data_19700 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19700 _Entry.PDB_ID 2MJ0 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 19700 _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 1 101 101 LEU N N 101 128.488 128.488 121.401 7.087 19700 2 1 1 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.886 -0.164 19700 3 1 1 . 1 1 101 101 LEU H H 101 8.706 8.706 8.337 0.369 19700 4 1 1 . 1 1 102 102 THR N N 102 117.086 117.086 118.521 -1.435 19700 5 1 1 . 1 1 102 102 THR HA H 102 5.198 5.198 4.878 0.320 19700 6 1 1 . 1 1 102 102 THR H H 102 7.729 7.729 8.234 -0.505 19700 7 1 1 . 1 1 103 103 CYS N N 103 119.021 119.021 124.808 -5.787 19700 8 1 1 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.810 0.318 19700 9 1 1 . 1 1 103 103 CYS H H 103 8.514 8.514 9.188 -0.674 19700 10 1 1 . 1 1 104 104 LEU N N 104 123.028 123.028 121.959 1.069 19700 11 1 1 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.545 0.266 19700 12 1 1 . 1 1 104 104 LEU H H 104 9.147 9.147 8.381 0.766 19700 13 1 1 . 1 1 105 105 ASN N N 105 119.029 119.029 117.832 1.197 19700 14 1 1 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.093 -0.287 19700 15 1 1 . 1 1 105 105 ASN H H 105 8.611 8.611 8.662 -0.051 19700 16 1 1 . 1 1 106 106 CYS N N 106 117.427 117.427 116.473 0.954 19700 17 1 1 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.998 0.229 19700 18 1 1 . 1 1 106 106 CYS H H 106 7.210 7.210 7.985 -0.775 19700 19 1 1 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.843 0.221 19700 20 1 1 . 1 1 108 108 GLU N N 108 119.996 119.996 117.884 2.112 19700 21 1 1 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.411 0.165 19700 22 1 1 . 1 1 108 108 GLU H H 108 7.777 7.777 8.072 -0.295 19700 23 1 1 . 1 1 109 109 MET N N 109 121.587 121.587 122.587 -1.000 19700 24 1 1 . 1 1 109 109 MET HA H 109 3.879 3.879 4.280 -0.401 19700 25 1 1 . 1 1 109 109 MET H H 109 8.954 8.954 9.049 -0.095 19700 26 1 1 . 1 1 110 110 PHE N N 110 114.224 114.224 118.058 -3.834 19700 27 1 1 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.630 0.317 19700 28 1 1 . 1 1 110 110 PHE H H 110 7.943 7.943 8.245 -0.302 19700 29 1 1 . 1 1 111 111 CYS N N 111 117.718 117.718 117.794 -0.076 19700 30 1 1 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.959 -0.106 19700 31 1 1 . 1 1 111 111 CYS H H 111 8.141 8.141 7.910 0.231 19700 32 1 1 . 1 1 112 112 GLY N N 112 106.232 106.232 106.380 -0.148 19700 33 1 1 . 1 1 112 112 GLY H H 112 8.738 8.738 8.493 0.245 19700 34 1 1 . 1 1 113 113 LYS N N 113 123.354 123.354 123.685 -0.331 19700 35 1 1 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.657 -0.266 19700 36 1 1 . 1 1 113 113 LYS H H 113 7.064 7.064 7.735 -0.671 19700 37 1 1 . 1 1 114 114 PHE N N 114 117.507 117.507 120.725 -3.218 19700 38 1 1 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.113 0.231 19700 39 1 1 . 1 1 114 114 PHE H H 114 7.823 7.823 8.094 -0.271 19700 40 1 1 . 1 1 115 115 GLN N N 115 117.426 117.426 117.907 -0.481 19700 41 1 1 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.633 0.155 19700 42 1 1 . 1 1 115 115 GLN H H 115 9.044 9.044 9.136 -0.092 19700 43 1 1 . 1 1 116 116 ILE N N 116 124.941 124.941 122.743 2.198 19700 44 1 1 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.439 -0.072 19700 45 1 1 . 1 1 116 116 ILE H H 116 8.705 8.705 8.466 0.239 19700 46 1 1 . 1 1 117 117 CYS N N 117 127.674 127.674 127.631 0.043 19700 47 1 1 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.592 0.256 19700 48 1 1 . 1 1 117 117 CYS H H 117 9.103 9.103 8.866 0.237 19700 49 1 1 . 1 1 118 118 ARG N N 118 120.976 120.976 123.482 -2.506 19700 50 1 1 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.551 -0.039 19700 51 1 1 . 1 1 118 118 ARG H H 118 8.396 8.396 8.525 -0.129 19700 52 1 1 . 1 1 119 119 ASN N N 119 119.240 119.240 118.070 1.170 19700 53 1 1 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.477 0.083 19700 54 1 1 . 1 1 119 119 ASN H H 119 8.836 8.836 8.347 0.489 19700 55 1 1 . 1 1 120 120 GLY N N 120 111.230 111.230 110.978 0.252 19700 56 1 1 . 1 1 120 120 GLY H H 120 8.755 8.755 8.514 0.241 19700 57 1 1 . 1 1 121 121 GLU N N 121 119.650 119.650 120.160 -0.510 19700 58 1 1 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.682 -0.432 19700 59 1 1 . 1 1 121 121 GLU H H 121 8.158 8.158 7.648 0.510 19700 60 1 1 . 1 1 122 122 LYS N N 122 120.471 120.471 121.568 -1.097 19700 61 1 1 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.434 0.125 19700 62 1 1 . 1 1 122 122 LYS H H 122 7.622 7.622 8.493 -0.871 19700 63 1 1 . 1 1 123 123 ILE N N 123 118.223 118.223 119.621 -1.398 19700 64 1 1 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.447 0.309 19700 65 1 1 . 1 1 123 123 ILE H H 123 8.142 8.142 7.603 0.539 19700 66 1 1 . 1 1 124 124 CYS N N 124 118.872 118.872 124.676 -5.804 19700 67 1 1 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.468 0.517 19700 68 1 1 . 1 1 124 124 CYS H H 124 9.196 9.196 9.126 0.070 19700 69 1 1 . 1 1 125 125 PHE N N 125 116.458 116.458 114.518 1.940 19700 70 1 1 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.578 0.739 19700 71 1 1 . 1 1 125 125 PHE H H 125 8.958 8.958 8.759 0.199 19700 72 1 1 . 1 1 126 126 LYS N N 126 125.559 125.559 122.991 2.568 19700 73 1 1 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.912 0.239 19700 74 1 1 . 1 1 126 126 LYS H H 126 9.109 9.109 8.454 0.655 19700 75 1 1 . 1 1 127 127 LYS N N 127 124.796 124.796 124.310 0.486 19700 76 1 1 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.391 -0.174 19700 77 1 1 . 1 1 127 127 LYS H H 127 9.498 9.498 8.374 1.124 19700 78 1 1 . 1 1 128 128 LEU N N 128 126.430 126.430 120.554 5.876 19700 79 1 1 . 1 1 128 128 LEU HA H 128 4.441 4.441 4.058 0.383 19700 80 1 1 . 1 1 128 128 LEU H H 128 9.105 9.105 8.744 0.361 19700 81 1 1 . 1 1 129 129 HIS N N 129 124.315 124.315 121.092 3.223 19700 82 1 1 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.728 0.202 19700 83 1 1 . 1 1 129 129 HIS H H 129 9.123 9.123 8.697 0.426 19700 84 1 1 . 1 1 130 130 GLN N N 130 120.311 120.311 117.323 2.988 19700 85 1 1 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.355 0.029 19700 86 1 1 . 1 1 130 130 GLN H H 130 8.246 8.246 7.568 0.678 19700 87 1 1 . 1 1 131 131 ARG N N 131 123.995 123.995 120.329 3.666 19700 88 1 1 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.085 0.205 19700 89 1 1 . 1 1 131 131 ARG H H 131 8.510 8.510 8.596 -0.086 19700 90 1 1 . 1 1 132 132 ARG N N 132 121.592 121.592 120.972 0.620 19700 91 1 1 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.300 0.008 19700 92 1 1 . 1 1 132 132 ARG H H 132 8.183 8.183 8.220 -0.037 19700 93 1 1 . 1 1 133 133 ALA N N 133 124.315 124.315 125.777 -1.462 19700 94 1 1 . 1 1 133 133 ALA HA H 133 4.236 4.236 3.956 0.280 19700 95 1 1 . 1 1 133 133 ALA H H 133 8.249 8.249 8.997 -0.748 19700 96 1 1 . 1 1 134 134 LEU N N 134 119.576 119.576 118.121 1.455 19700 97 1 1 . 1 1 134 134 LEU HA H 134 4.265 4.265 3.839 0.426 19700 98 1 1 . 1 1 134 134 LEU H H 134 8.146 8.146 7.398 0.748 19700 99 1 1 . 1 1 135 135 SER N N 135 113.103 113.103 115.343 -2.240 19700 100 1 1 . 1 1 135 135 SER HA H 135 4.504 4.504 4.154 0.350 19700 101 1 1 . 1 1 135 135 SER H H 135 7.980 7.980 8.265 -0.285 19700 102 1 1 . 1 1 136 136 TRP N N 136 123.354 123.354 117.849 5.505 19700 103 1 1 . 1 1 136 136 TRP HA H 136 4.853 4.853 5.023 -0.170 19700 104 1 1 . 1 1 136 136 TRP H H 136 8.027 8.027 7.767 0.260 19700 105 1 1 . 1 1 137 137 ARG N N 137 120.614 120.614 121.478 -0.864 19700 106 1 1 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.684 -0.010 19700 107 1 1 . 1 1 137 137 ARG H H 137 7.991 7.991 8.077 -0.086 19700 108 1 1 . 1 1 138 138 TYR N N 138 119.354 119.354 121.460 -2.106 19700 109 1 1 . 1 1 138 138 TYR HA H 138 5.414 5.414 4.910 0.504 19700 110 1 1 . 1 1 138 138 TYR H H 138 9.191 9.191 8.545 0.646 19700 111 1 1 . 1 1 139 139 ILE N N 139 119.510 119.510 123.361 -3.851 19700 112 1 1 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.300 0.018 19700 113 1 1 . 1 1 139 139 ILE H H 139 9.104 9.104 9.109 -0.005 19700 114 1 1 . 1 1 140 140 ARG N N 140 125.596 125.596 126.839 -1.243 19700 115 1 1 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.065 -0.249 19700 116 1 1 . 1 1 140 140 ARG H H 140 8.393 8.393 8.025 0.368 19700 117 1 1 . 1 1 141 141 GLY N N 141 103.964 103.964 110.133 -6.169 19700 118 1 1 . 1 1 141 141 GLY H H 141 6.307 6.307 7.453 -1.146 19700 119 1 1 . 1 1 142 142 CYS N N 142 117.908 117.908 119.542 -1.634 19700 120 1 1 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.904 0.852 19700 121 1 1 . 1 1 142 142 CYS H H 142 8.184 8.184 8.635 -0.451 19700 122 1 1 . 1 1 143 143 ALA N N 143 121.268 121.268 123.291 -2.023 19700 123 1 1 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.895 -0.100 19700 124 1 1 . 1 1 143 143 ALA H H 143 9.508 9.508 8.725 0.783 19700 125 1 1 . 1 1 144 144 ASP N N 144 118.068 118.068 118.895 -0.827 19700 126 1 1 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.666 0.226 19700 127 1 1 . 1 1 144 144 ASP H H 144 9.030 9.030 8.655 0.375 19700 128 1 1 . 1 1 145 145 THR N N 145 108.476 108.476 109.925 -1.449 19700 129 1 1 . 1 1 145 145 THR HA H 145 4.422 4.422 4.394 0.028 19700 130 1 1 . 1 1 145 145 THR H H 145 7.401 7.401 7.486 -0.085 19700 131 1 1 . 1 1 146 146 CYS N N 146 123.516 123.516 123.307 0.209 19700 132 1 1 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.379 0.334 19700 133 1 1 . 1 1 146 146 CYS H H 146 8.850 8.850 8.320 0.530 19700 134 1 1 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.409 -0.153 19700 135 1 1 . 1 1 148 148 VAL N N 148 118.686 118.686 122.375 -3.689 19700 136 1 1 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.972 0.114 19700 137 1 1 . 1 1 148 148 VAL H H 148 7.857 7.857 8.185 -0.328 19700 138 1 1 . 1 1 149 149 GLY N N 149 113.423 113.423 112.000 1.423 19700 139 1 1 . 1 1 149 149 GLY H H 149 8.357 8.357 8.158 0.199 19700 140 1 1 . 1 1 150 150 LYS N N 150 121.492 121.492 121.236 0.256 19700 141 1 1 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.600 0.027 19700 142 1 1 . 1 1 150 150 LYS H H 150 8.574 8.574 8.277 0.297 19700 143 1 1 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.482 -0.140 19700 144 1 1 . 1 1 152 152 TYR N N 152 111.257 111.257 118.773 -7.516 19700 145 1 1 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.539 -0.015 19700 146 1 1 . 1 1 152 152 TYR H H 152 7.127 7.127 8.096 -0.969 19700 147 1 1 . 1 1 153 153 GLU N N 153 119.670 119.670 117.600 2.070 19700 148 1 1 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.388 0.019 19700 149 1 1 . 1 1 153 153 GLU H H 153 7.603 7.603 7.627 -0.024 19700 150 1 1 . 1 1 154 154 MET N N 154 117.748 117.748 115.968 1.780 19700 151 1 1 . 1 1 154 154 MET HA H 154 4.335 4.335 4.053 0.282 19700 152 1 1 . 1 1 154 154 MET H H 154 8.052 8.052 7.429 0.623 19700 153 1 1 . 1 1 155 155 ILE N N 155 121.057 121.057 118.923 2.134 19700 154 1 1 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.055 0.489 19700 155 1 1 . 1 1 155 155 ILE H H 155 8.393 8.393 8.239 0.154 19700 156 1 1 . 1 1 156 156 GLU N N 156 127.999 127.999 128.696 -0.697 19700 157 1 1 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.640 0.232 19700 158 1 1 . 1 1 156 156 GLU H H 156 8.994 8.994 8.232 0.762 19700 159 1 1 . 1 1 157 157 CYS N N 157 123.034 123.034 120.394 2.640 19700 160 1 1 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.623 -0.105 19700 161 1 1 . 1 1 157 157 CYS H H 157 9.029 9.029 8.578 0.451 19700 162 1 1 . 1 1 158 158 CYS N N 158 119.670 119.670 120.191 -0.521 19700 163 1 1 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.862 0.309 19700 164 1 1 . 1 1 158 158 CYS H H 158 9.344 9.344 9.138 0.206 19700 165 1 1 . 1 1 159 159 SER N N 159 114.684 114.684 116.581 -1.897 19700 166 1 1 . 1 1 159 159 SER HA H 159 5.112 5.112 4.727 0.385 19700 167 1 1 . 1 1 159 159 SER H H 159 9.064 9.064 8.663 0.401 19700 168 1 1 . 1 1 160 160 THR N N 160 111.828 111.828 114.773 -2.945 19700 169 1 1 . 1 1 160 160 THR HA H 160 4.784 4.784 4.655 0.129 19700 170 1 1 . 1 1 160 160 THR H H 160 7.626 7.626 7.579 0.047 19700 171 1 1 . 1 1 161 161 ASP N N 161 118.279 118.279 123.026 -4.747 19700 172 1 1 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.298 0.558 19700 173 1 1 . 1 1 161 161 ASP H H 161 8.332 8.332 8.493 -0.161 19700 174 1 1 . 1 1 162 162 LYS N N 162 116.091 116.091 117.443 -1.352 19700 175 1 1 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.698 -0.246 19700 176 1 1 . 1 1 162 162 LYS H H 162 9.460 9.460 8.430 1.030 19700 177 1 1 . 1 1 163 163 CYS N N 163 111.859 111.859 115.482 -3.623 19700 178 1 1 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.188 0.228 19700 179 1 1 . 1 1 163 163 CYS H H 163 7.751 7.751 8.401 -0.650 19700 180 1 1 . 1 1 164 164 ASN N N 164 122.713 122.713 117.502 5.211 19700 181 1 1 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.748 -0.064 19700 182 1 1 . 1 1 164 164 ASN H H 164 9.396 9.396 8.091 1.305 19700 183 1 2 . 1 1 101 101 LEU N N 101 128.488 128.488 122.896 5.592 19700 184 1 2 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.908 -0.186 19700 185 1 2 . 1 1 101 101 LEU H H 101 8.706 8.706 8.607 0.099 19700 186 1 2 . 1 1 102 102 THR N N 102 117.086 117.086 119.924 -2.838 19700 187 1 2 . 1 1 102 102 THR HA H 102 5.198 5.198 4.963 0.235 19700 188 1 2 . 1 1 102 102 THR H H 102 7.729 7.729 8.460 -0.731 19700 189 1 2 . 1 1 103 103 CYS N N 103 119.021 119.021 124.736 -5.715 19700 190 1 2 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.803 0.325 19700 191 1 2 . 1 1 103 103 CYS H H 103 8.514 8.514 9.401 -0.887 19700 192 1 2 . 1 1 104 104 LEU N N 104 123.028 123.028 121.718 1.310 19700 193 1 2 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.511 0.300 19700 194 1 2 . 1 1 104 104 LEU H H 104 9.147 9.147 8.398 0.749 19700 195 1 2 . 1 1 105 105 ASN N N 105 119.029 119.029 118.038 0.991 19700 196 1 2 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.884 -0.078 19700 197 1 2 . 1 1 105 105 ASN H H 105 8.611 8.611 8.741 -0.130 19700 198 1 2 . 1 1 106 106 CYS N N 106 117.427 117.427 116.287 1.140 19700 199 1 2 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.998 0.229 19700 200 1 2 . 1 1 106 106 CYS H H 106 7.210 7.210 7.977 -0.767 19700 201 1 2 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.730 0.334 19700 202 1 2 . 1 1 108 108 GLU N N 108 119.996 119.996 118.157 1.839 19700 203 1 2 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.392 0.184 19700 204 1 2 . 1 1 108 108 GLU H H 108 7.777 7.777 8.153 -0.376 19700 205 1 2 . 1 1 109 109 MET N N 109 121.587 121.587 120.497 1.090 19700 206 1 2 . 1 1 109 109 MET HA H 109 3.879 3.879 4.314 -0.435 19700 207 1 2 . 1 1 109 109 MET H H 109 8.954 8.954 8.499 0.455 19700 208 1 2 . 1 1 110 110 PHE N N 110 114.224 114.224 120.604 -6.380 19700 209 1 2 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.592 0.355 19700 210 1 2 . 1 1 110 110 PHE H H 110 7.943 7.943 8.662 -0.719 19700 211 1 2 . 1 1 111 111 CYS N N 111 117.718 117.718 116.824 0.894 19700 212 1 2 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.908 -0.055 19700 213 1 2 . 1 1 111 111 CYS H H 111 8.141 8.141 7.807 0.334 19700 214 1 2 . 1 1 112 112 GLY N N 112 106.232 106.232 108.404 -2.172 19700 215 1 2 . 1 1 112 112 GLY H H 112 8.738 8.738 8.576 0.162 19700 216 1 2 . 