 SER C C 70 174.101 174.101 175.319 -1.218 25139 100 1 . 1 1 70 70 SER CA C 70 61.627 61.627 59.379 2.248 25139 101 1 . 1 1 70 70 SER H H 70 7.951 7.951 7.836 0.115 25139 102 1 . 1 1 71 71 ASN N N 71 117.576 117.576 117.143 0.433 25139 103 1 . 1 1 71 71 ASN HA H 71 4.802 4.802 4.666 0.136 25139 104 1 . 1 1 71 71 ASN C C 71 174.332 174.332 174.842 -0.510 25139 105 1 . 1 1 71 71 ASN CA C 71 52.439 52.439 52.854 -0.415 25139 106 1 . 1 1 71 71 ASN CB C 71 40.467 40.467 39.971 0.496 25139 107 1 . 1 1 71 71 ASN H H 71 7.131 7.131 7.502 -0.371 25139 108 1 . 1 1 72 72 GLY N N 72 103.925 103.925 105.467 -1.542 25139 109 1 . 1 1 72 72 GLY C C 72 174.710 174.710 173.503 1.207 25139 110 1 . 1 1 72 72 GLY CA C 72 44.549 44.549 44.516 0.033 25139 111 1 . 1 1 72 72 GLY H H 72 7.338 7.338 7.396 -0.058 25139 112 1 . 1 1 73 73 ALA N N 73 124.942 124.942 123.309 1.633 25139 113 1 . 1 1 73 73 ALA HA H 73 4.172 4.172 4.548 -0.376 25139 114 1 . 1 1 73 73 ALA C C 73 175.896 175.896 176.273 -0.377 25139 115 1 . 1 1 73 73 ALA CA C 73 52.673 52.673 51.919 0.754 25139 116 1 . 1 1 73 73 ALA CB C 73 20.056 20.056 20.103 -0.047 25139 117 1 . 1 1 73 73 ALA H H 73 8.032 8.032 7.790 0.242 25139 118 1 . 1 1 74 74 THR N N 74 113.423 113.423 116.273 -2.850 25139 119 1 . 1 1 74 74 THR HA H 74 4.678 4.678 4.570 0.108 25139 120 1 . 1 1 74 74 THR C C 74 173.339 173.339 173.216 0.123 25139 121 1 . 1 1 74 74 THR CA C 74 61.545 61.545 61.148 0.397 25139 122 1 . 1 1 74 74 THR CB C 74 71.319 71.319 71.479 -0.160 25139 123 1 . 1 1 74 74 THR H H 74 8.530 8.530 8.290 0.240 25139 124 1 . 1 1 75 75 PHE N N 75 128.180 128.180 129.932 -1.752 25139 125 1 . 1 1 75 75 PHE HA H 75 4.604 4.604 4.882 -0.278 25139 126 1 . 1 1 75 75 PHE C C 75 174.623 174.623 175.064 -0.441 25139 127 1 . 1 1 75 75 PHE CA C 75 57.616 57.616 56.629 0.987 25139 128 1 . 1 1 75 75 PHE CB C 75 38.675 38.675 38.396 0.279 25139 129 1 . 1 1 75 75 PHE H H 75 9.146 9.146 9.118 0.028 25139 130 1 . 1 1 76 76 LEU N N 76 127.849 127.849 125.398 2.451 25139 131 1 . 1 1 76 76 LEU HA H 76 4.351 4.351 4.520 -0.169 25139 132 1 . 1 1 76 76 LEU C C 76 176.339 176.339 176.542 -0.203 25139 133 1 . 1 1 76 76 LEU CA C 76 55.983 55.983 55.594 0.389 25139 134 1 . 1 1 76 76 LEU CB C 76 42.330 42.330 42.369 -0.039 25139 135 1 . 1 1 76 76 LEU H H 76 8.635 8.635 8.128 0.507 25139 136 1 . 1 1 77 77 GLU N N 77 115.131 115.131 119.876 -4.745 25139 137 1 . 1 1 77 77 GLU HA H 77 4.408 4.408 4.483 -0.075 25139 138 1 . 1 1 77 77 GLU C C 77 174.734 174.734 174.636 0.098 25139 139 1 . 1 1 77 77 GLU CA C 77 56.353 56.353 55.331 1.022 25139 140 1 . 1 1 77 77 GLU CB C 77 33.207 33.207 32.881 0.326 25139 141 1 . 1 1 77 77 GLU H H 77 7.252 7.252 7.637 -0.385 25139 142 1 . 1 1 78 78 SER N N 78 118.016 118.016 118.857 -0.841 25139 143 1 . 1 1 78 78 SER HA H 78 5.561 5.561 5.245 0.316 25139 144 1 . 1 1 78 78 SER C C 78 171.968 171.968 172.821 -0.853 25139 145 1 . 1 1 78 78 SER CA C 78 54.061 54.061 55.025 -0.964 25139 146 1 . 1 1 78 78 SER CB C 78 64.074 64.074 63.379 0.695 25139 147 1 . 1 1 78 78 SER H H 78 9.033 9.033 8.647 0.386 25139 148 1 . 1 1 79 79 PRO CA C 79 62.600 62.600 63.057 -0.457 25139 149 1 . 1 1 79 79 PRO CB C 79 32.410 32.410 32.413 -0.003 25139 150 1 . 1 1 80 80 THR N N 80 118.079 118.079 114.724 3.355 25139 151 1 . 1 1 80 80 THR HA H 80 4.342 4.342 4.190 0.152 25139 152 1 . 1 1 80 80 THR C C 80 174.494 174.494 174.328 0.166 25139 153 1 . 1 1 80 80 THR CA C 80 61.453 61.453 60.928 0.525 25139 154 1 . 1 1 80 80 THR CB C 80 67.797 67.797 68.424 -0.627 25139 155 1 . 1 1 80 80 THR H H 80 8.670 8.670 8.134 0.536 25139 156 1 . 1 1 81 81 VAL N N 81 117.395 117.395 116.495 0.900 25139 157 1 . 1 1 81 81 VAL HA H 81 4.607 4.607 3.970 0.637 25139 158 1 . 1 1 81 81 VAL C C 81 175.518 175.518 175.946 -0.428 25139 159 1 . 1 1 81 81 VAL CA C 81 59.114 59.114 62.103 -2.989 25139 160 1 . 1 1 81 81 VAL CB C 81 34.595 34.595 32.387 2.208 25139 161 1 . 1 1 81 81 VAL H H 81 7.448 7.448 7.428 0.020 25139 162 1 . 