1 1 113 113 LYS N N 113 123.354 123.354 123.652 -0.298 19700 217 1 2 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.659 -0.268 19700 218 1 2 . 1 1 113 113 LYS H H 113 7.064 7.064 7.737 -0.673 19700 219 1 2 . 1 1 114 114 PHE N N 114 117.507 117.507 120.461 -2.954 19700 220 1 2 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.123 0.221 19700 221 1 2 . 1 1 114 114 PHE H H 114 7.823 7.823 8.095 -0.272 19700 222 1 2 . 1 1 115 115 GLN N N 115 117.426 117.426 118.196 -0.770 19700 223 1 2 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.655 0.133 19700 224 1 2 . 1 1 115 115 GLN H H 115 9.044 9.044 9.233 -0.189 19700 225 1 2 . 1 1 116 116 ILE N N 116 124.941 124.941 123.272 1.669 19700 226 1 2 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.621 -0.254 19700 227 1 2 . 1 1 116 116 ILE H H 116 8.705 8.705 8.434 0.271 19700 228 1 2 . 1 1 117 117 CYS N N 117 127.674 127.674 128.264 -0.590 19700 229 1 2 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.529 0.319 19700 230 1 2 . 1 1 117 117 CYS H H 117 9.103 9.103 8.796 0.307 19700 231 1 2 . 1 1 118 118 ARG N N 118 120.976 120.976 123.283 -2.307 19700 232 1 2 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.541 -0.029 19700 233 1 2 . 1 1 118 118 ARG H H 118 8.396 8.396 8.598 -0.202 19700 234 1 2 . 1 1 119 119 ASN N N 119 119.240 119.240 118.660 0.580 19700 235 1 2 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.473 0.087 19700 236 1 2 . 1 1 119 119 ASN H H 119 8.836 8.836 8.495 0.341 19700 237 1 2 . 1 1 120 120 GLY N N 120 111.230 111.230 108.505 2.725 19700 238 1 2 . 1 1 120 120 GLY H H 120 8.755 8.755 8.608 0.147 19700 239 1 2 . 1 1 121 121 GLU N N 121 119.650 119.650 120.086 -0.436 19700 240 1 2 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.620 -0.370 19700 241 1 2 . 1 1 121 121 GLU H H 121 8.158 8.158 7.654 0.504 19700 242 1 2 . 1 1 122 122 LYS N N 122 120.471 120.471 121.649 -1.178 19700 243 1 2 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.410 0.149 19700 244 1 2 . 1 1 122 122 LYS H H 122 7.622 7.622 8.505 -0.883 19700 245 1 2 . 1 1 123 123 ILE N N 123 118.223 118.223 119.347 -1.124 19700 246 1 2 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.451 0.305 19700 247 1 2 . 1 1 123 123 ILE H H 123 8.142 8.142 7.595 0.547 19700 248 1 2 . 1 1 124 124 CYS N N 124 118.872 118.872 124.288 -5.416 19700 249 1 2 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.475 0.510 19700 250 1 2 . 1 1 124 124 CYS H H 124 9.196 9.196 9.049 0.147 19700 251 1 2 . 1 1 125 125 PHE N N 125 116.458 116.458 114.895 1.563 19700 252 1 2 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.770 0.547 19700 253 1 2 . 1 1 125 125 PHE H H 125 8.958 8.958 8.873 0.085 19700 254 1 2 . 1 1 126 126 LYS N N 126 125.559 125.559 123.411 2.148 19700 255 1 2 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.943 0.208 19700 256 1 2 . 1 1 126 126 LYS H H 126 9.109 9.109 8.841 0.268 19700 257 1 2 . 1 1 127 127 LYS N N 127 124.796 124.796 124.511 0.285 19700 258 1 2 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.381 -0.164 19700 259 1 2 . 1 1 127 127 LYS H H 127 9.498 9.498 8.343 1.155 19700 260 1 2 . 1 1 128 128 LEU N N 128 126.430 126.430 119.934 6.496 19700 261 1 2 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.065 1.376 19700 262 1 2 . 1 1 128 128 LEU H H 128 9.105 9.105 8.393 0.712 19700 263 1 2 . 1 1 129 129 HIS N N 129 124.315 124.315 123.822 0.493 19700 264 1 2 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.489 0.441 19700 265 1 2 . 1 1 129 129 HIS H H 129 9.123 9.123 8.085 1.038 19700 266 1 2 . 1 1 130 130 GLN N N 130 120.311 120.311 114.669 5.642 19700 267 1 2 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.212 0.172 19700 268 1 2 . 1 1 130 130 GLN H H 130 8.246 8.246 7.649 0.597 19700 269 1 2 . 1 1 131 131 ARG N N 131 123.995 123.995 121.993 2.002 19700 270 1 2 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.062 0.228 19700 271 1 2 . 1 1 131 131 ARG H H 131 8.510 8.510 8.594 -0.084 19700 272 1 2 . 1 1 132 132 ARG N N 132 121.592 121.592 117.790 3.802 19700 273 1 2 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.257 0.051 19700 274 1 2 . 1 1 132 132 ARG H H 132 8.183 8.183 7.852 0.331 19700 275 1 2 . 1 1 133 133 ALA N N 133 124.315 124.315 121.735 2.580 19700 276 1 2 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.446 -0.210 19700 277 1 2 . 1 1 133 133 ALA H H 133 8.249 8.249 8.404 -0.155 19700 278 1 2 . 1 1 134 134 LEU N N 134 119.576 119.576 117.888 1.688 19700 279 1 2 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.260 0.005 19700 280 1 2 . 1 1 134 134 LEU H H 134 8.146 8.146 8.374 -0.228 19700 281 1 2 . 1 1 135 135 SER N N 135 113.103 113.103 111.475 1.628 19700 282 1 2 . 1 1 135 135 SER HA H 135 4.504 4.504 4.642 -0.138 19700 283 1 2 . 1 1 135 135 SER H H 135 7.980 7.980 8.074 -0.094 19700 284 1 2 . 1 1 136 136 TRP N N 136 123.354 123.354 123.439 -0.085 19700 285 1 2 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.451 0.402 19700 286 1 2 . 1 1 136 136 TRP H H 136 8.027 8.027 8.050 -0.023 19700 287 1 2 . 1 1 137 137 ARG N N 137 120.614 120.614 117.437 3.177 19700 288 1 2 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.289 0.385 19700 289 1 2 . 1 1 137 137 ARG H H 137 7.991 7.991 7.850 0.141 19700 290 1 2 . 1 1 138 138 TYR N N 138 119.354 119.354 116.239 3.115 19700 291 1 2 . 1 1 138 138 TYR HA H 138 5.414 5.414 4.785 0.629 19700 292 1 2 . 1 1 138 138 TYR H H 138 9.191 9.191 8.388 0.803 19700 293 1 2 . 1 1 139 139 ILE N N 139 119.510 119.510 122.186 -2.676 19700 294 1 2 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.362 -0.044 19700 295 1 2 . 1 1 139 139 ILE H H 139 9.104 9.104 8.980 0.124 19700 296 1 2 . 1 1 140 140 ARG N N 140 125.596 125.596 126.268 -0.672 19700 297 1 2 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.076 -0.260 19700 298 1 2 . 1 1 140 140 ARG H H 140 8.393 8.393 8.320 0.073 19700 299 1 2 . 1 1 141 141 GLY N N 141 103.964 103.964 108.587 -4.623 19700 300 1 2 . 1 1 141 141 GLY H H 141 6.307 6.307 7.379 -1.072 19700 301 1 2 . 1 1 142 142 CYS N N 142 117.908 117.908 118.824 -0.916 19700 302 1 2 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.995 0.761 19700 303 1 2 . 1 1 142 142 CYS H H 142 8.184 8.184 8.535 -0.351 19700 304 1 2 . 1 1 143 143 ALA N N 143 121.268 121.268 122.883 -1.615 19700 305 1 2 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.738 0.057 19700 306 1 2 . 1 1 143 143 ALA H H 143 9.508 9.508 8.811 0.697 19700 307 1 2 . 1 1 144 144 ASP N N 144 118.068 118.068 117.203 0.865 19700 308 1 2 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.700 0.192 19700 309 1 2 . 1 1 144 144 ASP H H 144 9.030 9.030 8.611 0.419 19700 310 1 2 . 1 1 145 145 THR N N 145 108.476 108.476 109.507 -1.031 19700 311 1 2 . 1 1 145 145 THR HA H 145 4.422 4.422 4.284 0.138 19700 312 1 2 . 1 1 145 145 THR H H 145 7.401 7.401 7.545 -0.144 19700 313 1 2 . 1 1 146 146 CYS N N 146 123.516 123.516 122.669 0.847 19700 314 1 2 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.328 0.385 19700 315 1 2 . 1 1 146 146 CYS H H 146 8.850 8.850 8.480 0.370 19700 316 1 2 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.413 -0.157 19700 317 1 2 . 1 1 148 148 VAL N N 148 118.686 118.686 122.499 -3.813 19700 318 1 2 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.939 0.147 19700 319 1 2 . 1 1 148 148 VAL H H 148 7.857 7.857 8.207 -0.350 19700 320 1 2 . 1 1 149 149 GLY N N 149 113.423 113.423 112.570 0.853 19700 321 1 2 . 1 1 149 149 GLY H H 149 8.357 8.357 8.174 0.183 19700 322 1 2 . 1 1 150 150 LYS N N 150 121.492 121.492 121.421 0.071 19700 323 1 2 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.606 0.021 19700 324 1 2 . 1 1 150 150 LYS H H 150 8.574 8.574 8.416 0.158 19700 325 1 2 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.398 -0.056 19700 326 1 2 . 1 1 152 152 TYR N N 152 111.257 111.257 118.409 -7.152 19700 327 1 2 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.548 -0.024 19700 328 1 2 . 1 1 152 152 TYR H H 152 7.127 7.127 7.764 -0.637 19700 329 1 2 . 1 1 153 153 GLU N N 153 119.670 119.670 117.252 2.418 19700 330 1 2 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.257 0.150 19700 331 1 2 . 1 1 153 153 GLU H H 153 7.603 7.603 7.684 -0.081 19700 332 1 2 . 1 1 154 154 MET N N 154 117.748 117.748 115.767 1.981 19700 333 1 2 . 1 1 154 154 MET HA H 154 4.335 4.335 4.057 0.278 19700 334 1 2 . 1 1 154 154 MET H H 154 8.052 8.052 7.401 0.651 19700 335 1 2 . 1 1 155 155 ILE N N 155 121.057 121.057 119.296 1.761 19700 336 1 2 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.011 0.533 19700 337 1 2 . 1 1 155 155 ILE H H 155 8.393 8.393 8.256 0.137 19700 338 1 2 . 1 1 156 156 GLU N N 156 127.999 127.999 129.459 -1.460 19700 339 1 2 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.597 0.275 19700 340 1 2 . 1 1 156 156 GLU H H 156 8.994 8.994 8.079 0.915 19700 341 1 2 . 1 1 157 157 CYS N N 157 123.034 123.034 121.841 1.193 19700 342 1 2 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.625 -0.107 19700 343 1 2 . 1 1 157 157 CYS H H 157 9.029 9.029 8.566 0.463 19700 344 1 2 . 1 1 158 158 CYS N N 158 119.670 119.670 119.833 -0.163 19700 345 1 2 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.728 0.443 19700 346 1 2 . 1 1 158 158 CYS H H 158 9.344 9.344 8.939 0.405 19700 347 1 2 . 1 1 159 159 SER N N 159 114.684 114.684 115.673 -0.989 19700 348 1 2 . 1 1 159 159 SER HA H 159 5.112 5.112 4.820 0.292 19700 349 1 2 . 1 1 159 159 SER H H 159 9.064 9.064 8.534 0.530 19700 350 1 2 . 1 1 160 160 THR N N 160 111.828 111.828 112.607 -0.779 19700 351 1 2 . 1 1 160 160 THR HA H 160 4.784 4.784 4.528 0.256 19700 352 1 2 . 1 1 160 160 THR H H 160 7.626 7.626 7.441 0.185 19700 353 1 2 . 1 1 161 161 ASP N N 161 118.279 118.279 123.212 -4.933 19700 354 1 2 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.312 0.544 19700 355 1 2 . 1 1 161 161 ASP H H 161 8.332 8.332 8.537 -0.205 19700 356 1 2 . 1 1 162 162 LYS N N 162 116.091 116.091 117.040 -0.949 19700 357 1 2 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.684 -0.232 19700 358 1 2 . 1 1 162 162 LYS H H 162 9.460 9.460 8.433 1.027 19700 359 1 2 . 1 1 163 163 CYS N N 163 111.859 111.859 115.671 -3.812 19700 360 1 2 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.193 0.223 19700 361 1 2 . 1 1 163 163 CYS H H 163 7.751 7.751 8.438 -0.687 19700 362 1 2 . 1 1 164 164 ASN N N 164 122.713 122.713 117.560 5.153 19700 363 1 2 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.585 0.099 19700 364 1 2 . 1 1 164 164 ASN H H 164 9.396 9.396 8.165 1.231 19700 365 1 3 . 1 1 101 101 LEU N N 101 128.488 128.488 122.747 5.741 19700 366 1 3 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.897 -0.175 19700 367 1 3 . 1 1 101 101 LEU H H 101 8.706 8.706 8.437 0.269 19700 368 1 3 . 1 1 102 102 THR N N 102 117.086 117.086 120.087 -3.001 19700 369 1 3 . 1 1 102 102 THR HA H 102 5.198 5.198 4.944 0.254 19700 370 1 3 . 1 1 102 102 THR H H 102 7.729 7.729 8.315 -0.586 19700 371 1 3 . 1 1 103 103 CYS N N 103 119.021 119.021 124.494 -5.473 19700 372 1 3 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.803 0.325 19700 373 1 3 . 1 1 103 103 CYS H H 103 8.514 8.514 9.269 -0.755 19700 374 1 3 . 1 1 104 104 LEU N N 104 123.028 123.028 121.845 1.183 19700 375 1 3 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.595 0.216 19700 376 1 3 . 1 1 104 104 LEU H H 104 9.147 9.147 8.448 0.699 19700 377 1 3 . 1 1 105 105 ASN N N 105 119.029 119.029 115.731 3.298 19700 378 1 3 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.090 -0.284 19700 379 1 3 . 1 1 105 105 ASN H H 105 8.611 8.611 8.637 -0.026 19700 380 1 3 . 1 1 106 106 CYS N N 106 117.427 117.427 116.509 0.918 19700 381 1 3 . 1 1 106 106 CYS HA H 106 5.227 5.227 5.018 0.209 19700 382 1 3 . 1 1 106 106 CYS H H 106 7.210 7.210 7.966 -0.756 19700 383 1 3 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.704 0.360 19700 384 1 3 . 1 1 108 108 GLU N N 108 119.996 119.996 117.703 2.293 19700 385 1 3 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.590 -0.014 19700 386 1 3 . 1 1 108 108 GLU H H 108 7.777 7.777 8.260 -0.483 19700 387 1 3 . 1 1 109 109 MET N N 109 121.587 121.587 120.045 1.542 19700 388 1 3 . 1 1 109 109 MET HA H 109 3.879 3.879 4.236 -0.357 19700 389 1 3 . 1 1 109 109 MET H H 109 8.954 8.954 8.548 0.406 19700 390 1 3 . 1 1 110 110 PHE N N 110 114.224 114.224 119.160 -4.936 19700 391 1 3 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.525 0.422 19700 392 1 3 . 1 1 110 110 PHE H H 110 7.943 7.943 8.337 -0.394 19700 393 1 3 . 1 1 111 111 CYS N N 111 117.718 117.718 117.241 0.477 19700 394 1 3 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.809 0.044 19700 395 1 3 . 1 1 111 111 CYS H H 111 8.141 8.141 7.631 0.510 19700 396 1 3 . 1 1 112 112 GLY N N 112 106.232 106.232 108.312 -2.080 19700 397 1 3 . 1 1 112 112 GLY H H 112 8.738 8.738 8.543 0.195 19700 398 1 3 . 1 1 113 113 LYS N N 113 123.354 123.354 123.746 -0.392 19700 399 1 3 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.637 -0.246 19700 400 1 3 . 1 1 113 113 LYS H H 113 7.064 7.064 7.709 -0.645 19700 401 1 3 . 1 1 114 114 PHE N N 114 117.507 117.507 120.360 -2.853 19700 402 1 3 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.510 -0.166 19700 403 1 3 . 1 1 114 114 PHE H H 114 7.823 7.823 8.017 -0.194 19700 404 1 3 . 1 1 115 115 GLN N N 115 117.426 117.426 118.181 -0.755 19700 405 1 3 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.655 0.133 19700 406 1 3 . 1 1 115 115 GLN H H 115 9.044 9.044 9.186 -0.142 19700 407 1 3 . 1 1 116 116 ILE N N 116 124.941 124.941 123.232 1.709 19700 408 1 3 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.548 -0.181 19700 409 1 3 . 1 1 116 116 ILE H H 116 8.705 8.705 8.440 0.265 19700 410 1 3 . 1 1 117 117 CYS N N 117 127.674 127.674 127.610 0.064 19700 411 1 3 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.590 0.258 19700 412 1 3 . 1 1 117 117 CYS H H 117 9.103 9.103 8.967 0.136 19700 413 1 3 . 1 1 118 118 ARG N N 118 120.976 120.976 123.828 -2.852 19700 414 1 3 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.618 -0.106 19700 415 1 3 . 1 1 118 118 ARG H H 118 8.396 8.396 8.630 -0.234 19700 416 1 3 . 1 1 119 119 ASN N N 119 119.240 119.240 118.249 0.991 19700 417 1 3 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.446 0.114 19700 418 1 3 . 1 1 119 119 ASN H H 119 8.836 8.836 8.492 0.344 19700 419 1 3 . 1 1 120 120 GLY N N 120 111.230 111.230 107.862 3.368 19700 420 1 3 . 1 1 120 120 GLY H H 120 8.755 8.755 8.666 0.089 19700 421 1 3 . 1 1 121 121 GLU N N 121 119.650 119.650 119.813 -0.163 19700 422 1 3 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.673 -0.423 19700 423 1 3 . 1 1 121 121 GLU H H 121 8.158 8.158 7.661 0.497 19700 424 1 3 . 1 1 122 122 LYS N N 122 120.471 120.471 121.833 -1.362 19700 425 1 3 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.449 0.110 19700 426 1 3 . 1 1 122 122 LYS H H 122 7.622 7.622 8.498 -0.876 19700 427 1 3 . 1 1 123 123 ILE N N 123 118.223 118.223 119.170 -0.947 19700 428 1 3 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.360 0.396 19700 429 1 3 . 1 1 123 123 ILE H H 123 8.142 8.142 7.628 0.514 19700 430 1 3 . 1 1 124 124 CYS N N 124 118.872 118.872 124.049 -5.177 19700 431 1 3 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.550 0.435 19700 432 1 3 . 1 1 124 124 CYS H H 124 9.196 9.196 9.025 0.171 19700 433 1 3 . 1 1 125 125 PHE N N 125 116.458 116.458 115.207 1.251 19700 434 1 3 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.768 0.549 19700 435 1 3 . 1 1 125 125 PHE H H 125 8.958 8.958 8.676 0.282 19700 436 1 3 . 1 1 126 126 LYS N N 126 125.559 125.559 122.435 3.124 19700 437 1 3 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.960 0.191 19700 438 1 3 . 1 1 126 126 LYS H H 126 9.109 9.109 8.722 0.387 19700 439 1 3 . 1 1 127 127 LYS N N 127 124.796 124.796 126.846 -2.050 19700 440 1 3 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.599 -0.382 19700 441 1 3 . 1 1 127 127 LYS H H 127 9.498 9.498 8.295 1.203 19700 442 1 3 . 1 1 128 128 LEU N N 128 126.430 126.430 122.232 4.198 19700 443 1 3 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.573 0.868 19700 444 1 3 . 1 1 128 128 LEU H H 128 9.105 9.105 8.791 0.314 19700 445 1 3 . 1 1 129 129 HIS N N 129 124.315 124.315 121.564 2.751 19700 446 1 3 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.624 0.306 19700 447 1 3 . 1 1 129 129 HIS H H 129 9.123 9.123 8.356 0.767 19700 448 1 3 . 1 1 130 130 GLN N N 130 120.311 120.311 117.475 2.836 19700 449 1 3 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.429 -0.045 19700 450 1 3 . 1 1 130 130 GLN H H 130 8.246 8.246 7.639 0.607 19700 451 1 3 . 1 1 131 131 ARG N N 131 123.995 123.995 123.264 0.731 19700 452 1 3 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.260 0.030 19700 453 1 3 . 1 1 131 131 ARG H H 131 8.510 8.510 8.558 -0.048 19700 454 1 3 . 1 1 132 132 ARG N N 132 121.592 121.592 119.602 1.990 19700 455 1 3 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.440 -0.132 19700 456 1 3 . 1 1 132 132 ARG H H 132 8.183 8.183 8.269 -0.086 19700 457 1 3 . 1 1 133 133 ALA N N 133 124.315 124.315 122.943 1.372 19700 458 1 3 . 1 1 133 133 ALA HA H 133 4.236 4.236 3.964 0.272 19700 459 1 3 . 1 1 133 133 ALA H H 133 8.249 8.249 8.641 -0.392 19700 460 1 3 . 1 1 134 134 LEU N N 134 119.576 119.576 116.542 3.034 19700 461 1 3 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.034 0.231 19700 462 1 3 . 1 1 134 134 LEU H H 134 8.146 8.146 7.629 0.517 19700 463 1 3 . 1 1 135 135 SER N N 135 113.103 113.103 111.258 1.845 19700 464 1 3 . 1 1 135 135 SER HA H 135 4.504 4.504 3.714 0.790 19700 465 1 3 . 1 1 135 135 SER H H 135 7.980 7.980 8.028 -0.048 19700 466 1 3 . 1 1 136 136 TRP N N 136 123.354 123.354 116.170 7.184 19700 467 1 3 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.398 0.455 19700 468 1 3 . 1 1 136 136 TRP H H 136 8.027 8.027 8.140 -0.113 19700 469 1 3 . 1 1 137 137 ARG N N 137 120.614 120.614 121.211 -0.597 19700 470 1 3 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.854 -0.180 19700 471 1 3 . 1 1 137 137 ARG H H 137 7.991 7.991 8.311 -0.320 19700 472 1 3 . 1 1 138 138 TYR N N 138 119.354 119.354 122.932 -3.578 19700 473 1 3 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.103 0.311 19700 474 1 3 . 1 1 138 138 TYR H H 138 9.191 9.191 8.905 0.286 19700 475 1 3 . 1 1 139 139 ILE N N 139 119.510 119.510 121.488 -1.978 19700 476 1 3 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.460 -0.142 19700 477 1 3 . 1 1 139 139 ILE H H 139 9.104 9.104 9.103 0.001 19700 478 1 3 . 1 1 140 140 ARG N N 140 125.596 125.596 125.856 -0.260 19700 479 1 3 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.089 -0.273 19700 480 1 3 . 1 1 140 140 ARG H H 140 8.393 8.393 8.652 -0.259 19700 481 1 3 . 1 1 141 141 GLY N N 141 103.964 103.964 109.761 -5.797 19700 482 1 3 . 1 1 141 141 GLY H H 141 6.307 6.307 7.546 -1.239 19700 483 1 3 . 1 1 142 142 CYS N N 142 117.908 117.908 119.532 -1.624 19700 484 1 3 . 1 1 142 142 CYS HA H 142 5.756 5.756 5.025 0.731 19700 485 1 3 . 1 1 142 142 CYS H H 142 8.184 8.184 8.601 -0.417 19700 486 1 3 . 1 1 143 143 ALA N N 143 121.268 121.268 124.231 -2.963 19700 487 1 3 . 1 1 143 143 ALA HA H 143 4.795 4.795 5.047 -0.252 19700 488 1 3 . 1 1 143 143 ALA H H 143 9.508 9.508 8.842 0.666 19700 489 1 3 . 1 1 144 144 ASP N N 144 118.068 118.068 118.034 0.034 19700 490 1 3 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.618 0.274 19700 491 1 3 . 1 1 144 144 ASP H H 144 9.030 9.030 8.946 0.084 19700 492 1 3 . 1 1 145 145 THR N N 145 108.476 108.476 109.112 -0.636 19700 493 1 3 . 1 1 145 145 THR HA H 145 4.422 4.422 4.354 0.068 19700 494 1 3 . 1 1 145 145 THR H H 145 7.401 7.401 7.376 0.025 19700 495 1 3 . 1 1 146 146 CYS N N 146 123.516 123.516 122.843 0.673 19700 496 1 3 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.458 0.255 19700 497 1 3 . 1 1 146 146 CYS H H 146 8.850 8.850 8.563 0.287 19700 498 1 3 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.368 -0.112 19700 499 1 3 . 1 1 148 148 VAL N N 148 118.686 118.686 121.527 -2.841 19700 500 1 3 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.066 0.020 19700 501 1 3 . 1 1 148 148 VAL H H 148 7.857 7.857 8.102 -0.245 19700 502 1 3 . 1 1 149 149 GLY N N 149 113.423 113.423 111.263 2.160 19700 503 1 3 . 1 1 149 149 GLY H H 149 8.357 8.357 7.785 0.572 19700 504 1 3 . 1 1 150 150 LYS N N 150 121.492 121.492 121.084 0.408 19700 505 1 3 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.516 0.111 19700 506 1 3 . 1 1 150 150 LYS H H 150 8.574 8.574 8.219 0.355 19700 507 1 3 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.442 -0.100 19700 508 1 3 . 1 1 152 152 TYR N N 152 111.257 111.257 118.469 -7.212 19700 509 1 3 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.528 -0.004 19700 510 1 3 . 1 1 152 152 TYR H H 152 7.127 7.127 7.862 -0.735 19700 511 1 3 . 1 1 153 153 GLU N N 153 119.670 119.670 118.108 1.562 19700 512 1 3 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.326 0.081 19700 513 1 3 . 1 1 153 153 GLU H H 153 7.603 7.603 7.628 -0.025 19700 514 1 3 . 1 1 154 154 MET N N 154 117.748 117.748 116.974 0.774 19700 515 1 3 . 1 1 154 154 MET HA H 154 4.335 4.335 4.114 0.221 19700 516 1 3 . 1 1 154 154 MET H H 154 8.052 8.052 7.437 0.615 19700 517 1 3 . 1 1 155 155 ILE N N 155 121.057 121.057 119.522 1.535 19700 518 1 3 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.512 0.032 19700 519 1 3 . 1 1 155 155 ILE H H 155 8.393 8.393 8.208 0.185 19700 520 1 3 . 1 1 156 156 GLU N N 156 127.999 127.999 128.983 -0.984 19700 521 1 3 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.689 0.183 19700 522 1 3 . 1 1 156 156 GLU H H 156 8.994 8.994 8.414 0.580 19700 523 1 3 . 1 1 157 157 CYS N N 157 123.034 123.034 121.622 1.412 19700 524 1 3 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.634 -0.116 19700 525 1 3 . 1 1 157 157 CYS H H 157 9.029 9.029 8.614 0.415 19700 526 1 3 . 1 1 158 158 CYS N N 158 119.670 119.670 119.989 -0.319 19700 527 1 3 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.832 0.339 19700 528 1 3 . 1 1 158 158 CYS H H 158 9.344 9.344 9.141 0.203 19700 529 1 3 . 1 1 159 159 SER N N 159 114.684 114.684 117.710 -3.026 19700 530 1 3 . 1 1 159 159 SER HA H 159 5.112 5.112 4.783 0.329 19700 531 1 3 . 1 1 159 159 SER H H 159 9.064 9.064 8.628 0.436 19700 532 1 3 . 1 1 160 160 THR N N 160 111.828 111.828 113.268 -1.440 19700 533 1 3 . 1 1 160 160 THR HA H 160 4.784 4.784 4.547 0.237 19700 534 1 3 . 1 1 160 160 THR H H 160 7.626 7.626 7.338 0.288 19700 535 1 3 . 1 1 161 161 ASP N N 161 118.279 118.279 123.330 -5.051 19700 536 1 3 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.353 0.503 19700 537 1 3 . 1 1 161 161 ASP H H 161 8.332 8.332 8.573 -0.241 19700 538 1 3 . 1 1 162 162 LYS N N 162 116.091 116.091 118.440 -2.349 19700 539 1 3 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.675 -0.223 19700 540 1 3 . 1 1 162 162 LYS H H 162 9.460 9.460 8.283 1.177 19700 541 1 3 . 1 1 163 163 CYS N N 163 111.859 111.859 114.715 -2.856 19700 542 1 3 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.130 0.286 19700 543 1 3 . 1 1 163 163 CYS H H 163 7.751 7.751 8.361 -0.610 19700 544 1 3 . 1 1 164 164 ASN N N 164 122.713 122.713 117.123 5.590 19700 545 1 3 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.799 -0.115 19700 546 1 3 . 1 1 164 164 ASN H H 164 9.396 9.396 8.010 1.386 19700 547 1 4 . 1 1 101 101 LEU N N 101 128.488 128.488 123.038 5.450 19700 548 1 4 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.926 -0.204 19700 549 1 4 . 1 1 101 101 LEU H H 101 8.706 8.706 8.608 0.098 19700 550 1 4 . 1 1 102 102 THR N N 102 117.086 117.086 120.271 -3.185 19700 551 1 4 . 1 1 102 102 THR HA H 102 5.198 5.198 4.996 0.202 19700 552 1 4 . 1 1 102 102 THR H H 102 7.729 7.729 8.334 -0.605 19700 553 1 4 . 1 1 103 103 CYS N N 103 119.021 119.021 124.311 -5.290 19700 554 1 4 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.797 0.331 19700 555 1 4 . 1 1 103 103 CYS H H 103 8.514 8.514 9.203 -0.689 19700 556 1 4 . 1 1 104 104 LEU N N 104 123.028 123.028 121.618 1.410 19700 557 1 4 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.637 0.174 19700 558 1 4 . 1 1 104 104 LEU H H 104 9.147 9.147 8.382 0.765 19700 559 1 4 . 1 1 105 105 ASN N N 105 119.029 119.029 119.113 -0.084 19700 560 1 4 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.897 -0.091 19700 561 1 4 . 1 1 105 105 ASN H H 105 8.611 8.611 8.661 -0.050 19700 562 1 4 . 1 1 106 106 CYS N N 106 117.427 117.427 116.382 1.045 19700 563 1 4 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.893 0.334 19700 564 1 4 . 1 1 106 106 CYS H H 106 7.210 7.210 7.891 -0.681 19700 565 1 4 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.742 0.322 19700 566 1 4 . 1 1 108 108 GLU N N 108 119.996 119.996 118.194 1.802 19700 567 1 4 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.319 0.257 19700 568 1 4 . 1 1 108 108 GLU H H 108 7.777 7.777 8.325 -0.548 19700 569 1 4 . 1 1 109 109 MET N N 109 121.587 121.587 121.372 0.215 19700 570 1 4 . 1 1 109 109 MET HA H 109 3.879 3.879 4.209 -0.330 19700 571 1 4 . 1 1 109 109 MET H H 109 8.954 8.954 8.720 0.234 19700 572 1 4 . 1 1 110 110 PHE N N 110 114.224 114.224 120.311 -6.087 19700 573 1 4 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.573 0.374 19700 574 1 4 . 1 1 110 110 PHE H H 110 7.943 7.943 8.341 -0.398 19700 575 1 4 . 1 1 111 111 CYS N N 111 117.718 117.718 118.042 -0.324 19700 576 1 4 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.883 -0.030 19700 577 1 4 . 1 1 111 111 CYS H H 111 8.141 8.141 7.850 0.291 19700 578 1 4 . 1 1 112 112 GLY N N 112 106.232 106.232 105.776 0.456 19700 579 1 4 . 1 1 112 112 GLY H H 112 8.738 8.738 8.514 0.224 19700 580 1 4 . 1 1 113 113 LYS N N 113 123.354 123.354 123.662 -0.308 19700 581 1 4 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.658 -0.267 19700 582 1 4 . 1 1 113 113 LYS H H 113 7.064 7.064 7.748 -0.684 19700 583 1 4 . 1 1 114 114 PHE N N 114 117.507 117.507 120.585 -3.078 19700 584 1 4 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.249 0.095 19700 585 1 4 . 1 1 114 114 PHE H H 114 7.823 7.823 8.139 -0.316 19700 586 1 4 . 1 1 115 115 GLN N N 115 117.426 117.426 118.206 -0.780 19700 587 1 4 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.645 0.143 19700 588 1 4 . 1 1 115 115 GLN H H 115 9.044 9.044 9.141 -0.097 19700 589 1 4 . 1 1 116 116 ILE N N 116 124.941 124.941 123.152 1.789 19700 590 1 4 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.521 -0.154 19700 591 1 4 . 1 1 116 116 ILE H H 116 8.705 8.705 8.426 0.279 19700 592 1 4 . 1 1 117 117 CYS N N 117 127.674 127.674 127.695 -0.021 19700 593 1 4 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.592 0.256 19700 594 1 4 . 1 1 117 117 CYS H H 117 9.103 9.103 9.080 0.023 19700 595 1 4 . 1 1 118 118 ARG N N 118 120.976 120.976 123.956 -2.980 19700 596 1 4 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.605 -0.093 19700 597 1 4 . 1 1 118 118 ARG H H 118 8.396 8.396 8.634 -0.238 19700 598 1 4 . 1 1 119 119 ASN N N 119 119.240 119.240 118.378 0.862 19700 599 1 4 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.464 0.096 19700 600 1 4 . 1 1 119 119 ASN H H 119 8.836 8.836 8.480 0.356 19700 601 1 4 . 1 1 120 120 GLY N N 120 111.230 111.230 107.714 3.516 19700 602 1 4 . 1 1 120 120 GLY H H 120 8.755 8.755 8.648 0.107 19700 603 1 4 . 1 1 121 121 GLU N N 121 119.650 119.650 120.081 -0.431 19700 604 1 4 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.702 -0.452 19700 605 1 4 . 1 1 121 121 GLU H H 121 8.158 8.158 7.632 0.526 19700 606 1 4 . 1 1 122 122 LYS N N 122 120.471 120.471 121.225 -0.754 19700 607 1 4 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.502 0.057 19700 608 1 4 . 1 1 122 122 LYS H H 122 7.622 7.622 8.656 -1.034 19700 609 1 4 . 1 1 123 123 ILE N N 123 118.223 118.223 113.989 4.234 19700 610 1 4 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.633 0.123 19700 611 1 4 . 1 1 123 123 ILE H H 123 8.142 8.142 7.738 0.404 19700 612 1 4 . 1 1 124 124 CYS N N 124 118.872 118.872 119.946 -1.074 19700 613 1 4 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.536 0.449 19700 614 1 4 . 1 1 124 124 CYS H H 124 9.196 9.196 8.819 0.377 19700 615 1 4 . 1 1 125 125 PHE N N 125 116.458 116.458 114.983 1.475 19700 616 1 4 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.713 0.604 19700 617 1 4 . 1 1 125 125 PHE H H 125 8.958 8.958 8.776 0.182 19700 618 1 4 . 1 1 126 126 LYS N N 126 125.559 125.559 122.101 3.458 19700 619 1 4 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.961 0.190 19700 620 1 4 . 1 1 126 126 LYS H H 126 9.109 9.109 8.695 0.414 19700 621 1 4 . 1 1 127 127 LYS N N 127 124.796 124.796 126.668 -1.872 19700 622 1 4 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.097 0.120 19700 623 1 4 . 1 1 127 127 LYS H H 127 9.498 9.498 8.403 1.095 19700 624 1 4 . 1 1 128 128 LEU N N 128 126.430 126.430 122.374 4.056 19700 625 1 4 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.578 0.863 19700 626 1 4 . 1 1 128 128 LEU H H 128 9.105 9.105 8.465 0.640 19700 627 1 4 . 1 1 129 129 HIS N N 129 124.315 124.315 125.549 -1.234 19700 628 1 4 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.523 0.407 19700 629 1 4 . 1 1 129 129 HIS H H 129 9.123 9.123 8.052 1.071 19700 630 1 4 . 1 1 130 130 GLN N N 130 120.311 120.311 115.722 4.589 19700 631 1 4 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.499 -0.115 19700 632 1 4 . 1 1 130 130 GLN H H 130 8.246 8.246 7.729 0.517 19700 633 1 4 . 1 1 131 131 ARG N N 131 123.995 123.995 124.161 -0.166 19700 634 1 4 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.344 -0.054 19700 635 1 4 . 1 1 131 131 ARG H H 131 8.510 8.510 8.797 -0.287 19700 636 1 4 . 1 1 132 132 ARG N N 132 121.592 121.592 118.725 2.867 19700 637 1 4 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.436 -0.128 19700 638 1 4 . 1 1 132 132 ARG H H 132 8.183 8.183 7.936 0.247 19700 639 1 4 . 1 1 133 133 ALA N N 133 124.315 124.315 123.396 0.919 19700 640 1 4 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.419 -0.183 19700 641 1 4 . 1 1 133 133 ALA H H 133 8.249 8.249 7.586 0.663 19700 642 1 4 . 1 1 134 134 LEU N N 134 119.576 119.576 117.272 2.304 19700 643 1 4 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.258 0.007 19700 644 1 4 . 1 1 134 134 LEU H H 134 8.146 8.146 8.697 -0.551 19700 645 1 4 . 1 1 135 135 SER N N 135 113.103 113.103 112.674 0.429 19700 646 1 4 . 1 1 135 135 SER HA H 135 4.504 4.504 4.656 -0.152 19700 647 1 4 . 