1 1 82 82 ARG N N 82 117.852 117.852 119.436 -1.584 25139 163 1 . 1 1 82 82 ARG HA H 82 4.521 4.521 4.645 -0.124 25139 164 1 . 1 1 82 82 ARG C C 82 176.992 176.992 175.914 1.078 25139 165 1 . 1 1 82 82 ARG CA C 82 56.385 56.385 55.623 0.762 25139 166 1 . 1 1 82 82 ARG CB C 82 31.602 31.602 30.604 0.998 25139 167 1 . 1 1 82 82 ARG H H 82 8.710 8.710 8.667 0.043 25139 168 1 . 1 1 83 83 ARG N N 83 117.035 117.035 118.073 -1.038 25139 169 1 . 1 1 83 83 ARG HA H 83 5.322 5.322 4.764 0.558 25139 170 1 . 1 1 83 83 ARG C C 83 177.379 177.379 176.612 0.767 25139 171 1 . 1 1 83 83 ARG CA C 83 53.684 53.684 54.680 -0.996 25139 172 1 . 1 1 83 83 ARG CB C 83 33.041 33.041 33.879 -0.838 25139 173 1 . 1 1 83 83 ARG H H 83 7.292 7.292 7.676 -0.384 25139 174 1 . 1 1 84 84 GLY N N 84 114.911 114.911 110.247 4.664 25139 175 1 . 1 1 84 84 GLY C C 84 176.940 176.940 175.125 1.815 25139 176 1 . 1 1 84 84 GLY CA C 84 48.672 48.672 46.822 1.850 25139 177 1 . 1 1 84 84 GLY H H 84 9.255 9.255 8.612 0.643 25139 178 1 . 1 1 85 85 TRP N N 85 121.810 121.810 120.201 1.609 25139 179 1 . 1 1 85 85 TRP HA H 85 4.167 4.167 4.199 -0.032 25139 180 1 . 1 1 85 85 TRP C C 85 178.272 178.272 177.655 0.617 25139 181 1 . 1 1 85 85 TRP CA C 85 60.045 60.045 59.317 0.728 25139 182 1 . 1 1 85 85 TRP CB C 85 29.217 29.217 29.167 0.050 25139 183 1 . 1 1 85 85 TRP H H 85 9.963 9.963 7.905 2.058 25139 184 1 . 1 1 86 86 ASP N N 86 116.400 116.400 119.789 -3.389 25139 185 1 . 1 1 86 86 ASP HA H 86 4.393 4.393 4.465 -0.072 25139 186 1 . 1 1 86 86 ASP C C 86 178.803 178.803 177.931 0.872 25139 187 1 . 1 1 86 86 ASP CA C 86 57.054 57.054 56.885 0.169 25139 188 1 . 1 1 86 86 ASP CB C 86 40.733 40.733 40.259 0.474 25139 189 1 . 1 1 86 86 ASP H H 86 6.934 6.934 7.785 -0.851 25139 190 1 . 1 1 87 87 CYS N N 87 122.454 122.454 119.423 3.031 25139 191 1 . 1 1 87 87 CYS HA H 87 4.250 4.250 4.236 0.014 25139 192 1 . 1 1 87 87 CYS C C 87 174.956 174.956 176.582 -1.626 25139 193 1 . 1 1 87 87 CYS CA C 87 57.147 57.147 61.019 -3.872 25139 194 1 . 1 1 87 87 CYS CB C 87 37.485 37.485 26.227 11.258 25139 195 1 . 1 1 87 87 CYS H H 87 7.603 7.603 7.499 0.104 25139 196 1 . 1 1 88 88 VAL N N 88 119.192 119.192 120.259 -1.067 25139 197 1 . 1 1 88 88 VAL HA H 88 2.458 2.458 3.264 -0.806 25139 198 1 . 1 1 88 88 VAL C C 88 177.413 177.413 177.447 -0.034 25139 199 1 . 1 1 88 88 VAL CA C 88 66.976 66.976 65.721 1.255 25139 200 1 . 1 1 88 88 VAL CB C 88 30.242 30.242 30.951 -0.709 25139 201 1 . 1 1 88 88 VAL H H 88 7.192 7.192 7.484 -0.292 25139 202 1 . 1 1 89 89 ARG N N 89 118.185 118.185 118.810 -0.625 25139 203 1 . 1 1 89 89 ARG HA H 89 3.680 3.680 3.991 -0.311 25139 204 1 . 1 1 89 89 ARG C C 89 178.677 178.677 177.891 0.786 25139 205 1 . 1 1 89 89 ARG CA C 89 59.955 59.955 58.969 0.986 25139 206 1 . 1 1 89 89 ARG CB C 89 29.791 29.791 29.394 0.397 25139 207 1 . 1 1 89 89 ARG H H 89 7.971 7.971 7.825 0.147 25139 208 1 . 1 1 90 90 ALA N N 90 120.815 120.815 122.314 -1.499 25139 209 1 . 1 1 90 90 ALA HA H 90 4.075 4.075 4.155 -0.080 25139 210 1 . 1 1 90 90 ALA C C 90 177.416 177.416 178.964 -1.548 25139 211 1 . 1 1 90 90 ALA CA C 90 54.254 54.254 54.475 -0.221 25139 212 1 . 1 1 90 90 ALA CB C 90 17.436 17.436 18.141 -0.705 25139 213 1 . 1 1 90 90 ALA H H 90 7.453 7.453 7.525 -0.072 25139 214 1 . 1 1 91 91 CYS N N 91 120.380 120.380 116.163 4.217 25139 215 1 . 1 1 91 91 CYS HA H 91 4.371 4.371 4.245 0.126 25139 216 1 . 1 1 91 91 CYS C C 91 176.654 176.654 175.902 0.752 25139 217 1 . 1 1 91 91 CYS CA C 91 57.695 57.695 61.673 -3.978 25139 218 1 . 1 1 91 91 CYS CB C 91 37.704 37.704 25.235 12.469 25139 219 1 . 1 1 91 91 CYS H H 91 7.944 7.944 7.550 0.394 25139 220 1 . 1 1 92 92 CYS N N 92 116.270 116.270 117.915 -1.645 25139 221 1 . 1 1 92 92 CYS HA H 92 4.404 4.404 4.498 -0.094 25139 222 1 . 1 1 92 92 CYS C C 92 175.628 175.628 176.507 -0.879 25139 223 1 . 1 1 92 92 CYS CA C 92 58.706 58.706 60.889 -2.183 25139 224 1 . 