1 1 135 135 SER H H 135 7.980 7.980 7.568 0.412 19700 648 1 4 . 1 1 136 136 TRP N N 136 123.354 123.354 121.011 2.343 19700 649 1 4 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.550 0.303 19700 650 1 4 . 1 1 136 136 TRP H H 136 8.027 8.027 8.708 -0.681 19700 651 1 4 . 1 1 137 137 ARG N N 137 120.614 120.614 121.184 -0.570 19700 652 1 4 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.910 -0.236 19700 653 1 4 . 1 1 137 137 ARG H H 137 7.991 7.991 8.757 -0.766 19700 654 1 4 . 1 1 138 138 TYR N N 138 119.354 119.354 120.822 -1.468 19700 655 1 4 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.028 0.386 19700 656 1 4 . 1 1 138 138 TYR H H 138 9.191 9.191 8.520 0.671 19700 657 1 4 . 1 1 139 139 ILE N N 139 119.510 119.510 123.219 -3.709 19700 658 1 4 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.417 -0.099 19700 659 1 4 . 1 1 139 139 ILE H H 139 9.104 9.104 9.093 0.011 19700 660 1 4 . 1 1 140 140 ARG N N 140 125.596 125.596 125.859 -0.263 19700 661 1 4 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.086 -0.270 19700 662 1 4 . 1 1 140 140 ARG H H 140 8.393 8.393 8.103 0.290 19700 663 1 4 . 1 1 141 141 GLY N N 141 103.964 103.964 109.895 -5.931 19700 664 1 4 . 1 1 141 141 GLY H H 141 6.307 6.307 7.538 -1.231 19700 665 1 4 . 1 1 142 142 CYS N N 142 117.908 117.908 119.529 -1.621 19700 666 1 4 . 1 1 142 142 CYS HA H 142 5.756 5.756 5.046 0.710 19700 667 1 4 . 1 1 142 142 CYS H H 142 8.184 8.184 8.612 -0.428 19700 668 1 4 . 1 1 143 143 ALA N N 143 121.268 121.268 123.921 -2.653 19700 669 1 4 . 1 1 143 143 ALA HA H 143 4.795 4.795 5.021 -0.226 19700 670 1 4 . 1 1 143 143 ALA H H 143 9.508 9.508 8.875 0.633 19700 671 1 4 . 1 1 144 144 ASP N N 144 118.068 118.068 118.466 -0.398 19700 672 1 4 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.670 0.222 19700 673 1 4 . 1 1 144 144 ASP H H 144 9.030 9.030 8.674 0.356 19700 674 1 4 . 1 1 145 145 THR N N 145 108.476 108.476 109.369 -0.893 19700 675 1 4 . 1 1 145 145 THR HA H 145 4.422 4.422 4.283 0.139 19700 676 1 4 . 1 1 145 145 THR H H 145 7.401 7.401 7.560 -0.159 19700 677 1 4 . 1 1 146 146 CYS N N 146 123.516 123.516 122.602 0.914 19700 678 1 4 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.314 0.399 19700 679 1 4 . 1 1 146 146 CYS H H 146 8.850 8.850 8.464 0.386 19700 680 1 4 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.401 -0.145 19700 681 1 4 . 1 1 148 148 VAL N N 148 118.686 118.686 121.944 -3.258 19700 682 1 4 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.886 0.200 19700 683 1 4 . 1 1 148 148 VAL H H 148 7.857 7.857 8.160 -0.303 19700 684 1 4 . 1 1 149 149 GLY N N 149 113.423 113.423 114.095 -0.672 19700 685 1 4 . 1 1 149 149 GLY H H 149 8.357 8.357 8.286 0.071 19700 686 1 4 . 1 1 150 150 LYS N N 150 121.492 121.492 121.741 -0.249 19700 687 1 4 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.833 -0.206 19700 688 1 4 . 1 1 150 150 LYS H H 150 8.574 8.574 8.339 0.235 19700 689 1 4 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.472 -0.130 19700 690 1 4 . 1 1 152 152 TYR N N 152 111.257 111.257 118.669 -7.412 19700 691 1 4 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.596 -0.072 19700 692 1 4 . 1 1 152 152 TYR H H 152 7.127 7.127 8.353 -1.226 19700 693 1 4 . 1 1 153 153 GLU N N 153 119.670 119.670 119.177 0.493 19700 694 1 4 . 1 1 153 153 GLU HA H 153 4.407 4.407 3.941 0.466 19700 695 1 4 . 1 1 153 153 GLU H H 153 7.603 7.603 7.852 -0.249 19700 696 1 4 . 1 1 154 154 MET N N 154 117.748 117.748 116.273 1.475 19700 697 1 4 . 1 1 154 154 MET HA H 154 4.335 4.335 3.995 0.340 19700 698 1 4 . 1 1 154 154 MET H H 154 8.052 8.052 7.346 0.706 19700 699 1 4 . 1 1 155 155 ILE N N 155 121.057 121.057 118.603 2.454 19700 700 1 4 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.168 0.376 19700 701 1 4 . 1 1 155 155 ILE H H 155 8.393 8.393 8.226 0.167 19700 702 1 4 . 1 1 156 156 GLU N N 156 127.999 127.999 128.918 -0.919 19700 703 1 4 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.507 0.365 19700 704 1 4 . 1 1 156 156 GLU H H 156 8.994 8.994 8.314 0.680 19700 705 1 4 . 1 1 157 157 CYS N N 157 123.034 123.034 121.596 1.438 19700 706 1 4 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.638 -0.120 19700 707 1 4 . 1 1 157 157 CYS H H 157 9.029 9.029 8.553 0.476 19700 708 1 4 . 1 1 158 158 CYS N N 158 119.670 119.670 119.680 -0.010 19700 709 1 4 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.957 0.214 19700 710 1 4 . 1 1 158 158 CYS H H 158 9.344 9.344 9.099 0.245 19700 711 1 4 . 1 1 159 159 SER N N 159 114.684 114.684 116.060 -1.376 19700 712 1 4 . 1 1 159 159 SER HA H 159 5.112 5.112 4.762 0.350 19700 713 1 4 . 1 1 159 159 SER H H 159 9.064 9.064 8.503 0.561 19700 714 1 4 . 1 1 160 160 THR N N 160 111.828 111.828 112.359 -0.531 19700 715 1 4 . 1 1 160 160 THR HA H 160 4.784 4.784 4.506 0.278 19700 716 1 4 . 1 1 160 160 THR H H 160 7.626 7.626 7.466 0.160 19700 717 1 4 . 1 1 161 161 ASP N N 161 118.279 118.279 123.323 -5.044 19700 718 1 4 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.397 0.459 19700 719 1 4 . 1 1 161 161 ASP H H 161 8.332 8.332 8.538 -0.206 19700 720 1 4 . 1 1 162 162 LYS N N 162 116.091 116.091 118.193 -2.102 19700 721 1 4 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.739 -0.287 19700 722 1 4 . 1 1 162 162 LYS H H 162 9.460 9.460 8.378 1.082 19700 723 1 4 . 1 1 163 163 CYS N N 163 111.859 111.859 115.299 -3.440 19700 724 1 4 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.227 0.189 19700 725 1 4 . 1 1 163 163 CYS H H 163 7.751 7.751 8.475 -0.724 19700 726 1 4 . 1 1 164 164 ASN N N 164 122.713 122.713 116.899 5.814 19700 727 1 4 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.814 -0.130 19700 728 1 4 . 1 1 164 164 ASN H H 164 9.396 9.396 8.223 1.173 19700 729 1 5 . 1 1 101 101 LEU N N 101 128.488 128.488 122.602 5.886 19700 730 1 5 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.911 -0.189 19700 731 1 5 . 1 1 101 101 LEU H H 101 8.706 8.706 8.415 0.291 19700 732 1 5 . 1 1 102 102 THR N N 102 117.086 117.086 119.632 -2.546 19700 733 1 5 . 1 1 102 102 THR HA H 102 5.198 5.198 5.081 0.117 19700 734 1 5 . 1 1 102 102 THR H H 102 7.729 7.729 8.246 -0.517 19700 735 1 5 . 1 1 103 103 CYS N N 103 119.021 119.021 124.055 -5.034 19700 736 1 5 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.802 0.326 19700 737 1 5 . 1 1 103 103 CYS H H 103 8.514 8.514 9.185 -0.671 19700 738 1 5 . 1 1 104 104 LEU N N 104 123.028 123.028 121.813 1.215 19700 739 1 5 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.587 0.224 19700 740 1 5 . 1 1 104 104 LEU H H 104 9.147 9.147 8.304 0.843 19700 741 1 5 . 1 1 105 105 ASN N N 105 119.029 119.029 117.486 1.543 19700 742 1 5 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.974 -0.168 19700 743 1 5 . 1 1 105 105 ASN H H 105 8.611 8.611 8.729 -0.118 19700 744 1 5 . 1 1 106 106 CYS N N 106 117.427 117.427 115.655 1.772 19700 745 1 5 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.955 0.272 19700 746 1 5 . 1 1 106 106 CYS H H 106 7.210 7.210 7.857 -0.647 19700 747 1 5 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.759 0.305 19700 748 1 5 . 1 1 108 108 GLU N N 108 119.996 119.996 117.741 2.255 19700 749 1 5 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.346 0.230 19700 750 1 5 . 1 1 108 108 GLU H H 108 7.777 7.777 8.132 -0.355 19700 751 1 5 . 1 1 109 109 MET N N 109 121.587 121.587 121.026 0.561 19700 752 1 5 . 1 1 109 109 MET HA H 109 3.879 3.879 4.211 -0.332 19700 753 1 5 . 1 1 109 109 MET H H 109 8.954 8.954 8.580 0.374 19700 754 1 5 . 1 1 110 110 PHE N N 110 114.224 114.224 120.165 -5.941 19700 755 1 5 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.493 0.454 19700 756 1 5 . 1 1 110 110 PHE H H 110 7.943 7.943 8.460 -0.517 19700 757 1 5 . 1 1 111 111 CYS N N 111 117.718 117.718 116.766 0.952 19700 758 1 5 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.881 -0.028 19700 759 1 5 . 1 1 111 111 CYS H H 111 8.141 8.141 7.640 0.501 19700 760 1 5 . 1 1 112 112 GLY N N 112 106.232 106.232 108.434 -2.202 19700 761 1 5 . 1 1 112 112 GLY H H 112 8.738 8.738 8.564 0.174 19700 762 1 5 . 1 1 113 113 LYS N N 113 123.354 123.354 123.835 -0.481 19700 763 1 5 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.639 -0.248 19700 764 1 5 . 1 1 113 113 LYS H H 113 7.064 7.064 7.757 -0.693 19700 765 1 5 . 1 1 114 114 PHE N N 114 117.507 117.507 120.368 -2.861 19700 766 1 5 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.219 0.125 19700 767 1 5 . 1 1 114 114 PHE H H 114 7.823 7.823 7.928 -0.105 19700 768 1 5 . 1 1 115 115 GLN N N 115 117.426 117.426 116.776 0.650 19700 769 1 5 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.786 0.002 19700 770 1 5 . 1 1 115 115 GLN H H 115 9.044 9.044 9.236 -0.192 19700 771 1 5 . 1 1 116 116 ILE N N 116 124.941 124.941 121.472 3.469 19700 772 1 5 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.654 -0.287 19700 773 1 5 . 1 1 116 116 ILE H H 116 8.705 8.705 8.500 0.205 19700 774 1 5 . 1 1 117 117 CYS N N 117 127.674 127.674 127.851 -0.177 19700 775 1 5 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.580 0.268 19700 776 1 5 . 1 1 117 117 CYS H H 117 9.103 9.103 8.932 0.171 19700 777 1 5 . 1 1 118 118 ARG N N 118 120.976 120.976 123.683 -2.707 19700 778 1 5 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.565 -0.053 19700 779 1 5 . 1 1 118 118 ARG H H 118 8.396 8.396 8.568 -0.172 19700 780 1 5 . 1 1 119 119 ASN N N 119 119.240 119.240 118.512 0.728 19700 781 1 5 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.501 0.059 19700 782 1 5 . 1 1 119 119 ASN H H 119 8.836 8.836 8.467 0.369 19700 783 1 5 . 1 1 120 120 GLY N N 120 111.230 111.230 108.539 2.691 19700 784 1 5 . 1 1 120 120 GLY H H 120 8.755 8.755 8.588 0.167 19700 785 1 5 . 1 1 121 121 GLU N N 121 119.650 119.650 119.648 0.002 19700 786 1 5 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.701 -0.451 19700 787 1 5 . 1 1 121 121 GLU H H 121 8.158 8.158 7.653 0.505 19700 788 1 5 . 1 1 122 122 LYS N N 122 120.471 120.471 120.429 0.042 19700 789 1 5 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.561 -0.002 19700 790 1 5 . 1 1 122 122 LYS H H 122 7.622 7.622 8.626 -1.004 19700 791 1 5 . 1 1 123 123 ILE N N 123 118.223 118.223 114.135 4.088 19700 792 1 5 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.635 0.121 19700 793 1 5 . 1 1 123 123 ILE H H 123 8.142 8.142 7.735 0.407 19700 794 1 5 . 1 1 124 124 CYS N N 124 118.872 118.872 120.169 -1.297 19700 795 1 5 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.574 0.411 19700 796 1 5 . 1 1 124 124 CYS H H 124 9.196 9.196 8.788 0.408 19700 797 1 5 . 1 1 125 125 PHE N N 125 116.458 116.458 114.410 2.048 19700 798 1 5 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.539 0.778 19700 799 1 5 . 1 1 125 125 PHE H H 125 8.958 8.958 8.783 0.175 19700 800 1 5 . 1 1 126 126 LYS N N 126 125.559 125.559 122.639 2.920 19700 801 1 5 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.755 0.396 19700 802 1 5 . 1 1 126 126 LYS H H 126 9.109 9.109 8.499 0.610 19700 803 1 5 . 1 1 127 127 LYS N N 127 124.796 124.796 125.944 -1.148 19700 804 1 5 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.384 -0.167 19700 805 1 5 . 1 1 127 127 LYS H H 127 9.498 9.498 8.148 1.350 19700 806 1 5 . 1 1 128 128 LEU N N 128 126.430 126.430 120.794 5.636 19700 807 1 5 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.090 1.351 19700 808 1 5 . 1 1 128 128 LEU H H 128 9.105 9.105 8.506 0.599 19700 809 1 5 . 1 1 129 129 HIS N N 129 124.315 124.315 123.092 1.223 19700 810 1 5 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.551 0.379 19700 811 1 5 . 1 1 129 129 HIS H H 129 9.123 9.123 8.368 0.755 19700 812 1 5 . 1 1 130 130 GLN N N 130 120.311 120.311 115.295 5.016 19700 813 1 5 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.468 -0.084 19700 814 1 5 . 1 1 130 130 GLN H H 130 8.246 8.246 7.830 0.416 19700 815 1 5 . 1 1 131 131 ARG N N 131 123.995 123.995 122.139 1.856 19700 816 1 5 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.230 0.060 19700 817 1 5 . 1 1 131 131 ARG H H 131 8.510 8.510 8.644 -0.134 19700 818 1 5 . 1 1 132 132 ARG N N 132 121.592 121.592 119.145 2.447 19700 819 1 5 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.154 0.154 19700 820 1 5 . 1 1 132 132 ARG H H 132 8.183 8.183 8.201 -0.018 19700 821 1 5 . 1 1 133 133 ALA N N 133 124.315 124.315 122.230 2.085 19700 822 1 5 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.243 -0.007 19700 823 1 5 . 1 1 133 133 ALA H H 133 8.249 8.249 7.657 0.592 19700 824 1 5 . 1 1 134 134 LEU N N 134 119.576 119.576 122.946 -3.370 19700 825 1 5 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.338 -0.073 19700 826 1 5 . 1 1 134 134 LEU H H 134 8.146 8.146 8.177 -0.031 19700 827 1 5 . 1 1 135 135 SER N N 135 113.103 113.103 116.434 -3.331 19700 828 1 5 . 1 1 135 135 SER HA H 135 4.504 4.504 4.418 0.086 19700 829 1 5 . 1 1 135 135 SER H H 135 7.980 7.980 7.843 0.137 19700 830 1 5 . 1 1 136 136 TRP N N 136 123.354 123.354 126.759 -3.405 19700 831 1 5 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.544 0.309 19700 832 1 5 . 1 1 136 136 TRP H H 136 8.027 8.027 8.539 -0.512 19700 833 1 5 . 1 1 137 137 ARG N N 137 120.614 120.614 125.662 -5.048 19700 834 1 5 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.789 -0.115 19700 835 1 5 . 1 1 137 137 ARG H H 137 7.991 7.991 7.840 0.151 19700 836 1 5 . 1 1 138 138 TYR N N 138 119.354 119.354 120.645 -1.291 19700 837 1 5 . 1 1 138 138 TYR HA H 138 5.414 5.414 4.974 0.440 19700 838 1 5 . 1 1 138 138 TYR H H 138 9.191 9.191 8.819 0.372 19700 839 1 5 . 1 1 139 139 ILE N N 139 119.510 119.510 123.419 -3.909 19700 840 1 5 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.257 0.061 19700 841 1 5 . 1 1 139 139 ILE H H 139 9.104 9.104 8.895 0.209 19700 842 1 5 . 1 1 140 140 ARG N N 140 125.596 125.596 126.477 -0.881 19700 843 1 5 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.010 -0.194 19700 844 1 5 . 1 1 140 140 ARG H H 140 8.393 8.393 8.081 0.312 19700 845 1 5 . 1 1 141 141 GLY N N 141 103.964 103.964 109.952 -5.988 19700 846 1 5 . 1 1 141 141 GLY H H 141 6.307 6.307 7.533 -1.226 19700 847 1 5 . 1 1 142 142 CYS N N 142 117.908 117.908 119.641 -1.733 19700 848 1 5 . 1 1 142 142 CYS HA H 142 5.756 5.756 5.021 0.735 19700 849 1 5 . 1 1 142 142 CYS H H 142 8.184 8.184 8.661 -0.477 19700 850 1 5 . 1 1 143 143 ALA N N 143 121.268 121.268 124.402 -3.134 19700 851 1 5 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.991 -0.196 19700 852 1 5 . 1 1 143 143 ALA H H 143 9.508 9.508 8.978 0.530 19700 853 1 5 . 1 1 144 144 ASP N N 144 118.068 118.068 118.196 -0.128 19700 854 1 5 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.677 0.215 19700 855 1 5 . 1 1 144 144 ASP H H 144 9.030 9.030 8.622 0.408 19700 856 1 5 . 1 1 145 145 THR N N 145 108.476 108.476 109.370 -0.894 19700 857 1 5 . 1 1 145 145 THR HA H 145 4.422 4.422 4.274 0.148 19700 858 1 5 . 1 1 145 145 THR H H 145 7.401 7.401 7.546 -0.145 19700 859 1 5 . 1 1 146 146 CYS N N 146 123.516 123.516 122.754 0.762 19700 860 1 5 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.337 0.376 19700 861 1 5 . 1 1 146 146 CYS H H 146 8.850 8.850 8.472 0.378 19700 862 1 5 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.429 -0.173 19700 863 1 5 . 1 1 148 148 VAL N N 148 118.686 118.686 122.196 -3.510 19700 864 1 5 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.974 0.112 19700 865 1 5 . 1 1 148 148 VAL H H 148 7.857 7.857 8.219 -0.362 19700 866 1 5 . 1 1 149 149 GLY N N 149 113.423 113.423 113.073 0.350 19700 867 1 5 . 1 1 149 149 GLY H H 149 8.357 8.357 7.950 0.407 19700 868 1 5 . 1 1 150 150 LYS N N 150 121.492 121.492 121.112 0.380 19700 869 1 5 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.557 0.070 19700 870 1 5 . 1 1 150 150 LYS H H 150 8.574 8.574 8.266 0.308 19700 871 1 5 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.490 -0.148 19700 872 1 5 . 1 1 152 152 TYR N N 152 111.257 111.257 119.987 -8.730 19700 873 1 5 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.350 0.174 19700 874 1 5 . 1 1 152 152 TYR H H 152 7.127 7.127 8.148 -1.021 19700 875 1 5 . 1 1 153 153 GLU N N 153 119.670 119.670 115.535 4.135 19700 876 1 5 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.270 0.137 19700 877 1 5 . 1 1 153 153 GLU H H 153 7.603 7.603 8.426 -0.823 19700 878 1 5 . 1 1 154 154 MET N N 154 117.748 117.748 115.978 1.770 19700 879 1 5 . 1 1 154 154 MET HA H 154 4.335 4.335 4.021 0.314 19700 880 1 5 . 1 1 154 154 MET H H 154 8.052 8.052 7.475 0.577 19700 881 1 5 . 1 1 155 155 ILE N N 155 121.057 121.057 118.725 2.332 19700 882 1 5 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.124 0.420 19700 883 1 5 . 1 1 155 155 ILE H H 155 8.393 8.393 8.336 0.057 19700 884 1 5 . 1 1 156 156 GLU N N 156 127.999 127.999 129.151 -1.152 19700 885 1 5 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.589 0.283 19700 886 1 5 . 1 1 156 156 GLU H H 156 8.994 8.994 8.084 0.910 19700 887 1 5 . 1 1 157 157 CYS N N 157 123.034 123.034 121.594 1.440 19700 888 1 5 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.668 -0.150 19700 889 1 5 . 1 1 157 157 CYS H H 157 9.029 9.029 8.584 0.445 19700 890 1 5 . 1 1 158 158 CYS N N 158 119.670 119.670 120.117 -0.447 19700 891 1 5 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.933 0.238 19700 892 1 5 . 1 1 158 158 CYS H H 158 9.344 9.344 9.157 0.187 19700 893 1 5 . 1 1 159 159 SER N N 159 114.684 114.684 116.607 -1.923 19700 894 1 5 . 1 1 159 159 SER HA H 159 5.112 5.112 4.792 0.320 19700 895 1 5 . 1 1 159 159 SER H H 159 9.064 9.064 8.596 0.468 19700 896 1 5 . 1 1 160 160 THR N N 160 111.828 111.828 112.873 -1.045 19700 897 1 5 . 1 1 160 160 THR HA H 160 4.784 4.784 4.594 0.190 19700 898 1 5 . 1 1 160 160 THR H H 160 7.626 7.626 7.410 0.216 19700 899 1 5 . 1 1 161 161 ASP N N 161 118.279 118.279 123.210 -4.931 19700 900 1 5 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.364 0.492 19700 901 1 5 . 1 1 161 161 ASP H H 161 8.332 8.332 8.545 -0.213 19700 902 1 5 . 1 1 162 162 LYS N N 162 116.091 116.091 118.376 -2.285 19700 903 1 5 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.695 -0.243 19700 904 1 5 . 1 1 162 162 LYS H H 162 9.460 9.460 8.107 1.353 19700 905 1 5 . 1 1 163 163 CYS N N 163 111.859 111.859 115.715 -3.856 19700 906 1 5 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.149 0.267 19700 907 1 5 . 1 1 163 163 CYS H H 163 7.751 7.751 8.435 -0.684 19700 908 1 5 . 1 1 164 164 ASN N N 164 122.713 122.713 117.597 5.116 19700 909 1 5 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.616 0.068 19700 910 1 5 . 1 1 164 164 ASN H H 164 9.396 9.396 8.148 1.248 19700 911 1 6 . 1 1 101 101 LEU N N 101 128.488 128.488 122.243 6.245 19700 912 1 6 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.914 -0.192 19700 913 1 6 . 1 1 101 101 LEU H H 101 8.706 8.706 8.584 0.122 19700 914 1 6 . 1 1 102 102 THR N N 102 117.086 117.086 119.691 -2.605 19700 915 1 6 . 1 1 102 102 THR HA H 102 5.198 5.198 4.943 0.255 19700 916 1 6 . 1 1 102 102 THR H H 102 7.729 7.729 8.353 -0.624 19700 917 1 6 . 1 1 103 103 CYS N N 103 119.021 119.021 124.296 -5.275 19700 918 1 6 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.794 0.334 19700 919 1 6 . 1 1 103 103 CYS H H 103 8.514 8.514 9.152 -0.638 19700 920 1 6 . 1 1 104 104 LEU N N 104 123.028 123.028 121.286 1.742 19700 921 1 6 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.541 0.270 19700 922 1 6 . 1 1 104 104 LEU H H 104 9.147 9.147 8.309 0.838 19700 923 1 6 . 1 1 105 105 ASN N N 105 119.029 119.029 118.022 1.007 19700 924 1 6 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.885 -0.079 19700 925 1 6 . 1 1 105 105 ASN H H 105 8.611 8.611 8.768 -0.157 19700 926 1 6 . 1 1 106 106 CYS N N 106 117.427 117.427 116.073 1.354 19700 927 1 6 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.897 0.330 19700 928 1 6 . 1 1 106 106 CYS H H 106 7.210 7.210 7.890 -0.680 19700 929 1 6 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.698 0.366 19700 930 1 6 . 1 1 108 108 GLU N N 108 119.996 119.996 118.161 1.835 19700 931 1 6 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.372 0.204 19700 932 1 6 . 1 1 108 108 GLU H H 108 7.777 7.777 8.244 -0.467 19700 933 1 6 . 1 1 109 109 MET N N 109 121.587 121.587 120.996 0.591 19700 934 1 6 . 1 1 109 109 MET HA H 109 3.879 3.879 4.342 -0.463 19700 935 1 6 . 1 1 109 109 MET H H 109 8.954 8.954 8.934 0.020 19700 936 1 6 . 1 1 110 110 PHE N N 110 114.224 114.224 119.586 -5.362 19700 937 1 6 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.608 0.339 19700 938 1 6 . 1 1 110 110 PHE H H 110 7.943 7.943 8.583 -0.640 19700 939 1 6 . 1 1 111 111 CYS N N 111 117.718 117.718 117.384 0.334 19700 940 1 6 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.827 0.026 19700 941 1 6 . 1 1 111 111 CYS H H 111 8.141 8.141 7.760 0.381 19700 942 1 6 . 1 1 112 112 GLY N N 112 106.232 106.232 105.666 0.566 19700 943 1 6 . 1 1 112 112 GLY H H 112 8.738 8.738 8.479 0.259 19700 944 1 6 . 1 1 113 113 LYS N N 113 123.354 123.354 123.792 -0.438 19700 945 1 6 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.657 -0.266 19700 946 1 6 . 1 1 113 113 LYS H H 113 7.064 7.064 7.724 -0.660 19700 947 1 6 . 1 1 114 114 PHE N N 114 117.507 117.507 120.454 -2.947 19700 948 1 6 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.153 0.191 19700 949 1 6 . 1 1 114 114 PHE H H 114 7.823 7.823 8.028 -0.205 19700 950 1 6 . 1 1 115 115 GLN N N 115 117.426 117.426 118.274 -0.848 19700 951 1 6 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.657 0.131 19700 952 1 6 . 1 1 115 115 GLN H H 115 9.044 9.044 9.063 -0.019 19700 953 1 6 . 1 1 116 116 ILE N N 116 124.941 124.941 123.489 1.452 19700 954 1 6 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.515 -0.148 19700 955 1 6 . 1 1 116 116 ILE H H 116 8.705 8.705 8.443 0.263 19700 956 1 6 . 1 1 117 117 CYS N N 117 127.674 127.674 127.489 0.185 19700 957 1 6 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.629 0.219 19700 958 1 6 . 1 1 117 117 CYS H H 117 9.103 9.103 8.939 0.164 19700 959 1 6 . 1 1 118 118 ARG N N 118 120.976 120.976 123.820 -2.844 19700 960 1 6 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.488 0.024 19700 961 1 6 . 1 1 118 118 ARG H H 118 8.396 8.396 8.601 -0.205 19700 962 1 6 . 1 1 119 119 ASN N N 119 119.240 119.240 118.461 0.779 19700 963 1 6 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.493 0.067 19700 964 1 6 . 1 1 119 119 ASN H H 119 8.836 8.836 8.496 0.340 19700 965 1 6 . 1 1 120 120 GLY N N 120 111.230 111.230 109.345 1.885 19700 966 1 6 . 1 1 120 120 GLY H H 120 8.755 8.755 8.577 0.178 19700 967 1 6 . 1 1 121 121 GLU N N 121 119.650 119.650 119.900 -0.250 19700 968 1 6 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.619 -0.369 19700 969 1 6 . 1 1 121 121 GLU H H 121 8.158 8.158 7.699 0.459 19700 970 1 6 . 1 1 122 122 LYS N N 122 120.471 120.471 121.785 -1.314 19700 971 1 6 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.416 0.143 19700 972 1 6 . 1 1 122 122 LYS H H 122 7.622 7.622 8.501 -0.879 19700 973 1 6 . 1 1 123 123 ILE N N 123 118.223 118.223 119.265 -1.042 19700 974 1 6 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.453 0.303 19700 975 1 6 . 1 1 123 123 ILE H H 123 8.142 8.142 7.575 0.567 19700 976 1 6 . 1 1 124 124 CYS N N 124 118.872 118.872 124.941 -6.069 19700 977 1 6 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.447 0.538 19700 978 1 6 . 1 1 124 124 CYS H H 124 9.196 9.196 9.019 0.177 19700 979 1 6 . 1 1 125 125 PHE N N 125 116.458 116.458 114.652 1.806 19700 980 1 6 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.612 0.705 19700 981 1 6 . 1 1 125 125 PHE H H 125 8.958 8.958 8.900 0.058 19700 982 1 6 . 1 1 126 126 LYS N N 126 125.559 125.559 123.379 2.180 19700 983 1 6 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.981 0.170 19700 984 1 6 . 1 1 126 126 LYS H H 126 9.109 9.109 8.794 0.315 19700 985 1 6 . 1 1 127 127 LYS N N 127 124.796 124.796 125.432 -0.636 19700 986 1 6 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.579 -0.362 19700 987 1 6 . 1 1 127 127 LYS H H 127 9.498 9.498 8.378 1.120 19700 988 1 6 . 1 1 128 128 LEU N N 128 126.430 126.430 120.484 5.946 19700 989 1 6 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.741 0.700 19700 990 1 6 . 1 1 128 128 LEU H H 128 9.105 9.105 8.800 0.305 19700 991 1 6 . 1 1 129 129 HIS N N 129 124.315 124.315 121.870 2.445 19700 992 1 6 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.767 0.163 19700 993 1 6 . 1 1 129 129 HIS H H 129 9.123 9.123 8.772 0.351 19700 994 1 6 . 1 1 130 130 GLN N N 130 120.311 120.311 117.368 2.943 19700 995 1 6 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.497 -0.113 19700 996 1 6 . 1 1 130 130 GLN H H 130 8.246 8.246 7.606 0.640 19700 997 1 6 . 1 1 131 131 ARG N N 131 123.995 123.995 122.302 1.693 19700 998 1 6 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.177 0.113 19700 999 1 6 . 1 1 131 131 ARG H H 131 8.510 8.510 8.728 -0.218 19700 1000 1 6 . 1 1 132 132 ARG N N 132 121.592 121.592 119.569 2.023 19700 1001 1 6 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.087 0.221 19700 1002 1 6 . 1 1 132 132 ARG H H 132 8.183 8.183 8.131 0.052 19700 1003 1 6 . 1 1 133 133 ALA N N 133 124.315 124.315 119.622 4.693 19700 1004 1 6 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.448 -0.212 19700 1005 1 6 . 1 1 133 133 ALA H H 133 8.249 8.249 7.721 0.528 19700 1006 1 6 . 1 1 134 134 LEU N N 134 119.576 119.576 117.359 2.217 19700 1007 1 6 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.665 -0.400 19700 1008 1 6 . 1 1 134 134 LEU H H 134 8.146 8.146 8.209 -0.063 19700 1009 1 6 . 1 1 135 135 SER N N 135 113.103 113.103 115.205 -2.102 19700 1010 1 6 . 1 1 135 135 SER HA H 135 4.504 4.504 4.047 0.457 19700 1011 1 6 . 1 1 135 135 SER H H 135 7.980 7.980 7.801 0.179 19700 1012 1 6 . 1 1 136 136 TRP N N 136 123.354 123.354 122.232 1.122 19700 1013 1 6 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.659 0.194 19700 1014 1 6 . 1 1 136 136 TRP H H 136 8.027 8.027 8.477 -0.450 19700 1015 1 6 . 1 1 137 137 ARG N N 137 120.614 120.614 116.311 4.303 19700 1016 1 6 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.774 -0.100 19700 1017 1 6 . 1 1 137 137 ARG H H 137 7.991 7.991 8.312 -0.321 19700 1018 1 6 . 1 1 138 138 TYR N N 138 119.354 119.354 119.205 0.149 19700 1019 1 6 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.019 0.395 19700 1020 1 6 . 1 1 138 138 TYR H H 138 9.191 9.191 7.752 1.439 19700 1021 1 6 . 1 1 139 139 ILE N N 139 119.510 119.510 121.320 -1.810 19700 1022 1 6 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.279 0.039 19700 1023 1 6 . 1 1 139 139 ILE H H 139 9.104 9.104 9.036 0.068 19700 1024 1 6 . 1 1 140 140 ARG N N 140 125.596 125.596 126.396 -0.800 19700 1025 1 6 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.096 -0.280 19700 1026 1 6 . 1 1 140 140 ARG H H 140 8.393 8.393 8.469 -0.076 19700 1027 1 6 . 1 1 141 141 GLY N N 141 103.964 103.964 109.333 -5.369 19700 1028 1 6 . 1 1 141 141 GLY H H 141 6.307 6.307 7.545 -1.238 19700 1029 1 6 . 1 1 142 142 CYS N N 142 117.908 117.908 119.178 -1.270 19700 1030 1 6 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.939 0.817 19700 1031 1 6 . 1 1 142 142 CYS H H 142 8.184 8.184 8.607 -0.423 19700 1032 1 6 . 1 1 143 143 ALA N N 143 121.268 121.268 123.037 -1.769 19700 1033 1 6 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.936 -0.141 19700 1034 1 6 . 1 1 143 143 ALA H H 143 9.508 9.508 8.579 0.929 19700 1035 1 6 . 1 1 144 144 ASP N N 144 118.068 118.068 118.172 -0.104 19700 1036 1 6 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.599 0.293 19700 1037 1 6 . 1 1 144 144 ASP H H 144 9.030 9.030 8.923 0.107 19700 1038 1 6 . 1 1 145 145 THR N N 145 108.476 108.476 109.654 -1.178 19700 1039 1 6 . 1 1 145 145 THR HA H 145 4.422 4.422 4.287 0.135 19700 1040 1 6 . 1 1 145 145 THR H H 145 7.401 7.401 7.477 -0.076 19700 1041 1 6 . 1 1 146 146 CYS N N 146 123.516 123.516 122.806 0.710 19700 1042 1 6 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.334 0.379 19700 1043 1 6 . 1 1 146 146 CYS H H 146 8.850 8.850 8.500 0.350 19700 1044 1 6 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.424 -0.168 19700 1045 1 6 . 1 1 148 148 VAL N N 148 118.686 118.686 122.178 -3.492 19700 1046 1 6 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.915 0.171 19700 1047 1 6 . 1 1 148 148 VAL H H 148 7.857 7.857 8.232 -0.375 19700 1048 1 6 . 1 1 149 149 GLY N N 149 113.423 113.423 112.705 0.718 19700 1049 1 6 . 1 1 149 149 GLY H H 149 8.357 8.357 8.350 0.007 19700 1050 1 6 . 1 1 150 150 LYS N N 150 121.492 121.492 121.051 0.441 19700 1051 1 6 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.485 0.142 19700 1052 1 6 . 1 1 150 150 LYS H H 150 8.574 8.574 8.586 -0.012 19700 1053 1 6 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.436 -0.094 19700 1054 1 6 . 1 1 152 152 TYR N N 152 111.257 111.257 119.041 -7.784 19700 1055 1 6 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.496 0.028 19700 1056 1 6 . 1 1 152 152 TYR H H 152 7.127 7.127 7.917 -0.790 19700 1057 1 6 . 1 1 153 153 GLU N N 153 119.670 119.670 117.881 1.789 19700 1058 1 6 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.292 0.115 19700 1059 1 6 . 1 1 153 153 GLU H H 153 7.603 7.603 7.794 -0.191 19700 1060 1 6 . 1 1 154 154 MET N N 154 117.748 117.748 115.627 2.121 19700 1061 1 6 . 1 1 154 154 MET HA H 154 4.335 4.335 4.069 0.266 19700 1062 1 6 . 1 1 154 154 MET H H 154 8.052 8.052 7.509 0.543 19700 1063 1 6 . 1 1 155 155 ILE N N 155 121.057 121.057 118.952 2.105 19700 1064 1 6 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.039 0.505 19700 1065 1 6 . 1 1 155 155 ILE H H 155 8.393 8.393 8.284 0.109 19700 1066 1 6 . 1 1 156 156 GLU N N 156 127.999 127.999 129.421 -1.422 19700 1067 1 6 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.637 0.235 19700 1068 1 6 . 1 1 156 156 GLU H H 156 8.994 8.994 8.276 0.718 19700 1069 1 6 . 1 1 157 157 CYS N N 157 123.034 123.034 120.923 2.111 19700 1070 1 6 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.620 -0.102 19700 1071 1 6 . 1 1 157 157 CYS H H 157 9.029 9.029 8.534 0.495 19700 1072 1 6 . 1 1 158 158 CYS N N 158 119.670 119.670 119.806 -0.136 19700 1073 1 6 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.831 0.340 19700 1074 1 6 . 1 1 158 158 CYS H H 158 9.344 9.344 9.060 0.284 19700 1075 1 6 . 1 1 159 159 SER N N 159 114.684 114.684 116.779 -2.095 19700 1076 1 6 . 1 1 159 159 SER HA H 159 5.112 5.112 4.756 0.356 19700 1077 1 6 . 