1 1 92 92 CYS CB C 92 42.149 42.149 26.945 15.203 25139 225 1 . 1 1 92 92 CYS H H 92 8.315 8.315 7.687 0.628 25139 226 1 . 1 1 93 93 THR N N 93 107.283 107.283 111.282 -3.999 25139 227 1 . 1 1 93 93 THR HA H 93 4.481 4.481 4.301 0.180 25139 228 1 . 1 1 93 93 THR C C 93 173.606 173.606 175.390 -1.784 25139 229 1 . 1 1 93 93 THR CA C 93 61.402 61.402 63.704 -2.302 25139 230 1 . 1 1 93 93 THR CB C 93 69.046 69.046 69.376 -0.330 25139 231 1 . 1 1 93 93 THR H H 93 7.445 7.445 7.553 -0.108 25139 232 1 . 1 1 94 94 THR N N 94 121.432 121.432 121.284 0.148 25139 233 1 . 1 1 94 94 THR HA H 94 4.398 4.398 4.447 -0.049 25139 234 1 . 1 1 94 94 THR C C 94 173.493 173.493 174.908 -1.415 25139 235 1 . 1 1 94 94 THR CA C 94 62.726 62.726 62.946 -0.220 25139 236 1 . 1 1 94 94 THR CB C 94 69.704 69.704 68.719 0.985 25139 237 1 . 1 1 94 94 THR H H 94 7.553 7.553 7.994 -0.441 25139 238 1 . 1 1 95 95 GLN N N 95 129.410 129.410 127.976 1.434 25139 239 1 . 1 1 95 95 GLN HA H 95 3.944 3.944 4.015 -0.071 25139 240 1 . 1 1 95 95 GLN C C 95 176.293 176.293 176.237 0.056 25139 241 1 . 1 1 95 95 GLN CA C 95 58.040 58.040 58.753 -0.713 25139 242 1 . 1 1 95 95 GLN CB C 95 28.256 28.256 28.776 -0.520 25139 243 1 . 1 1 95 95 GLN H H 95 8.812 8.812 8.810 0.002 25139 244 1 . 1 1 96 96 ASN N N 96 115.015 115.015 114.642 0.373 25139 245 1 . 1 1 96 96 ASN HA H 96 4.199 4.199 4.812 -0.613 25139 246 1 . 1 1 96 96 ASN C C 96 172.260 172.260 173.868 -1.608 25139 247 1 . 1 1 96 96 ASN CA C 96 55.567 55.567 52.960 2.607 25139 248 1 . 1 1 96 96 ASN CB C 96 36.837 36.837 38.828 -1.991 25139 249 1 . 1 1 96 96 ASN H H 96 8.791 8.791 8.131 0.660 25139 250 1 . 1 1 97 97 CYS N N 97 115.830 115.830 120.456 -4.626 25139 251 1 . 1 1 97 97 CYS HA H 97 4.101 4.101 4.475 -0.374 25139 252 1 . 1 1 97 97 CYS C C 97 175.025 175.025 173.967 1.058 25139 253 1 . 1 1 97 97 CYS CA C 97 58.148 58.148 59.793 -1.645 25139 254 1 . 1 1 97 97 CYS CB C 97 43.234 43.234 27.031 16.203 25139 255 1 . 1 1 97 97 CYS H H 97 7.651 7.651 7.788 -0.137 25139 256 1 . 1 1 98 98 ASN N N 98 125.148 125.148 125.114 0.034 25139 257 1 . 1 1 98 98 ASN HA H 98 5.133 5.133 5.022 0.111 25139 258 1 . 1 1 98 98 ASN C C 98 171.892 171.892 174.279 -2.387 25139 259 1 . 1 1 98 98 ASN CA C 98 53.194 53.194 53.560 -0.366 25139 260 1 . 1 1 98 98 ASN CB C 98 39.948 39.948 41.375 -1.427 25139 261 1 . 1 1 98 98 ASN H H 98 8.736 8.736 8.414 0.322 25139 262 1 . 1 1 99 99 LEU N N 99 120.898 120.898 121.063 -0.165 25139 263 1 . 1 1 99 99 LEU C C 99 173.084 173.084 174.047 -0.963 25139 264 1 . 1 1 99 99 LEU CA C 99 56.120 56.120 53.667 2.453 25139 265 1 . 1 1 99 99 LEU CB C 99 44.328 44.328 45.588 -1.260 25139 266 1 . 1 1 99 99 LEU H H 99 8.200 8.200 8.112 0.088 25139 267 1 . 1 1 100 100 ALA N N 100 128.085 128.085 129.697 -1.612 25139 268 1 . 1 1 100 100 ALA C C 100 174.938 174.938 175.454 -0.516 25139 269 1 . 1 1 100 100 ALA CA C 100 49.747 49.747 50.485 -0.739 25139 270 1 . 1 1 100 100 ALA CB C 100 20.714 20.714 20.428 0.287 25139 271 1 . 1 1 100 100 ALA H H 100 9.156 9.156 9.238 -0.081 25139 272 1 . 1 1 101 101 LEU N N 101 128.723 128.723 127.964 0.759 25139 273 1 . 1 1 101 101 LEU HA H 101 5.142 5.142 5.275 -0.133 25139 274 1 . 1 1 101 101 LEU C C 101 174.379 174.379 175.328 -0.949 25139 275 1 . 1 1 101 101 LEU CA C 101 53.853 53.853 54.459 -0.606 25139 276 1 . 1 1 101 101 LEU CB C 101 45.307 45.307 44.701 0.606 25139 277 1 . 1 1 101 101 LEU H H 101 9.578 9.578 8.984 0.594 25139 278 1 . 1 1 102 102 VAL N N 102 119.417 119.417 119.758 -0.341 25139 279 1 . 1 1 102 102 VAL HA H 102 5.528 5.528 5.211 0.317 25139 280 1 . 1 1 102 102 VAL C C 102 173.660 173.660 174.012 -0.352 25139 281 1 . 1 1 102 102 VAL CA C 102 58.620 58.620 58.938 -0.318 25139 282 1 . 1 1 102 102 VAL CB C 102 34.273 34.273 35.816 -1.543 25139 283 1 . 1 1 102 102 VAL H H 102 9.297 9.297 9.387 -0.090 25139 284 1 . 1 1 103 103 GLU N N 103 124.427 124.427 123.763 0.664 25139 285 1 . 1 1 103 103 GLU HA H 103 3.865 3.865 4.250 -0.385 25139 286 1 . 1 1 103 103 GLU C C 103 176.319 176.319 175.138 1.181 25139 287 1 . 1 1 103 103 GLU CA C 103 54.101 54.101 54.426 -0.325 25139 288 1 . 1 1 103 103 GLU CB C 103 32.201 32.201 31.704 0.497 25139 289 1 . 1 1 103 103 GLU H H 103 7.749 7.749 8.279 -0.530 25139 290 1 . 1 1 104 104 LEU N N 104 127.294 127.294 125.742 1.552 25139 291 1 . 1 1 104 104 LEU HA H 104 4.320 4.320 4.494 -0.174 25139 292 1 . 1 1 104 104 LEU C C 104 176.593 176.593 177.470 -0.877 25139 293 1 . 1 1 104 104 LEU CA C 104 56.084 56.084 53.317 2.767 25139 294 1 . 1 1 104 104 LEU CB C 104 42.391 42.391 43.063 -0.672 25139 295 1 . 1 1 104 104 LEU H H 104 8.323 8.323 8.287 0.036 25139 296 1 . 1 1 105 105 GLN N N 105 121.361 121.361 116.680 4.681 25139 297 1 . 1 1 105 105 GLN C C 105 172.868 172.868 174.508 -1.640 25139 298 1 . 1 1 105 105 GLN CA C 105 53.406 53.406 56.412 -3.006 25139 299 1 . 1 1 105 105 GLN CB C 105 29.729 29.729 27.308 2.421 25139 300 1 . 1 1 105 105 GLN H H 105 8.095 8.095 8.290 -0.195 25139 301 1 . 1 1 106 106 PRO HA H 106 4.409 4.409 4.447 -0.038 25139 302 1 . 1 1 106 106 PRO C C 106 177.770 177.770 176.795 0.975 25139 303 1 . 1 1 106 106 PRO CA C 106 64.485 64.485 64.594 -0.109 25139 304 1 . 1 1 106 106 PRO CB C 106 31.768 31.768 32.118 -0.350 25139 305 1 . 1 1 107 107 ASP N N 107 116.484 116.484 115.525 0.959 25139 306 1 . 1 1 107 107 ASP HA H 107 4.440 4.440 4.581 -0.141 25139 307 1 . 1 1 107 107 ASP C C 107 176.749 176.749 176.125 0.624 25139 308 1 . 1 1 107 107 ASP CA C 107 55.455 55.455 55.234 0.221 25139 309 1 . 1 1 107 107 ASP CB C 107 39.888 39.888 41.012 -1.123 25139 310 1 . 1 1 107 107 ASP H H 107 8.638 8.638 8.440 0.198 25139 311 1 . 1 1 108 108 ARG N N 108 117.895 117.895 120.206 -2.311 25139 312 1 . 1 1 108 108 ARG HA H 108 4.490 4.490 4.656 -0.166 25139 313 1 . 1 1 108 108 ARG C C 108 176.111 176.111 177.004 -0.894 25139 314 1 . 1 1 108 108 ARG CA C 108 55.265 55.265 55.324 -0.059 25139 315 1 . 1 1 108 108 ARG CB C 108 31.076 31.076 31.043 0.033 25139 316 1 . 1 1 108 108 ARG H H 108 7.905 7.905 8.267 -0.362 25139 317 1 . 1 1 109 109 GLY N N 109 108.307 108.307 108.123 0.184 25139 318 1 . 1 1 109 109 GLY C C 109 173.949 173.949 174.181 -0.232 25139 319 1 . 1 1 109 109 GLY CA C 109 44.551 44.551 45.608 -1.057 25139 320 1 . 1 1 109 109 GLY H H 109 7.753 7.753 8.291 -0.538 25139 321 1 . 1 1 110 110 GLU N N 110 120.035 120.035 122.012 -1.977 25139 322 1 . 1 1 110 110 GLU HA H 110 4.091 4.091 4.469 -0.379 25139 323 1 . 1 1 110 110 GLU C C 110 177.045 177.045 176.751 0.294 25139 324 1 . 1 1 110 110 GLU CA C 110 58.282 58.282 56.565 1.717 25139 325 1 . 1 1 110 110 GLU CB C 110 29.673 29.673 30.982 -1.309 25139 326 1 . 1 1 110 110 GLU H H 110 8.509 8.509 8.375 0.134 25139 327 1 . 1 1 111 111 ASP N N 111 121.160 121.160 120.819 0.342 25139 328 1 . 1 1 111 111 ASP HA H 111 4.570 4.570 4.491 0.079 25139 329 1 . 1 1 111 111 ASP C C 111 175.089 175.089 175.685 -0.596 25139 330 1 . 1 1 111 111 ASP CA C 111 54.591 54.591 56.254 -1.663 25139 331 1 . 1 1 111 111 ASP CB C 111 42.432 42.432 41.095 1.337 25139 332 1 . 1 1 111 111 ASP H H 111 8.916 8.916 8.511 0.405 25139 333 1 . 1 1 112 112 ALA N N 112 122.130 122.130 119.141 2.989 25139 334 1 . 1 1 112 112 ALA C C 112 178.120 178.120 175.854 2.266 25139 335 1 . 1 1 112 112 ALA CA C 112 53.259 53.259 50.488 2.770 25139 336 1 . 1 1 112 112 ALA CB C 112 19.770 19.770 21.427 -1.657 25139 337 1 . 1 1 112 112 ALA H H 112 7.361 7.361 7.475 -0.114 25139 338 1 . 1 1 113 113 ILE N N 113 113.780 113.780 114.606 -0.826 25139 339 1 . 1 1 113 113 ILE HA H 113 4.886 4.886 4.808 0.078 25139 340 1 . 1 1 113 113 ILE C C 113 174.258 174.258 174.844 -0.586 25139 341 1 . 1 1 113 113 ILE CA C 113 59.512 59.512 59.260 0.252 25139 342 1 . 1 1 113 113 ILE CB C 113 41.848 41.848 41.810 0.038 25139 343 1 . 1 1 113 113 ILE H H 113 7.667 7.667 8.301 -0.634 25139 344 1 . 1 1 114 114 ALA N N 114 122.673 122.673 125.235 -2.562 25139 345 1 . 1 1 114 114 ALA C C 114 176.984 176.984 176.716 0.268 25139 346 1 . 