1 1 159 159 SER H H 159 9.064 9.064 8.546 0.518 19700 1078 1 6 . 1 1 160 160 THR N N 160 111.828 111.828 113.128 -1.300 19700 1079 1 6 . 1 1 160 160 THR HA H 160 4.784 4.784 4.552 0.232 19700 1080 1 6 . 1 1 160 160 THR H H 160 7.626 7.626 7.351 0.275 19700 1081 1 6 . 1 1 161 161 ASP N N 161 118.279 118.279 123.137 -4.858 19700 1082 1 6 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.297 0.559 19700 1083 1 6 . 1 1 161 161 ASP H H 161 8.332 8.332 8.542 -0.210 19700 1084 1 6 . 1 1 162 162 LYS N N 162 116.091 116.091 117.317 -1.226 19700 1085 1 6 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.687 -0.235 19700 1086 1 6 . 1 1 162 162 LYS H H 162 9.460 9.460 8.225 1.235 19700 1087 1 6 . 1 1 163 163 CYS N N 163 111.859 111.859 115.666 -3.807 19700 1088 1 6 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.188 0.228 19700 1089 1 6 . 1 1 163 163 CYS H H 163 7.751 7.751 8.525 -0.774 19700 1090 1 6 . 1 1 164 164 ASN N N 164 122.713 122.713 117.153 5.560 19700 1091 1 6 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.591 0.093 19700 1092 1 6 . 1 1 164 164 ASN H H 164 9.396 9.396 8.267 1.129 19700 1093 1 7 . 1 1 101 101 LEU N N 101 128.488 128.488 122.467 6.021 19700 1094 1 7 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.868 -0.146 19700 1095 1 7 . 1 1 101 101 LEU H H 101 8.706 8.706 8.564 0.142 19700 1096 1 7 . 1 1 102 102 THR N N 102 117.086 117.086 119.500 -2.414 19700 1097 1 7 . 1 1 102 102 THR HA H 102 5.198 5.198 4.958 0.240 19700 1098 1 7 . 1 1 102 102 THR H H 102 7.729 7.729 8.261 -0.532 19700 1099 1 7 . 1 1 103 103 CYS N N 103 119.021 119.021 124.733 -5.712 19700 1100 1 7 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.826 0.302 19700 1101 1 7 . 1 1 103 103 CYS H H 103 8.514 8.514 9.405 -0.891 19700 1102 1 7 . 1 1 104 104 LEU N N 104 123.028 123.028 121.200 1.828 19700 1103 1 7 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.465 0.346 19700 1104 1 7 . 1 1 104 104 LEU H H 104 9.147 9.147 8.254 0.893 19700 1105 1 7 . 1 1 105 105 ASN N N 105 119.029 119.029 116.918 2.111 19700 1106 1 7 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.927 -0.121 19700 1107 1 7 . 1 1 105 105 ASN H H 105 8.611 8.611 8.713 -0.102 19700 1108 1 7 . 1 1 106 106 CYS N N 106 117.427 117.427 116.139 1.288 19700 1109 1 7 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.885 0.342 19700 1110 1 7 . 1 1 106 106 CYS H H 106 7.210 7.210 8.108 -0.898 19700 1111 1 7 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.638 0.426 19700 1112 1 7 . 1 1 108 108 GLU N N 108 119.996 119.996 118.133 1.863 19700 1113 1 7 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.222 0.354 19700 1114 1 7 . 1 1 108 108 GLU H H 108 7.777 7.777 7.972 -0.195 19700 1115 1 7 . 1 1 109 109 MET N N 109 121.587 121.587 119.131 2.456 19700 1116 1 7 . 1 1 109 109 MET HA H 109 3.879 3.879 4.220 -0.341 19700 1117 1 7 . 1 1 109 109 MET H H 109 8.954 8.954 8.522 0.432 19700 1118 1 7 . 1 1 110 110 PHE N N 110 114.224 114.224 120.110 -5.886 19700 1119 1 7 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.504 0.443 19700 1120 1 7 . 1 1 110 110 PHE H H 110 7.943 7.943 8.290 -0.347 19700 1121 1 7 . 1 1 111 111 CYS N N 111 117.718 117.718 117.814 -0.096 19700 1122 1 7 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.918 -0.065 19700 1123 1 7 . 1 1 111 111 CYS H H 111 8.141 8.141 7.930 0.211 19700 1124 1 7 . 1 1 112 112 GLY N N 112 106.232 106.232 106.214 0.018 19700 1125 1 7 . 1 1 112 112 GLY H H 112 8.738 8.738 8.523 0.215 19700 1126 1 7 . 1 1 113 113 LYS N N 113 123.354 123.354 123.364 -0.010 19700 1127 1 7 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.602 -0.211 19700 1128 1 7 . 1 1 113 113 LYS H H 113 7.064 7.064 7.735 -0.671 19700 1129 1 7 . 1 1 114 114 PHE N N 114 117.507 117.507 119.810 -2.303 19700 1130 1 7 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.066 0.278 19700 1131 1 7 . 1 1 114 114 PHE H H 114 7.823 7.823 8.132 -0.309 19700 1132 1 7 . 1 1 115 115 GLN N N 115 117.426 117.426 118.232 -0.806 19700 1133 1 7 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.694 0.094 19700 1134 1 7 . 1 1 115 115 GLN H H 115 9.044 9.044 9.321 -0.277 19700 1135 1 7 . 1 1 116 116 ILE N N 116 124.941 124.941 123.183 1.758 19700 1136 1 7 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.587 -0.220 19700 1137 1 7 . 1 1 116 116 ILE H H 116 8.705 8.705 8.446 0.259 19700 1138 1 7 . 1 1 117 117 CYS N N 117 127.674 127.674 127.439 0.235 19700 1139 1 7 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.639 0.209 19700 1140 1 7 . 1 1 117 117 CYS H H 117 9.103 9.103 8.721 0.382 19700 1141 1 7 . 1 1 118 118 ARG N N 118 120.976 120.976 122.685 -1.709 19700 1142 1 7 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.697 -0.184 19700 1143 1 7 . 1 1 118 118 ARG H H 118 8.396 8.396 8.507 -0.111 19700 1144 1 7 . 1 1 119 119 ASN N N 119 119.240 119.240 117.884 1.356 19700 1145 1 7 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.493 0.067 19700 1146 1 7 . 1 1 119 119 ASN H H 119 8.836 8.836 8.673 0.163 19700 1147 1 7 . 1 1 120 120 GLY N N 120 111.230 111.230 108.247 2.983 19700 1148 1 7 . 1 1 120 120 GLY H H 120 8.755 8.755 8.548 0.207 19700 1149 1 7 . 1 1 121 121 GLU N N 121 119.650 119.650 120.142 -0.492 19700 1150 1 7 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.680 -0.430 19700 1151 1 7 . 1 1 121 121 GLU H H 121 8.158 8.158 7.648 0.510 19700 1152 1 7 . 1 1 122 122 LYS N N 122 120.471 120.471 121.753 -1.282 19700 1153 1 7 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.436 0.123 19700 1154 1 7 . 1 1 122 122 LYS H H 122 7.622 7.622 8.593 -0.971 19700 1155 1 7 . 1 1 123 123 ILE N N 123 118.223 118.223 114.872 3.351 19700 1156 1 7 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.635 0.121 19700 1157 1 7 . 1 1 123 123 ILE H H 123 8.142 8.142 7.597 0.545 19700 1158 1 7 . 1 1 124 124 CYS N N 124 118.872 118.872 120.890 -2.018 19700 1159 1 7 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.383 0.602 19700 1160 1 7 . 1 1 124 124 CYS H H 124 9.196 9.196 8.715 0.481 19700 1161 1 7 . 1 1 125 125 PHE N N 125 116.458 116.458 114.921 1.537 19700 1162 1 7 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.784 0.533 19700 1163 1 7 . 1 1 125 125 PHE H H 125 8.958 8.958 8.915 0.043 19700 1164 1 7 . 1 1 126 126 LYS N N 126 125.559 125.559 123.393 2.166 19700 1165 1 7 . 1 1 126 126 LYS HA H 126 5.151 5.151 5.143 0.008 19700 1166 1 7 . 1 1 126 126 LYS H H 126 9.109 9.109 9.040 0.069 19700 1167 1 7 . 1 1 127 127 LYS N N 127 124.796 124.796 125.409 -0.613 19700 1168 1 7 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.538 -0.321 19700 1169 1 7 . 1 1 127 127 LYS H H 127 9.498 9.498 8.515 0.983 19700 1170 1 7 . 1 1 128 128 LEU N N 128 126.430 126.430 120.509 5.921 19700 1171 1 7 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.772 0.669 19700 1172 1 7 . 1 1 128 128 LEU H H 128 9.105 9.105 8.712 0.393 19700 1173 1 7 . 1 1 129 129 HIS N N 129 124.315 124.315 119.135 5.180 19700 1174 1 7 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.436 0.494 19700 1175 1 7 . 1 1 129 129 HIS H H 129 9.123 9.123 8.300 0.823 19700 1176 1 7 . 1 1 130 130 GLN N N 130 120.311 120.311 115.129 5.182 19700 1177 1 7 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.290 0.094 19700 1178 1 7 . 1 1 130 130 GLN H H 130 8.246 8.246 7.796 0.450 19700 1179 1 7 . 1 1 131 131 ARG N N 131 123.995 123.995 121.838 2.157 19700 1180 1 7 . 1 1 131 131 ARG HA H 131 4.290 4.290 3.921 0.369 19700 1181 1 7 . 1 1 131 131 ARG H H 131 8.510 8.510 8.314 0.196 19700 1182 1 7 . 1 1 132 132 ARG N N 132 121.592 121.592 121.576 0.016 19700 1183 1 7 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.296 0.012 19700 1184 1 7 . 1 1 132 132 ARG H H 132 8.183 8.183 8.154 0.029 19700 1185 1 7 . 1 1 133 133 ALA N N 133 124.315 124.315 126.210 -1.895 19700 1186 1 7 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.515 -0.279 19700 1187 1 7 . 1 1 133 133 ALA H H 133 8.249 8.249 7.871 0.378 19700 1188 1 7 . 1 1 134 134 LEU N N 134 119.576 119.576 117.792 1.784 19700 1189 1 7 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.337 -0.072 19700 1190 1 7 . 1 1 134 134 LEU H H 134 8.146 8.146 8.352 -0.206 19700 1191 1 7 . 1 1 135 135 SER N N 135 113.103 113.103 114.819 -1.716 19700 1192 1 7 . 1 1 135 135 SER HA H 135 4.504 4.504 4.514 -0.010 19700 1193 1 7 . 1 1 135 135 SER H H 135 7.980 7.980 7.619 0.361 19700 1194 1 7 . 1 1 136 136 TRP N N 136 123.354 123.354 127.022 -3.668 19700 1195 1 7 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.748 0.105 19700 1196 1 7 . 1 1 136 136 TRP H H 136 8.027 8.027 8.701 -0.674 19700 1197 1 7 . 1 1 137 137 ARG N N 137 120.614 120.614 124.119 -3.505 19700 1198 1 7 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.685 -0.011 19700 1199 1 7 . 1 1 137 137 ARG H H 137 7.991 7.991 8.441 -0.450 19700 1200 1 7 . 1 1 138 138 TYR N N 138 119.354 119.354 117.177 2.177 19700 1201 1 7 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.085 0.329 19700 1202 1 7 . 1 1 138 138 TYR H H 138 9.191 9.191 8.386 0.805 19700 1203 1 7 . 1 1 139 139 ILE N N 139 119.510 119.510 122.567 -3.057 19700 1204 1 7 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.493 -0.175 19700 1205 1 7 . 1 1 139 139 ILE H H 139 9.104 9.104 9.242 -0.138 19700 1206 1 7 . 1 1 140 140 ARG N N 140 125.596 125.596 126.522 -0.926 19700 1207 1 7 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.107 -0.291 19700 1208 1 7 . 1 1 140 140 ARG H H 140 8.393 8.393 8.594 -0.201 19700 1209 1 7 . 1 1 141 141 GLY N N 141 103.964 103.964 109.703 -5.739 19700 1210 1 7 . 1 1 141 141 GLY H H 141 6.307 6.307 7.442 -1.135 19700 1211 1 7 . 1 1 142 142 CYS N N 142 117.908 117.908 119.392 -1.484 19700 1212 1 7 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.798 0.958 19700 1213 1 7 . 1 1 142 142 CYS H H 142 8.184 8.184 8.615 -0.431 19700 1214 1 7 . 1 1 143 143 ALA N N 143 121.268 121.268 123.387 -2.119 19700 1215 1 7 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.976 -0.181 19700 1216 1 7 . 1 1 143 143 ALA H H 143 9.508 9.508 8.689 0.819 19700 1217 1 7 . 1 1 144 144 ASP N N 144 118.068 118.068 117.994 0.074 19700 1218 1 7 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.638 0.254 19700 1219 1 7 . 1 1 144 144 ASP H H 144 9.030 9.030 8.871 0.159 19700 1220 1 7 . 1 1 145 145 THR N N 145 108.476 108.476 109.673 -1.197 19700 1221 1 7 . 1 1 145 145 THR HA H 145 4.422 4.422 4.293 0.129 19700 1222 1 7 . 1 1 145 145 THR H H 145 7.401 7.401 7.481 -0.080 19700 1223 1 7 . 1 1 146 146 CYS N N 146 123.516 123.516 122.701 0.815 19700 1224 1 7 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.343 0.370 19700 1225 1 7 . 1 1 146 146 CYS H H 146 8.850 8.850 8.509 0.341 19700 1226 1 7 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.395 -0.139 19700 1227 1 7 . 1 1 148 148 VAL N N 148 118.686 118.686 123.008 -4.322 19700 1228 1 7 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.983 0.103 19700 1229 1 7 . 1 1 148 148 VAL H H 148 7.857 7.857 8.194 -0.337 19700 1230 1 7 . 1 1 149 149 GLY N N 149 113.423 113.423 113.365 0.058 19700 1231 1 7 . 1 1 149 149 GLY H H 149 8.357 8.357 8.040 0.317 19700 1232 1 7 . 1 1 150 150 LYS N N 150 121.492 121.492 121.702 -0.210 19700 1233 1 7 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.832 -0.205 19700 1234 1 7 . 1 1 150 150 LYS H H 150 8.574 8.574 8.121 0.453 19700 1235 1 7 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.407 -0.065 19700 1236 1 7 . 1 1 152 152 TYR N N 152 111.257 111.257 119.645 -8.388 19700 1237 1 7 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.528 -0.004 19700 1238 1 7 . 1 1 152 152 TYR H H 152 7.127 7.127 8.005 -0.878 19700 1239 1 7 . 1 1 153 153 GLU N N 153 119.670 119.670 118.206 1.464 19700 1240 1 7 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.280 0.127 19700 1241 1 7 . 1 1 153 153 GLU H H 153 7.603 7.603 8.154 -0.551 19700 1242 1 7 . 1 1 154 154 MET N N 154 117.748 117.748 115.908 1.840 19700 1243 1 7 . 1 1 154 154 MET HA H 154 4.335 4.335 4.076 0.259 19700 1244 1 7 . 1 1 154 154 MET H H 154 8.052 8.052 7.434 0.618 19700 1245 1 7 . 1 1 155 155 ILE N N 155 121.057 121.057 119.252 1.805 19700 1246 1 7 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.036 0.508 19700 1247 1 7 . 1 1 155 155 ILE H H 155 8.393 8.393 8.256 0.137 19700 1248 1 7 . 1 1 156 156 GLU N N 156 127.999 127.999 129.281 -1.282 19700 1249 1 7 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.553 0.319 19700 1250 1 7 . 1 1 156 156 GLU H H 156 8.994 8.994 8.770 0.224 19700 1251 1 7 . 1 1 157 157 CYS N N 157 123.034 123.034 121.671 1.363 19700 1252 1 7 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.644 -0.126 19700 1253 1 7 . 1 1 157 157 CYS H H 157 9.029 9.029 8.555 0.474 19700 1254 1 7 . 1 1 158 158 CYS N N 158 119.670 119.670 119.665 0.005 19700 1255 1 7 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.784 0.387 19700 1256 1 7 . 1 1 158 158 CYS H H 158 9.344 9.344 8.932 0.412 19700 1257 1 7 . 1 1 159 159 SER N N 159 114.684 114.684 115.552 -0.868 19700 1258 1 7 . 1 1 159 159 SER HA H 159 5.112 5.112 4.764 0.348 19700 1259 1 7 . 1 1 159 159 SER H H 159 9.064 9.064 8.497 0.567 19700 1260 1 7 . 1 1 160 160 THR N N 160 111.828 111.828 112.150 -0.322 19700 1261 1 7 . 1 1 160 160 THR HA H 160 4.784 4.784 4.620 0.164 19700 1262 1 7 . 1 1 160 160 THR H H 160 7.626 7.626 7.456 0.170 19700 1263 1 7 . 1 1 161 161 ASP N N 161 118.279 118.279 123.361 -5.082 19700 1264 1 7 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.408 0.448 19700 1265 1 7 . 1 1 161 161 ASP H H 161 8.332 8.332 8.565 -0.233 19700 1266 1 7 . 1 1 162 162 LYS N N 162 116.091 116.091 118.358 -2.267 19700 1267 1 7 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.688 -0.236 19700 1268 1 7 . 1 1 162 162 LYS H H 162 9.460 9.460 8.690 0.770 19700 1269 1 7 . 1 1 163 163 CYS N N 163 111.859 111.859 114.832 -2.973 19700 1270 1 7 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.142 0.274 19700 1271 1 7 . 1 1 163 163 CYS H H 163 7.751 7.751 8.373 -0.622 19700 1272 1 7 . 1 1 164 164 ASN N N 164 122.713 122.713 117.563 5.150 19700 1273 1 7 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.570 0.114 19700 1274 1 7 . 1 1 164 164 ASN H H 164 9.396 9.396 8.098 1.298 19700 1275 1 8 . 1 1 101 101 LEU N N 101 128.488 128.488 121.571 6.917 19700 1276 1 8 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.866 -0.144 19700 1277 1 8 . 1 1 101 101 LEU H H 101 8.706 8.706 8.497 0.209 19700 1278 1 8 . 1 1 102 102 THR N N 102 117.086 117.086 119.212 -2.126 19700 1279 1 8 . 1 1 102 102 THR HA H 102 5.198 5.198 5.129 0.069 19700 1280 1 8 . 1 1 102 102 THR H H 102 7.729 7.729 8.326 -0.597 19700 1281 1 8 . 1 1 103 103 CYS N N 103 119.021 119.021 125.130 -6.109 19700 1282 1 8 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.804 0.324 19700 1283 1 8 . 1 1 103 103 CYS H H 103 8.514 8.514 9.141 -0.627 19700 1284 1 8 . 1 1 104 104 LEU N N 104 123.028 123.028 121.786 1.242 19700 1285 1 8 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.662 0.149 19700 1286 1 8 . 1 1 104 104 LEU H H 104 9.147 9.147 8.466 0.681 19700 1287 1 8 . 1 1 105 105 ASN N N 105 119.029 119.029 116.744 2.285 19700 1288 1 8 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.066 -0.260 19700 1289 1 8 . 