1 1 114 114 ALA CA C 114 51.564 51.564 53.038 -1.474 25139 347 1 . 1 1 114 114 ALA CB C 114 20.582 20.582 19.635 0.947 25139 348 1 . 1 1 114 114 ALA H H 114 8.904 8.904 8.825 0.079 25139 349 1 . 1 1 115 115 ALA N N 115 116.486 116.486 116.636 -0.150 25139 350 1 . 1 1 115 115 ALA HA H 115 4.355 4.355 4.452 -0.097 25139 351 1 . 1 1 115 115 ALA C C 115 174.138 174.138 174.180 -0.042 25139 352 1 . 1 1 115 115 ALA CA C 115 52.320 52.320 50.847 1.473 25139 353 1 . 1 1 115 115 ALA CB C 115 22.983 22.983 21.285 1.698 25139 354 1 . 1 1 115 115 ALA H H 115 7.182 7.182 7.242 -0.060 25139 355 1 . 1 1 116 116 CYS N N 116 120.099 120.099 119.854 0.245 25139 356 1 . 1 1 116 116 CYS HA H 116 5.331 5.331 5.240 0.091 25139 357 1 . 1 1 116 116 CYS C C 116 176.609 176.609 172.516 4.093 25139 358 1 . 1 1 116 116 CYS CA C 116 53.949 53.949 56.357 -2.408 25139 359 1 . 1 1 116 116 CYS CB C 116 40.384 40.384 28.755 11.629 25139 360 1 . 1 1 116 116 CYS H H 116 8.298 8.298 7.881 0.417 25139 361 1 . 1 1 117 117 PHE N N 117 126.406 126.406 125.730 0.676 25139 362 1 . 1 1 117 117 PHE HA H 117 5.199 5.199 5.186 0.012 25139 363 1 . 1 1 117 117 PHE C C 117 173.385 173.385 174.267 -0.882 25139 364 1 . 1 1 117 117 PHE CA C 117 56.254 56.254 56.073 0.181 25139 365 1 . 1 1 117 117 PHE CB C 117 41.681 41.681 41.585 0.096 25139 366 1 . 1 1 117 117 PHE H H 117 9.712 9.712 9.098 0.614 25139 367 1 . 1 1 118 118 LEU N N 118 122.119 122.119 123.822 -1.703 25139 368 1 . 1 1 118 118 LEU HA H 118 5.166 5.166 5.451 -0.285 25139 369 1 . 1 1 118 118 LEU C C 118 175.097 175.097 176.218 -1.121 25139 370 1 . 1 1 118 118 LEU CA C 118 53.904 53.904 54.241 -0.337 25139 371 1 . 1 1 118 118 LEU CB C 118 42.298 42.298 43.584 -1.286 25139 372 1 . 1 1 118 118 LEU H H 118 8.719 8.719 9.247 -0.528 25139 373 1 . 1 1 119 119 ILE N N 119 125.324 125.324 122.636 2.688 25139 374 1 . 1 1 119 119 ILE HA H 119 4.877 4.877 4.941 -0.064 25139 375 1 . 1 1 119 119 ILE C C 119 173.825 173.825 175.443 -1.618 25139 376 1 . 1 1 119 119 ILE CA C 119 59.107 59.107 59.928 -0.821 25139 377 1 . 1 1 119 119 ILE CB C 119 41.510 41.510 42.252 -0.742 25139 378 1 . 1 1 119 119 ILE H H 119 8.986 8.986 9.044 -0.058 25139 379 1 . 1 1 120 120 ASN N N 120 121.534 121.534 124.488 -2.954 25139 380 1 . 1 1 120 120 ASN HA H 120 5.390 5.390 4.769 0.621 25139 381 1 . 1 1 120 120 ASN C C 120 176.098 176.098 175.976 0.122 25139 382 1 . 1 1 120 120 ASN CA C 120 51.457 51.457 55.285 -3.828 25139 383 1 . 1 1 120 120 ASN CB C 120 39.918 39.918 38.968 0.950 25139 384 1 . 1 1 120 120 ASN H H 120 8.694 8.694 9.058 -0.364 25139 385 1 . 1 1 121 121 CYS N N 121 122.779 122.779 116.456 6.323 25139 386 1 . 1 1 121 121 CYS HA H 121 4.483 4.483 4.106 0.377 25139 387 1 . 1 1 121 121 CYS C C 121 173.195 173.195 173.431 -0.236 25139 388 1 . 1 1 121 121 CYS CA C 121 55.764 55.764 59.788 -4.024 25139 389 1 . 1 1 121 121 CYS CB C 121 41.707 41.707 25.596 16.111 25139 390 1 . 1 1 121 121 CYS H H 121 10.668 10.668 8.556 2.112 25139 391 1 . 1 1 122 122 LEU N N 122 121.063 121.063 117.288 3.775 25139 392 1 . 1 1 122 122 LEU HA H 122 5.365 5.365 5.497 -0.132 25139 393 1 . 1 1 122 122 LEU C C 122 176.743 176.743 175.628 1.115 25139 394 1 . 1 1 122 122 LEU CA C 122 53.664 53.664 53.048 0.616 25139 395 1 . 1 1 122 122 LEU CB C 122 44.234 44.234 45.622 -1.388 25139 396 1 . 1 1 122 122 LEU H H 122 8.256 8.256 7.718 0.538 25139 397 1 . 1 1 123 123 TYR N N 123 123.081 123.081 123.080 0.001 25139 398 1 . 1 1 123 123 TYR HA H 123 4.043 4.043 4.746 -0.703 25139 399 1 . 1 1 123 123 TYR C C 123 173.633 173.633 174.854 -1.221 25139 400 1 . 1 1 123 123 TYR CA C 123 57.888 57.888 58.152 -0.264 25139 401 1 . 1 1 123 123 TYR CB C 123 41.081 41.081 41.630 -0.549 25139 402 1 . 1 1 123 123 TYR H H 123 8.990 8.990 8.961 0.029 25139 403 1 . 1 1 124 124 GLU N N 124 128.742 128.742 126.705 2.037 25139 404 1 . 1 1 124 124 GLU HA H 124 3.550 3.550 3.725 -0.175 25139 405 1 . 1 1 124 124 GLU C C 124 174.835 174.835 175.461 -0.626 25139 406 1 . 