1 1 105 105 ASN H H 105 8.611 8.611 8.768 -0.157 19700 1290 1 8 . 1 1 106 106 CYS N N 106 117.427 117.427 116.628 0.799 19700 1291 1 8 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.903 0.324 19700 1292 1 8 . 1 1 106 106 CYS H H 106 7.210 7.210 7.997 -0.787 19700 1293 1 8 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.781 0.283 19700 1294 1 8 . 1 1 108 108 GLU N N 108 119.996 119.996 118.565 1.431 19700 1295 1 8 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.348 0.228 19700 1296 1 8 . 1 1 108 108 GLU H H 108 7.777 7.777 8.042 -0.265 19700 1297 1 8 . 1 1 109 109 MET N N 109 121.587 121.587 122.878 -1.291 19700 1298 1 8 . 1 1 109 109 MET HA H 109 3.879 3.879 4.172 -0.293 19700 1299 1 8 . 1 1 109 109 MET H H 109 8.954 8.954 8.751 0.203 19700 1300 1 8 . 1 1 110 110 PHE N N 110 114.224 114.224 120.492 -6.268 19700 1301 1 8 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.553 0.394 19700 1302 1 8 . 1 1 110 110 PHE H H 110 7.943 7.943 8.480 -0.537 19700 1303 1 8 . 1 1 111 111 CYS N N 111 117.718 117.718 117.714 0.004 19700 1304 1 8 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.831 0.022 19700 1305 1 8 . 1 1 111 111 CYS H H 111 8.141 8.141 7.790 0.351 19700 1306 1 8 . 1 1 112 112 GLY N N 112 106.232 106.232 106.202 0.030 19700 1307 1 8 . 1 1 112 112 GLY H H 112 8.738 8.738 8.525 0.213 19700 1308 1 8 . 1 1 113 113 LYS N N 113 123.354 123.354 123.699 -0.345 19700 1309 1 8 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.635 -0.244 19700 1310 1 8 . 1 1 113 113 LYS H H 113 7.064 7.064 7.699 -0.635 19700 1311 1 8 . 1 1 114 114 PHE N N 114 117.507 117.507 120.183 -2.676 19700 1312 1 8 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.445 -0.101 19700 1313 1 8 . 1 1 114 114 PHE H H 114 7.823 7.823 8.047 -0.224 19700 1314 1 8 . 1 1 115 115 GLN N N 115 117.426 117.426 118.154 -0.728 19700 1315 1 8 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.682 0.106 19700 1316 1 8 . 1 1 115 115 GLN H H 115 9.044 9.044 9.172 -0.128 19700 1317 1 8 . 1 1 116 116 ILE N N 116 124.941 124.941 123.049 1.892 19700 1318 1 8 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.434 -0.067 19700 1319 1 8 . 1 1 116 116 ILE H H 116 8.705 8.705 8.454 0.252 19700 1320 1 8 . 1 1 117 117 CYS N N 117 127.674 127.674 127.534 0.140 19700 1321 1 8 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.593 0.255 19700 1322 1 8 . 1 1 117 117 CYS H H 117 9.103 9.103 9.007 0.096 19700 1323 1 8 . 1 1 118 118 ARG N N 118 120.976 120.976 123.205 -2.229 19700 1324 1 8 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.501 0.011 19700 1325 1 8 . 1 1 118 118 ARG H H 118 8.396 8.396 8.627 -0.231 19700 1326 1 8 . 1 1 119 119 ASN N N 119 119.240 119.240 117.521 1.719 19700 1327 1 8 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.483 0.077 19700 1328 1 8 . 1 1 119 119 ASN H H 119 8.836 8.836 8.392 0.444 19700 1329 1 8 . 1 1 120 120 GLY N N 120 111.230 111.230 106.775 4.455 19700 1330 1 8 . 1 1 120 120 GLY H H 120 8.755 8.755 8.581 0.174 19700 1331 1 8 . 1 1 121 121 GLU N N 121 119.650 119.650 119.932 -0.282 19700 1332 1 8 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.703 -0.453 19700 1333 1 8 . 1 1 121 121 GLU H H 121 8.158 8.158 7.639 0.519 19700 1334 1 8 . 1 1 122 122 LYS N N 122 120.471 120.471 120.652 -0.181 19700 1335 1 8 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.468 0.091 19700 1336 1 8 . 1 1 122 122 LYS H H 122 7.622 7.622 8.605 -0.983 19700 1337 1 8 . 1 1 123 123 ILE N N 123 118.223 118.223 113.407 4.816 19700 1338 1 8 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.742 0.014 19700 1339 1 8 . 1 1 123 123 ILE H H 123 8.142 8.142 7.534 0.608 19700 1340 1 8 . 1 1 124 124 CYS N N 124 118.872 118.872 121.192 -2.320 19700 1341 1 8 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.386 0.599 19700 1342 1 8 . 1 1 124 124 CYS H H 124 9.196 9.196 8.668 0.528 19700 1343 1 8 . 1 1 125 125 PHE N N 125 116.458 116.458 114.692 1.766 19700 1344 1 8 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.768 0.549 19700 1345 1 8 . 1 1 125 125 PHE H H 125 8.958 8.958 8.931 0.027 19700 1346 1 8 . 1 1 126 126 LYS N N 126 125.559 125.559 123.400 2.159 19700 1347 1 8 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.958 0.193 19700 1348 1 8 . 1 1 126 126 LYS H H 126 9.109 9.109 8.861 0.248 19700 1349 1 8 . 1 1 127 127 LYS N N 127 124.796 124.796 124.595 0.201 19700 1350 1 8 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.480 -0.263 19700 1351 1 8 . 1 1 127 127 LYS H H 127 9.498 9.498 8.394 1.104 19700 1352 1 8 . 1 1 128 128 LEU N N 128 126.430 126.430 120.808 5.622 19700 1353 1 8 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.532 0.909 19700 1354 1 8 . 1 1 128 128 LEU H H 128 9.105 9.105 8.608 0.497 19700 1355 1 8 . 1 1 129 129 HIS N N 129 124.315 124.315 125.068 -0.753 19700 1356 1 8 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.588 0.342 19700 1357 1 8 . 1 1 129 129 HIS H H 129 9.123 9.123 8.671 0.452 19700 1358 1 8 . 1 1 130 130 GLN N N 130 120.311 120.311 116.644 3.667 19700 1359 1 8 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.325 0.059 19700 1360 1 8 . 1 1 130 130 GLN H H 130 8.246 8.246 7.362 0.884 19700 1361 1 8 . 1 1 131 131 ARG N N 131 123.995 123.995 122.712 1.283 19700 1362 1 8 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.418 -0.128 19700 1363 1 8 . 1 1 131 131 ARG H H 131 8.510 8.510 8.656 -0.146 19700 1364 1 8 . 1 1 132 132 ARG N N 132 121.592 121.592 121.204 0.388 19700 1365 1 8 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.154 0.154 19700 1366 1 8 . 1 1 132 132 ARG H H 132 8.183 8.183 7.945 0.238 19700 1367 1 8 . 1 1 133 133 ALA N N 133 124.315 124.315 121.236 3.079 19700 1368 1 8 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.172 0.064 19700 1369 1 8 . 1 1 133 133 ALA H H 133 8.249 8.249 7.704 0.545 19700 1370 1 8 . 1 1 134 134 LEU N N 134 119.576 119.576 119.651 -0.075 19700 1371 1 8 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.003 0.262 19700 1372 1 8 . 1 1 134 134 LEU H H 134 8.146 8.146 8.112 0.034 19700 1373 1 8 . 1 1 135 135 SER N N 135 113.103 113.103 115.186 -2.083 19700 1374 1 8 . 1 1 135 135 SER HA H 135 4.504 4.504 4.404 0.100 19700 1375 1 8 . 1 1 135 135 SER H H 135 7.980 7.980 7.726 0.254 19700 1376 1 8 . 1 1 136 136 TRP N N 136 123.354 123.354 126.265 -2.911 19700 1377 1 8 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.627 0.226 19700 1378 1 8 . 1 1 136 136 TRP H H 136 8.027 8.027 8.913 -0.886 19700 1379 1 8 . 1 1 137 137 ARG N N 137 120.614 120.614 120.995 -0.381 19700 1380 1 8 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.927 -0.253 19700 1381 1 8 . 1 1 137 137 ARG H H 137 7.991 7.991 8.251 -0.260 19700 1382 1 8 . 1 1 138 138 TYR N N 138 119.354 119.354 120.398 -1.044 19700 1383 1 8 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.133 0.281 19700 1384 1 8 . 1 1 138 138 TYR H H 138 9.191 9.191 8.318 0.873 19700 1385 1 8 . 1 1 139 139 ILE N N 139 119.510 119.510 123.478 -3.968 19700 1386 1 8 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.294 0.024 19700 1387 1 8 . 1 1 139 139 ILE H H 139 9.104 9.104 9.008 0.096 19700 1388 1 8 . 1 1 140 140 ARG N N 140 125.596 125.596 126.443 -0.847 19700 1389 1 8 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.054 -0.238 19700 1390 1 8 . 1 1 140 140 ARG H H 140 8.393 8.393 8.226 0.167 19700 1391 1 8 . 1 1 141 141 GLY N N 141 103.964 103.964 109.885 -5.921 19700 1392 1 8 . 1 1 141 141 GLY H H 141 6.307 6.307 7.549 -1.242 19700 1393 1 8 . 1 1 142 142 CYS N N 142 117.908 117.908 119.406 -1.498 19700 1394 1 8 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.814 0.942 19700 1395 1 8 . 1 1 142 142 CYS H H 142 8.184 8.184 8.630 -0.446 19700 1396 1 8 . 1 1 143 143 ALA N N 143 121.268 121.268 123.093 -1.825 19700 1397 1 8 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.965 -0.170 19700 1398 1 8 . 1 1 143 143 ALA H H 143 9.508 9.508 8.645 0.863 19700 1399 1 8 . 1 1 144 144 ASP N N 144 118.068 118.068 117.929 0.139 19700 1400 1 8 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.661 0.231 19700 1401 1 8 . 1 1 144 144 ASP H H 144 9.030 9.030 8.840 0.190 19700 1402 1 8 . 1 1 145 145 THR N N 145 108.476 108.476 108.395 0.081 19700 1403 1 8 . 1 1 145 145 THR HA H 145 4.422 4.422 4.377 0.045 19700 1404 1 8 . 1 1 145 145 THR H H 145 7.401 7.401 7.441 -0.040 19700 1405 1 8 . 1 1 146 146 CYS N N 146 123.516 123.516 123.139 0.377 19700 1406 1 8 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.346 0.367 19700 1407 1 8 . 1 1 146 146 CYS H H 146 8.850 8.850 8.551 0.299 19700 1408 1 8 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.456 -0.200 19700 1409 1 8 . 1 1 148 148 VAL N N 148 118.686 118.686 120.841 -2.155 19700 1410 1 8 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.086 0.000 19700 1411 1 8 . 1 1 148 148 VAL H H 148 7.857 7.857 8.136 -0.279 19700 1412 1 8 . 1 1 149 149 GLY N N 149 113.423 113.423 111.002 2.421 19700 1413 1 8 . 1 1 149 149 GLY H H 149 8.357 8.357 8.140 0.217 19700 1414 1 8 . 1 1 150 150 LYS N N 150 121.492 121.492 121.002 0.490 19700 1415 1 8 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.513 0.114 19700 1416 1 8 . 1 1 150 150 LYS H H 150 8.574 8.574 8.587 -0.013 19700 1417 1 8 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.375 -0.033 19700 1418 1 8 . 1 1 152 152 TYR N N 152 111.257 111.257 117.900 -6.643 19700 1419 1 8 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.566 -0.042 19700 1420 1 8 . 1 1 152 152 TYR H H 152 7.127 7.127 7.816 -0.689 19700 1421 1 8 . 1 1 153 153 GLU N N 153 119.670 119.670 117.438 2.232 19700 1422 1 8 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.361 0.046 19700 1423 1 8 . 1 1 153 153 GLU H H 153 7.603 7.603 7.591 0.012 19700 1424 1 8 . 1 1 154 154 MET N N 154 117.748 117.748 116.055 1.693 19700 1425 1 8 . 1 1 154 154 MET HA H 154 4.335 4.335 4.074 0.261 19700 1426 1 8 . 1 1 154 154 MET H H 154 8.052 8.052 7.447 0.605 19700 1427 1 8 . 1 1 155 155 ILE N N 155 121.057 121.057 119.141 1.916 19700 1428 1 8 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.074 0.470 19700 1429 1 8 . 1 1 155 155 ILE H H 155 8.393 8.393 8.281 0.112 19700 1430 1 8 . 1 1 156 156 GLU N N 156 127.999 127.999 129.202 -1.203 19700 1431 1 8 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.636 0.236 19700 1432 1 8 . 1 1 156 156 GLU H H 156 8.994 8.994 8.340 0.654 19700 1433 1 8 . 1 1 157 157 CYS N N 157 123.034 123.034 121.915 1.119 19700 1434 1 8 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.651 -0.133 19700 1435 1 8 . 1 1 157 157 CYS H H 157 9.029 9.029 8.630 0.399 19700 1436 1 8 . 1 1 158 158 CYS N N 158 119.670 119.670 119.914 -0.244 19700 1437 1 8 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.956 0.215 19700 1438 1 8 . 1 1 158 158 CYS H H 158 9.344 9.344 9.089 0.255 19700 1439 1 8 . 1 1 159 159 SER N N 159 114.684 114.684 116.768 -2.084 19700 1440 1 8 . 1 1 159 159 SER HA H 159 5.112 5.112 4.766 0.346 19700 1441 1 8 . 1 1 159 159 SER H H 159 9.064 9.064 8.542 0.522 19700 1442 1 8 . 1 1 160 160 THR N N 160 111.828 111.828 113.908 -2.080 19700 1443 1 8 . 1 1 160 160 THR HA H 160 4.784 4.784 4.504 0.280 19700 1444 1 8 . 1 1 160 160 THR H H 160 7.626 7.626 7.547 0.079 19700 1445 1 8 . 1 1 161 161 ASP N N 161 118.279 118.279 123.163 -4.884 19700 1446 1 8 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.183 0.673 19700 1447 1 8 . 1 1 161 161 ASP H H 161 8.332 8.332 8.499 -0.167 19700 1448 1 8 . 1 1 162 162 LYS N N 162 116.091 116.091 117.334 -1.243 19700 1449 1 8 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.703 -0.251 19700 1450 1 8 . 1 1 162 162 LYS H H 162 9.460 9.460 8.320 1.140 19700 1451 1 8 . 1 1 163 163 CYS N N 163 111.859 111.859 115.755 -3.896 19700 1452 1 8 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.152 0.264 19700 1453 1 8 . 1 1 163 163 CYS H H 163 7.751 7.751 8.435 -0.684 19700 1454 1 8 . 1 1 164 164 ASN N N 164 122.713 122.713 117.740 4.973 19700 1455 1 8 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.559 0.125 19700 1456 1 8 . 1 1 164 164 ASN H H 164 9.396 9.396 8.200 1.196 19700 1457 1 9 . 1 1 101 101 LEU N N 101 128.488 128.488 121.722 6.766 19700 1458 1 9 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.849 -0.127 19700 1459 1 9 . 1 1 101 101 LEU H H 101 8.706 8.706 8.431 0.275 19700 1460 1 9 . 1 1 102 102 THR N N 102 117.086 117.086 119.873 -2.787 19700 1461 1 9 . 1 1 102 102 THR HA H 102 5.198 5.198 4.985 0.213 19700 1462 1 9 . 1 1 102 102 THR H H 102 7.729 7.729 8.375 -0.646 19700 1463 1 9 . 1 1 103 103 CYS N N 103 119.021 119.021 124.769 -5.748 19700 1464 1 9 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.800 0.328 19700 1465 1 9 . 1 1 103 103 CYS H H 103 8.514 8.514 9.330 -0.816 19700 1466 1 9 . 1 1 104 104 LEU N N 104 123.028 123.028 121.840 1.188 19700 1467 1 9 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.582 0.229 19700 1468 1 9 . 1 1 104 104 LEU H H 104 9.147 9.147 8.448 0.699 19700 1469 1 9 . 1 1 105 105 ASN N N 105 119.029 119.029 116.359 2.670 19700 1470 1 9 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.034 -0.228 19700 1471 1 9 . 1 1 105 105 ASN H H 105 8.611 8.611 8.730 -0.119 19700 1472 1 9 . 1 1 106 106 CYS N N 106 117.427 117.427 115.991 1.436 19700 1473 1 9 . 1 1 106 106 CYS HA H 106 5.227 5.227 5.005 0.222 19700 1474 1 9 . 1 1 106 106 CYS H H 106 7.210 7.210 7.943 -0.733 19700 1475 1 9 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.678 0.386 19700 1476 1 9 . 1 1 108 108 GLU N N 108 119.996 119.996 117.609 2.387 19700 1477 1 9 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.351 0.225 19700 1478 1 9 . 1 1 108 108 GLU H H 108 7.777 7.777 8.195 -0.418 19700 1479 1 9 . 1 1 109 109 MET N N 109 121.587 121.587 122.077 -0.490 19700 1480 1 9 . 1 1 109 109 MET HA H 109 3.879 3.879 4.151 -0.272 19700 1481 1 9 . 1 1 109 109 MET H H 109 8.954 8.954 8.508 0.446 19700 1482 1 9 . 1 1 110 110 PHE N N 110 114.224 114.224 117.641 -3.417 19700 1483 1 9 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.701 0.246 19700 1484 1 9 . 1 1 110 110 PHE H H 110 7.943 7.943 8.167 -0.224 19700 1485 1 9 . 1 1 111 111 CYS N N 111 117.718 117.718 117.284 0.434 19700 1486 1 9 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.897 -0.044 19700 1487 1 9 . 1 1 111 111 CYS H H 111 8.141 8.141 7.773 0.368 19700 1488 1 9 . 1 1 112 112 GLY N N 112 106.232 106.232 107.737 -1.505 19700 1489 1 9 . 1 1 112 112 GLY H H 112 8.738 8.738 8.685 0.053 19700 1490 1 9 . 1 1 113 113 LYS N N 113 123.354 123.354 123.724 -0.370 19700 1491 1 9 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.647 -0.256 19700 1492 1 9 . 1 1 113 113 LYS H H 113 7.064 7.064 7.737 -0.673 19700 1493 1 9 . 1 1 114 114 PHE N N 114 117.507 117.507 120.950 -3.443 19700 1494 1 9 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.538 -0.194 19700 1495 1 9 . 1 1 114 114 PHE H H 114 7.823 7.823 7.992 -0.169 19700 1496 1 9 . 1 1 115 115 GLN N N 115 117.426 117.426 117.966 -0.540 19700 1497 1 9 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.613 0.175 19700 1498 1 9 . 1 1 115 115 GLN H H 115 9.044 9.044 9.170 -0.126 19700 1499 1 9 . 1 1 116 116 ILE N N 116 124.941 124.941 123.361 1.580 19700 1500 1 9 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.629 -0.262 19700 1501 1 9 . 1 1 116 116 ILE H H 116 8.705 8.705 8.443 0.262 19700 1502 1 9 . 