1 1 124 124 GLU CA C 124 57.632 57.632 57.448 0.184 25139 407 1 . 1 1 124 124 GLU CB C 124 26.895 26.895 27.432 -0.537 25139 408 1 . 1 1 124 124 GLU H H 124 9.135 9.135 8.762 0.373 25139 409 1 . 1 1 125 125 GLN N N 125 108.066 108.066 109.734 -1.668 25139 410 1 . 1 1 125 125 GLN HA H 125 3.721 3.721 3.912 -0.191 25139 411 1 . 1 1 125 125 GLN C C 125 174.627 174.627 174.807 -0.180 25139 412 1 . 1 1 125 125 GLN CA C 125 58.039 58.039 57.515 0.524 25139 413 1 . 1 1 125 125 GLN CB C 125 27.328 27.328 27.621 -0.293 25139 414 1 . 1 1 125 125 GLN H H 125 8.390 8.390 8.492 -0.102 25139 415 1 . 1 1 126 126 ASN N N 126 118.528 118.528 117.586 0.942 25139 416 1 . 1 1 126 126 ASN C C 126 173.713 173.713 174.759 -1.046 25139 417 1 . 1 1 126 126 ASN CA C 126 52.189 52.189 52.623 -0.434 25139 418 1 . 1 1 126 126 ASN CB C 126 40.801 40.801 39.845 0.956 25139 419 1 . 1 1 126 126 ASN H H 126 8.092 8.092 7.962 0.130 25139 420 1 . 1 1 127 127 PHE N N 127 124.680 124.680 122.116 2.564 25139 421 1 . 1 1 127 127 PHE HA H 127 5.037 5.037 4.763 0.274 25139 422 1 . 1 1 127 127 PHE C C 127 177.125 177.125 176.465 0.660 25139 423 1 . 1 1 127 127 PHE CA C 127 58.413 58.413 57.354 1.058 25139 424 1 . 1 1 127 127 PHE CB C 127 39.244 39.244 38.152 1.092 25139 425 1 . 1 1 127 127 PHE H H 127 9.026 9.026 8.827 0.199 25139 426 1 . 1 1 128 128 VAL N N 128 119.455 119.455 118.756 0.698 25139 427 1 . 1 1 128 128 VAL C C 128 175.886 175.886 175.712 0.174 25139 428 1 . 1 1 128 128 VAL CA C 128 60.919 60.919 61.699 -0.780 25139 429 1 . 1 1 128 128 VAL CB C 128 33.194 33.194 31.045 2.149 25139 430 1 . 1 1 128 128 VAL H H 128 8.364 8.364 7.643 0.721 25139 431 1 . 1 1 129 129 CYS N N 129 116.130 116.130 120.445 -4.315 25139 432 1 . 1 1 129 129 CYS HA H 129 3.477 3.477 3.854 -0.377 25139 433 1 . 1 1 129 129 CYS C C 129 170.569 170.569 174.151 -3.582 25139 434 1 . 1 1 129 129 CYS CA C 129 56.150 56.150 59.768 -3.618 25139 435 1 . 1 1 129 129 CYS CB C 129 44.617 44.617 25.845 18.772 25139 436 1 . 1 1 129 129 CYS H H 129 5.390 5.390 7.171 -1.781 25139 437 1 . 1 1 130 130 LYS N N 130 120.071 120.071 125.524 -5.453 25139 438 1 . 1 1 130 130 LYS HA H 130 4.561 4.561 4.232 0.329 25139 439 1 . 1 1 130 130 LYS C C 130 176.853 176.853 174.521 2.332 25139 440 1 . 1 1 130 130 LYS CA C 130 53.887 53.887 54.251 -0.364 25139 441 1 . 1 1 130 130 LYS CB C 130 35.642 35.642 34.389 1.253 25139 442 1 . 1 1 130 130 LYS H H 130 8.066 8.066 8.215 -0.149 25139 443 1 . 1 1 131 131 PHE N N 131 118.415 118.415 119.903 -1.488 25139 444 1 . 1 1 131 131 PHE HA H 131 4.607 4.607 5.438 -0.831 25139 445 1 . 1 1 131 131 PHE C C 131 174.013 174.013 175.174 -1.161 25139 446 1 . 1 1 131 131 PHE CA C 131 57.711 57.711 56.242 1.469 25139 447 1 . 1 1 131 131 PHE CB C 131 44.080 44.080 43.398 0.683 25139 448 1 . 1 1 131 131 PHE H H 131 8.714 8.714 8.248 0.466 25139 449 1 . 1 1 132 132 ALA N N 132 124.209 124.209 122.834 1.375 25139 450 1 . 1 1 132 132 ALA HA H 132 4.617 4.617 5.022 -0.405 25139 451 1 . 1 1 132 132 ALA C C 132 174.352 174.352 174.324 0.028 25139 452 1 . 1 1 132 132 ALA CA C 132 51.441 51.441 49.561 1.880 25139 453 1 . 1 1 132 132 ALA CB C 132 20.464 20.464 20.865 -0.401 25139 454 1 . 1 1 132 132 ALA H H 132 9.295 9.295 9.085 0.210 25139 455 1 . 1 1 133 133 PRO HA H 133 4.883 4.883 5.357 -0.474 25139 456 1 . 1 1 133 133 PRO C C 133 173.923 173.923 176.464 -2.541 25139 457 1 . 1 1 133 133 PRO CA C 133 63.071 63.071 62.629 0.442 25139 458 1 . 1 1 133 133 PRO CB C 133 31.603 31.603 32.463 -0.860 25139 459 1 . 1 1 134 134 ARG N N 134 126.071 126.071 122.967 3.104 25139 460 1 . 1 1 134 134 ARG HA H 134 4.255 4.255 4.656 -0.401 25139 461 1 . 1 1 134 134 ARG C C 134 177.065 177.065 176.054 1.011 25139 462 1 . 1 1 134 134 ARG CA C 134 57.164 57.164 55.047 2.117 25139 463 1 . 1 1 134 134 ARG CB C 134 32.183 32.183 33.112 -0.929 25139 464 1 . 1 1 134 134 ARG H H 134 8.672 8.672 8.546 0.126 25139 465 1 . 1 1 135 135 GLU N N 135 125.683 125.683 121.401 4.282 25139 466 1 . 1 1 135 135 GLU HA H 135 4.353 4.353 4.437 -0.084 25139 467 1 . 1 1 135 135 GLU C C 135 178.081 178.081 176.895 1.186 25139 468 1 . 1 1 135 135 GLU CA C 135 57.651 57.651 57.163 0.488 25139 469 1 . 1 1 135 135 GLU CB C 135 29.996 29.996 30.129 -0.133 25139 470 1 . 1 1 135 135 GLU H H 135 8.603 8.603 8.849 -0.246 25139 471 1 . 1 1 136 136 GLY N N 136 110.031 110.031 107.740 2.291 25139 472 1 . 1 1 136 136 GLY C C 136 173.079 173.079 173.040 0.039 25139 473 1 . 1 1 136 136 GLY CA C 136 45.778 45.778 44.892 0.886 25139 474 1 . 1 1 136 136 GLY H H 136 9.036 9.036 8.365 0.671 25139 475 1 . 1 1 137 137 PHE HA H 137 5.675 5.675 5.238 0.437 25139 476 1 . 1 1 137 137 PHE C C 137 174.936 174.936 174.595 0.341 25139 477 1 . 1 1 137 137 PHE CA C 137 56.084 56.084 57.169 -1.085 25139 478 1 . 1 1 137 137 PHE CB C 137 44.696 44.696 41.670 3.026 25139 479 1 . 1 1 138 138 ILE N N 138 117.417 117.417 114.537 2.880 25139 480 1 . 1 1 138 138 ILE HA H 138 4.507 4.507 4.666 -0.159 25139 481 1 . 1 1 138 138 ILE C C 138 173.858 173.858 173.478 0.380 25139 482 1 . 1 1 138 138 ILE CA C 138 60.620 60.620 59.638 0.982 25139 483 1 . 1 1 138 138 ILE CB C 138 42.597 42.597 41.289 1.308 25139 484 1 . 1 1 138 138 ILE H H 138 8.777 8.777 8.547 0.230 25139 485 1 . 1 1 139 139 ASN N N 139 117.201 117.201 116.865 0.336 25139 486 1 . 1 1 139 139 ASN HA H 139 6.059 6.059 5.500 0.559 25139 487 1 . 1 1 139 139 ASN C C 139 173.721 173.721 174.014 -0.293 25139 488 1 . 1 1 139 139 ASN CA C 139 50.230 50.230 51.725 -1.495 25139 489 1 . 1 1 139 139 ASN CB C 139 43.861 43.861 42.318 1.543 25139 490 1 . 1 1 139 139 ASN H H 139 8.872 8.872 8.311 0.561 25139 491 1 . 1 1 140 140 TYR N N 140 123.991 123.991 119.712 4.279 25139 492 1 . 1 1 140 140 TYR HA H 140 5.178 5.178 4.788 0.390 25139 493 1 . 1 1 140 140 TYR C C 140 174.791 174.791 175.254 -0.463 25139 494 1 . 1 1 140 140 TYR CA C 140 57.072 57.072 58.295 -1.223 25139 495 1 . 1 1 140 140 TYR CB C 140 41.670 41.670 39.795 1.876 25139 496 1 . 1 1 140 140 TYR H H 140 9.526 9.526 8.899 0.627 25139 497 1 . 1 1 141 141 LEU N N 141 122.779 122.779 121.160 1.619 25139 498 1 . 1 1 141 141 LEU C C 141 175.404 175.404 177.531 -2.127 25139 499 1 . 1 1 141 141 LEU CA C 141 55.103 55.103 52.843 2.260 25139 500 1 . 1 1 141 141 LEU CB C 141 45.161 45.161 45.955 -0.794 25139 501 1 . 1 1 141 141 LEU H H 141 9.010 9.010 9.062 -0.052 25139 502 1 . 1 1 142 142 THR N N 142 113.189 113.189 112.290 0.899 25139 503 1 . 1 1 142 142 THR HA H 142 4.061 4.061 4.325 -0.264 25139 504 1 . 1 1 142 142 THR C C 142 175.940 175.940 176.271 -0.331 25139 505 1 . 1 1 142 142 THR CA C 142 61.389 61.389 60.698 0.691 25139 506 1 . 1 1 142 142 THR CB C 142 69.779 69.779 70.399 -0.620 25139 507 1 . 1 1 142 142 THR H H 142 7.737 7.737 8.141 -0.404 25139 508 1 . 1 1 143 143 ARG N N 143 120.975 120.975 120.208 0.767 25139 509 1 . 1 1 143 143 ARG HA H 143 3.938 3.938 3.991 -0.053 25139 510 1 . 1 1 143 143 ARG C C 143 178.690 178.690 177.469 1.221 25139 511 1 . 1 1 143 143 ARG CA C 143 59.748 59.748 58.934 0.814 25139 512 1 . 1 1 143 143 ARG CB C 143 30.145 30.145 29.515 0.630 25139 513 1 . 1 1 143 143 ARG H H 143 8.149 8.149 8.429 -0.280 25139 514 1 . 1 1 144 144 GLU N N 144 116.997 116.997 118.301 -1.304 25139 515 1 . 1 1 144 144 GLU HA H 144 4.109 4.109 4.292 -0.183 25139 516 1 . 1 1 144 144 GLU C C 144 178.442 178.442 177.793 0.649 25139 517 1 . 1 1 144 144 GLU CA C 144 59.863 59.863 58.298 1.565 25139 518 1 . 1 1 144 144 GLU CB C 144 29.582 29.582 30.133 -0.551 25139 519 1 . 1 1 144 144 GLU H H 144 8.622 8.622 7.657 0.965 25139 520 1 . 1 1 145 145 VAL N N 145 111.213 111.213 117.458 -6.245 25139 521 1 . 1 1 145 145 VAL HA H 145 4.411 4.411 3.996 0.415 25139 522 1 . 1 1 145 145 VAL C C 145 176.965 176.965 176.761 0.204 25139 523 1 . 1 1 145 145 VAL CA C 145 62.594 62.594 63.130 -0.536 25139 524 1 . 1 1 145 145 VAL CB C 145 32.082 32.082 32.204 -0.122 25139 525 1 . 1 1 145 145 VAL H H 145 7.227 7.227 7.639 -0.412 25139 526 1 . 1 1 146 146 TYR N N 146 123.512 123.512 121.818 1.694 25139 527 1 . 1 1 146 146 TYR HA H 146 3.880 3.880 4.037 -0.157 25139 528 1 . 1 1 146 146 TYR C C 146 176.377 176.377 176.770 -0.393 25139 529 1 . 1 1 146 146 TYR CA C 146 62.537 62.537 62.210 0.327 25139 530 1 . 1 1 146 146 TYR CB C 146 38.339 38.339 38.630 -0.291 25139 531 1 . 1 1 146 146 TYR H H 146 8.492 8.492 8.734 -0.242 25139 532 1 . 1 1 147 147 ARG N N 147 116.680 116.680 117.110 -0.430 25139 533 1 . 1 1 147 147 ARG HA H 147 3.814 3.814 3.859 -0.045 25139 534 1 . 1 1 147 147 ARG C C 147 178.858 178.858 178.104 0.754 25139 535 1 . 1 1 147 147 ARG CA C 147 59.696 59.696 59.233 0.463 25139 536 1 . 1 1 147 147 ARG CB C 147 29.665 29.665 29.501 0.164 25139 537 1 . 1 1 147 147 ARG H H 147 8.053 8.053 8.417 -0.364 25139 538 1 . 1 1 148 148 SER N N 148 115.306 115.306 114.544 0.762 25139 539 1 . 1 1 148 148 SER HA H 148 3.998 3.998 4.330 -0.332 25139 540 1 . 1 1 148 148 SER C C 148 175.786 175.786 175.787 -0.001 25139 541 1 . 1 1 148 148 SER CA C 148 62.006 62.006 60.169 1.837 25139 542 1 . 1 1 148 148 SER H H 148 7.139 7.139 7.472 -0.333 25139 543 1 . 1 1 149 149 TYR N N 149 123.207 123.207 122.554 0.653 25139 544 1 . 1 1 149 149 TYR C C 149 175.831 175.831 177.334 -1.503 25139 545 1 . 1 1 149 149 TYR CA C 149 60.600 60.600 61.355 -0.755 25139 546 1 . 1 1 149 149 TYR CB C 149 38.781 38.781 38.478 0.303 25139 547 1 . 1 1 149 149 TYR H H 149 7.253 7.253 7.545 -0.292 25139 548 1 . 1 1 150 150 ARG N N 150 118.708 118.708 116.932 1.776 25139 549 1 . 1 1 150 150 ARG HA H 150 3.346 3.346 3.941 -0.595 25139 550 1 . 1 1 150 150 ARG C C 150 177.644 177.644 177.923 -0.279 25139 551 1 . 1 1 150 150 ARG CA C 150 57.323 57.323 57.286 0.037 25139 552 1 . 1 1 150 150 ARG CB C 150 28.854 28.854 29.410 -0.556 25139 553 1 . 1 1 150 150 ARG H H 150 8.441 8.441 7.634 0.807 25139 554 1 . 1 1 151 151 GLN N N 151 116.551 116.551 116.574 -0.023 25139 555 1 . 1 1 151 151 GLN HA H 151 3.957 3.957 4.095 -0.138 25139 556 1 . 1 1 151 151 GLN C C 151 177.987 177.987 176.820 1.167 25139 557 1 . 1 1 151 151 GLN CA C 151 58.341 58.341 57.899 0.442 25139 558 1 . 1 1 151 151 GLN CB C 151 28.464 28.464 28.464 0.000 25139 559 1 . 1 1 151 151 GLN H H 151 7.332 7.332 7.558 -0.226 25139 560 1 . 1 1 152 152 LEU N N 152 118.877 118.877 113.830 5.047 25139 561 1 . 1 1 152 152 LEU HA H 152 4.179 4.179 4.605 -0.426 25139 562 1 . 1 1 152 152 LEU C C 152 179.070 179.070 177.179 1.891 25139 563 1 . 1 1 152 152 LEU CA C 152 57.082 57.082 55.701 1.380 25139 564 1 . 1 1 152 152 LEU CB C 152 41.688 41.688 42.359 -0.671 25139 565 1 . 1 1 152 152 LEU H H 152 7.106 7.106 7.300 -0.194 25139 566 1 . 1 1 153 153 VAL N N 153 119.076 119.076 113.203 5.873 25139 567 1 . 1 1 153 153 VAL HA H 153 2.860 2.860 4.033 -1.173 25139 568 1 . 1 1 153 153 VAL C C 153 177.421 177.421 176.192 1.230 25139 569 1 . 1 1 153 153 VAL CA C 153 64.583 64.583 62.182 2.401 25139 570 1 . 1 1 153 153 VAL CB C 153 31.518 31.518 33.093 -1.575 25139 571 1 . 1 1 153 153 VAL H H 153 7.427 7.427 7.171 0.256 25139 572 1 . 1 1 154 154 ASP N N 154 119.888 119.888 121.560 -1.672 25139 573 1 . 1 1 154 154 ASP C C 154 177.422 177.422 175.817 1.605 25139 574 1 . 1 1 154 154 ASP CA C 154 56.071 56.071 54.400 1.671 25139 575 1 . 1 1 154 154 ASP CB C 154 40.349 40.349 41.294 -0.945 25139 576 1 . 1 1 154 154 ASP H H 154 7.930 7.930 7.723 0.207 25139 577 1 . 1 1 155 155 HIS N N 155 117.821 117.821 118.842 -1.021 25139 578 1 . 1 1 155 155 HIS CA C 155 57.756 57.756 55.933 1.823 25139 579 1 . 1 1 155 155 HIS CB C 155 30.180 30.180 30.375 -0.195 25139 580 1 . 1 1 155 155 HIS H H 155 7.680 7.680 8.106 -0.426 25139 581 1 . 1 1 156 156 HIS N N 156 119.180 119.180 119.319 -0.139 25139 582 1 . 1 1 156 156 HIS CA C 156 57.931 57.931 55.967 1.964 25139 583 1 . 1 1 156 156 HIS CB C 156 30.300 30.300 30.462 -0.162 25139 584 1 . 1 1 156 156 HIS H H 156 7.868 7.868 8.118 -0.250 25139 stop_ save_