1 1 117 117 CYS N N 117 127.674 127.674 127.578 0.096 19700 1503 1 9 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.593 0.255 19700 1504 1 9 . 1 1 117 117 CYS H H 117 9.103 9.103 8.896 0.207 19700 1505 1 9 . 1 1 118 118 ARG N N 118 120.976 120.976 123.639 -2.663 19700 1506 1 9 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.504 0.008 19700 1507 1 9 . 1 1 118 118 ARG H H 118 8.396 8.396 8.519 -0.123 19700 1508 1 9 . 1 1 119 119 ASN N N 119 119.240 119.240 118.127 1.113 19700 1509 1 9 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.483 0.077 19700 1510 1 9 . 1 1 119 119 ASN H H 119 8.836 8.836 8.333 0.503 19700 1511 1 9 . 1 1 120 120 GLY N N 120 111.230 111.230 111.545 -0.315 19700 1512 1 9 . 1 1 120 120 GLY H H 120 8.755 8.755 8.495 0.260 19700 1513 1 9 . 1 1 121 121 GLU N N 121 119.650 119.650 119.580 0.070 19700 1514 1 9 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.673 -0.423 19700 1515 1 9 . 1 1 121 121 GLU H H 121 8.158 8.158 7.661 0.497 19700 1516 1 9 . 1 1 122 122 LYS N N 122 120.471 120.471 121.112 -0.641 19700 1517 1 9 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.444 0.115 19700 1518 1 9 . 1 1 122 122 LYS H H 122 7.622 7.622 8.505 -0.883 19700 1519 1 9 . 1 1 123 123 ILE N N 123 118.223 118.223 119.340 -1.117 19700 1520 1 9 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.302 0.454 19700 1521 1 9 . 1 1 123 123 ILE H H 123 8.142 8.142 7.738 0.404 19700 1522 1 9 . 1 1 124 124 CYS N N 124 118.872 118.872 122.586 -3.714 19700 1523 1 9 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.513 0.472 19700 1524 1 9 . 1 1 124 124 CYS H H 124 9.196 9.196 9.094 0.102 19700 1525 1 9 . 1 1 125 125 PHE N N 125 116.458 116.458 114.963 1.495 19700 1526 1 9 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.658 0.659 19700 1527 1 9 . 1 1 125 125 PHE H H 125 8.958 8.958 8.553 0.405 19700 1528 1 9 . 1 1 126 126 LYS N N 126 125.559 125.559 122.490 3.069 19700 1529 1 9 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.830 0.321 19700 1530 1 9 . 1 1 126 126 LYS H H 126 9.109 9.109 8.704 0.405 19700 1531 1 9 . 1 1 127 127 LYS N N 127 124.796 124.796 128.872 -4.076 19700 1532 1 9 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.339 -0.122 19700 1533 1 9 . 1 1 127 127 LYS H H 127 9.498 9.498 8.257 1.241 19700 1534 1 9 . 1 1 128 128 LEU N N 128 126.430 126.430 127.470 -1.040 19700 1535 1 9 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.098 1.343 19700 1536 1 9 . 1 1 128 128 LEU H H 128 9.105 9.105 8.802 0.303 19700 1537 1 9 . 1 1 129 129 HIS N N 129 124.315 124.315 125.432 -1.117 19700 1538 1 9 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.715 0.215 19700 1539 1 9 . 1 1 129 129 HIS H H 129 9.123 9.123 8.548 0.575 19700 1540 1 9 . 1 1 130 130 GLN N N 130 120.311 120.311 116.706 3.605 19700 1541 1 9 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.459 -0.075 19700 1542 1 9 . 1 1 130 130 GLN H H 130 8.246 8.246 7.525 0.721 19700 1543 1 9 . 1 1 131 131 ARG N N 131 123.995 123.995 122.593 1.402 19700 1544 1 9 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.540 -0.250 19700 1545 1 9 . 1 1 131 131 ARG H H 131 8.510 8.510 8.769 -0.259 19700 1546 1 9 . 1 1 132 132 ARG N N 132 121.592 121.592 120.631 0.961 19700 1547 1 9 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.375 -0.067 19700 1548 1 9 . 1 1 132 132 ARG H H 132 8.183 8.183 7.810 0.373 19700 1549 1 9 . 1 1 133 133 ALA N N 133 124.315 124.315 122.228 2.087 19700 1550 1 9 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.465 -0.229 19700 1551 1 9 . 1 1 133 133 ALA H H 133 8.249 8.249 7.385 0.864 19700 1552 1 9 . 1 1 134 134 LEU N N 134 119.576 119.576 121.036 -1.460 19700 1553 1 9 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.030 0.235 19700 1554 1 9 . 1 1 134 134 LEU H H 134 8.146 8.146 8.420 -0.274 19700 1555 1 9 . 1 1 135 135 SER N N 135 113.103 113.103 112.357 0.746 19700 1556 1 9 . 1 1 135 135 SER HA H 135 4.504 4.504 4.459 0.045 19700 1557 1 9 . 1 1 135 135 SER H H 135 7.980 7.980 7.541 0.439 19700 1558 1 9 . 1 1 136 136 TRP N N 136 123.354 123.354 122.865 0.489 19700 1559 1 9 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.689 0.164 19700 1560 1 9 . 1 1 136 136 TRP H H 136 8.027 8.027 8.655 -0.628 19700 1561 1 9 . 1 1 137 137 ARG N N 137 120.614 120.614 122.409 -1.795 19700 1562 1 9 . 1 1 137 137 ARG HA H 137 4.674 4.674 5.063 -0.389 19700 1563 1 9 . 1 1 137 137 ARG H H 137 7.991 7.991 8.625 -0.634 19700 1564 1 9 . 1 1 138 138 TYR N N 138 119.354 119.354 123.616 -4.262 19700 1565 1 9 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.003 0.411 19700 1566 1 9 . 1 1 138 138 TYR H H 138 9.191 9.191 9.370 -0.179 19700 1567 1 9 . 1 1 139 139 ILE N N 139 119.510 119.510 121.198 -1.688 19700 1568 1 9 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.344 -0.026 19700 1569 1 9 . 1 1 139 139 ILE H H 139 9.104 9.104 8.585 0.519 19700 1570 1 9 . 1 1 140 140 ARG N N 140 125.596 125.596 125.920 -0.324 19700 1571 1 9 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.068 -0.252 19700 1572 1 9 . 1 1 140 140 ARG H H 140 8.393 8.393 8.625 -0.232 19700 1573 1 9 . 1 1 141 141 GLY N N 141 103.964 103.964 109.719 -5.755 19700 1574 1 9 . 1 1 141 141 GLY H H 141 6.307 6.307 7.445 -1.138 19700 1575 1 9 . 1 1 142 142 CYS N N 142 117.908 117.908 119.643 -1.735 19700 1576 1 9 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.966 0.790 19700 1577 1 9 . 1 1 142 142 CYS H H 142 8.184 8.184 8.615 -0.431 19700 1578 1 9 . 1 1 143 143 ALA N N 143 121.268 121.268 123.798 -2.530 19700 1579 1 9 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.982 -0.187 19700 1580 1 9 . 1 1 143 143 ALA H H 143 9.508 9.508 8.732 0.776 19700 1581 1 9 . 1 1 144 144 ASP N N 144 118.068 118.068 118.787 -0.719 19700 1582 1 9 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.643 0.249 19700 1583 1 9 . 1 1 144 144 ASP H H 144 9.030 9.030 8.702 0.328 19700 1584 1 9 . 1 1 145 145 THR N N 145 108.476 108.476 108.308 0.168 19700 1585 1 9 . 1 1 145 145 THR HA H 145 4.422 4.422 4.357 0.065 19700 1586 1 9 . 1 1 145 145 THR H H 145 7.401 7.401 7.452 -0.051 19700 1587 1 9 . 1 1 146 146 CYS N N 146 123.516 123.516 123.070 0.446 19700 1588 1 9 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.372 0.341 19700 1589 1 9 . 1 1 146 146 CYS H H 146 8.850 8.850 8.546 0.304 19700 1590 1 9 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.388 -0.132 19700 1591 1 9 . 1 1 148 148 VAL N N 148 118.686 118.686 122.795 -4.109 19700 1592 1 9 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.949 0.137 19700 1593 1 9 . 1 1 148 148 VAL H H 148 7.857 7.857 8.225 -0.368 19700 1594 1 9 . 1 1 149 149 GLY N N 149 113.423 113.423 113.766 -0.343 19700 1595 1 9 . 1 1 149 149 GLY H H 149 8.357 8.357 8.161 0.196 19700 1596 1 9 . 1 1 150 150 LYS N N 150 121.492 121.492 121.337 0.155 19700 1597 1 9 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.715 -0.088 19700 1598 1 9 . 1 1 150 150 LYS H H 150 8.574 8.574 8.237 0.337 19700 1599 1 9 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.487 -0.145 19700 1600 1 9 . 1 1 152 152 TYR N N 152 111.257 111.257 120.011 -8.754 19700 1601 1 9 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.395 0.129 19700 1602 1 9 . 1 1 152 152 TYR H H 152 7.127 7.127 8.069 -0.942 19700 1603 1 9 . 1 1 153 153 GLU N N 153 119.670 119.670 116.068 3.602 19700 1604 1 9 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.290 0.117 19700 1605 1 9 . 1 1 153 153 GLU H H 153 7.603 7.603 8.471 -0.868 19700 1606 1 9 . 1 1 154 154 MET N N 154 117.748 117.748 115.685 2.063 19700 1607 1 9 . 1 1 154 154 MET HA H 154 4.335 4.335 4.047 0.288 19700 1608 1 9 . 1 1 154 154 MET H H 154 8.052 8.052 7.467 0.585 19700 1609 1 9 . 1 1 155 155 ILE N N 155 121.057 121.057 120.211 0.846 19700 1610 1 9 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.231 0.313 19700 1611 1 9 . 1 1 155 155 ILE H H 155 8.393 8.393 8.436 -0.043 19700 1612 1 9 . 1 1 156 156 GLU N N 156 127.999 127.999 128.854 -0.855 19700 1613 1 9 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.506 0.366 19700 1614 1 9 . 1 1 156 156 GLU H H 156 8.994 8.994 8.280 0.714 19700 1615 1 9 . 1 1 157 157 CYS N N 157 123.034 123.034 119.738 3.296 19700 1616 1 9 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.645 -0.127 19700 1617 1 9 . 1 1 157 157 CYS H H 157 9.029 9.029 8.545 0.484 19700 1618 1 9 . 1 1 158 158 CYS N N 158 119.670 119.670 120.606 -0.936 19700 1619 1 9 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.859 0.312 19700 1620 1 9 . 1 1 158 158 CYS H H 158 9.344 9.344 9.046 0.298 19700 1621 1 9 . 1 1 159 159 SER N N 159 114.684 114.684 115.294 -0.610 19700 1622 1 9 . 1 1 159 159 SER HA H 159 5.112 5.112 4.749 0.363 19700 1623 1 9 . 1 1 159 159 SER H H 159 9.064 9.064 8.454 0.610 19700 1624 1 9 . 1 1 160 160 THR N N 160 111.828 111.828 112.754 -0.926 19700 1625 1 9 . 1 1 160 160 THR HA H 160 4.784 4.784 4.519 0.265 19700 1626 1 9 . 1 1 160 160 THR H H 160 7.626 7.626 7.668 -0.042 19700 1627 1 9 . 1 1 161 161 ASP N N 161 118.279 118.279 123.064 -4.785 19700 1628 1 9 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.333 0.523 19700 1629 1 9 . 1 1 161 161 ASP H H 161 8.332 8.332 8.480 -0.148 19700 1630 1 9 . 1 1 162 162 LYS N N 162 116.091 116.091 117.280 -1.189 19700 1631 1 9 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.694 -0.242 19700 1632 1 9 . 1 1 162 162 LYS H H 162 9.460 9.460 8.466 0.994 19700 1633 1 9 . 1 1 163 163 CYS N N 163 111.859 111.859 115.541 -3.682 19700 1634 1 9 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.210 0.206 19700 1635 1 9 . 1 1 163 163 CYS H H 163 7.751 7.751 8.389 -0.638 19700 1636 1 9 . 1 1 164 164 ASN N N 164 122.713 122.713 118.535 4.178 19700 1637 1 9 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.565 0.119 19700 1638 1 9 . 1 1 164 164 ASN H H 164 9.396 9.396 8.233 1.163 19700 1639 1 10 . 1 1 101 101 LEU N N 101 128.488 128.488 123.160 5.328 19700 1640 1 10 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.866 -0.144 19700 1641 1 10 . 1 1 101 101 LEU H H 101 8.706 8.706 8.569 0.137 19700 1642 1 10 . 1 1 102 102 THR N N 102 117.086 117.086 119.652 -2.566 19700 1643 1 10 . 1 1 102 102 THR HA H 102 5.198 5.198 4.955 0.243 19700 1644 1 10 . 1 1 102 102 THR H H 102 7.729 7.729 8.459 -0.730 19700 1645 1 10 . 1 1 103 103 CYS N N 103 119.021 119.021 124.835 -5.814 19700 1646 1 10 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.807 0.321 19700 1647 1 10 . 1 1 103 103 CYS H H 103 8.514 8.514 9.352 -0.838 19700 1648 1 10 . 1 1 104 104 LEU N N 104 123.028 123.028 121.856 1.172 19700 1649 1 10 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.472 0.339 19700 1650 1 10 . 1 1 104 104 LEU H H 104 9.147 9.147 8.286 0.861 19700 1651 1 10 . 1 1 105 105 ASN N N 105 119.029 119.029 116.345 2.684 19700 1652 1 10 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.971 -0.166 19700 1653 1 10 . 1 1 105 105 ASN H H 105 8.611 8.611 8.680 -0.069 19700 1654 1 10 . 1 1 106 106 CYS N N 106 117.427 117.427 114.828 2.599 19700 1655 1 10 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.930 0.297 19700 1656 1 10 . 1 1 106 106 CYS H H 106 7.210 7.210 7.958 -0.748 19700 1657 1 10 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.581 0.483 19700 1658 1 10 . 1 1 108 108 GLU N N 108 119.996 119.996 118.211 1.785 19700 1659 1 10 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.267 0.309 19700 1660 1 10 . 1 1 108 108 GLU H H 108 7.777 7.777 8.236 -0.459 19700 1661 1 10 . 1 1 109 109 MET N N 109 121.587 121.587 121.015 0.572 19700 1662 1 10 . 1 1 109 109 MET HA H 109 3.879 3.879 4.087 -0.208 19700 1663 1 10 . 1 1 109 109 MET H H 109 8.954 8.954 8.569 0.385 19700 1664 1 10 . 1 1 110 110 PHE N N 110 114.224 114.224 120.060 -5.836 19700 1665 1 10 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.604 0.343 19700 1666 1 10 . 1 1 110 110 PHE H H 110 7.943 7.943 8.097 -0.154 19700 1667 1 10 . 1 1 111 111 CYS N N 111 117.718 117.718 117.654 0.064 19700 1668 1 10 . 1 1 111 111 CYS HA H 111 4.853 4.853 5.029 -0.176 19700 1669 1 10 . 1 1 111 111 CYS H H 111 8.141 8.141 7.871 0.270 19700 1670 1 10 . 1 1 112 112 GLY N N 112 106.232 106.232 105.510 0.722 19700 1671 1 10 . 1 1 112 112 GLY H H 112 8.738 8.738 8.546 0.192 19700 1672 1 10 . 1 1 113 113 LYS N N 113 123.354 123.354 123.711 -0.357 19700 1673 1 10 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.668 -0.277 19700 1674 1 10 . 1 1 113 113 LYS H H 113 7.064 7.064 7.723 -0.659 19700 1675 1 10 . 1 1 114 114 PHE N N 114 117.507 117.507 120.322 -2.815 19700 1676 1 10 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.058 0.286 19700 1677 1 10 . 1 1 114 114 PHE H H 114 7.823 7.823 8.159 -0.336 19700 1678 1 10 . 1 1 115 115 GLN N N 115 117.426 117.426 117.974 -0.548 19700 1679 1 10 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.607 0.181 19700 1680 1 10 . 1 1 115 115 GLN H H 115 9.044 9.044 9.244 -0.200 19700 1681 1 10 . 1 1 116 116 ILE N N 116 124.941 124.941 123.139 1.802 19700 1682 1 10 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.561 -0.195 19700 1683 1 10 . 1 1 116 116 ILE H H 116 8.705 8.705 8.418 0.287 19700 1684 1 10 . 1 1 117 117 CYS N N 117 127.674 127.674 127.579 0.095 19700 1685 1 10 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.588 0.260 19700 1686 1 10 . 1 1 117 117 CYS H H 117 9.103 9.103 8.969 0.134 19700 1687 1 10 . 1 1 118 118 ARG N N 118 120.976 120.976 123.776 -2.800 19700 1688 1 10 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.560 -0.048 19700 1689 1 10 . 1 1 118 118 ARG H H 118 8.396 8.396 8.566 -0.170 19700 1690 1 10 . 1 1 119 119 ASN N N 119 119.240 119.240 118.586 0.654 19700 1691 1 10 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.486 0.074 19700 1692 1 10 . 1 1 119 119 ASN H H 119 8.836 8.836 8.480 0.356 19700 1693 1 10 . 1 1 120 120 GLY N N 120 111.230 111.230 109.401 1.829 19700 1694 1 10 . 1 1 120 120 GLY H H 120 8.755 8.755 8.615 0.140 19700 1695 1 10 . 1 1 121 121 GLU N N 121 119.650 119.650 119.993 -0.343 19700 1696 1 10 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.678 -0.428 19700 1697 1 10 . 1 1 121 121 GLU H H 121 8.158 8.158 7.640 0.518 19700 1698 1 10 . 1 1 122 122 LYS N N 122 120.471 120.471 121.550 -1.079 19700 1699 1 10 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.347 0.212 19700 1700 1 10 . 1 1 122 122 LYS H H 122 7.622 7.622 8.457 -0.835 19700 1701 1 10 . 1 1 123 123 ILE N N 123 118.223 118.223 113.529 4.694 19700 1702 1 10 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.693 0.063 19700 1703 1 10 . 1 1 123 123 ILE H H 123 8.142 8.142 7.532 0.610 19700 1704 1 10 . 1 1 124 124 CYS N N 124 118.872 118.872 120.336 -1.464 19700 1705 1 10 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.497 0.488 19700 1706 1 10 . 1 1 124 124 CYS H H 124 9.196 9.196 8.710 0.486 19700 1707 1 10 . 1 1 125 125 PHE N N 125 116.458 116.458 114.801 1.657 19700 1708 1 10 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.758 0.559 19700 1709 1 10 . 1 1 125 125 PHE H H 125 8.958 8.958 9.023 -0.065 19700 1710 1 10 . 1 1 126 126 LYS N N 126 125.559 125.559 123.422 2.137 19700 1711 1 10 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.975 0.176 19700 1712 1 10 . 1 1 126 126 LYS H H 126 9.109 9.109 8.953 0.156 19700 1713 1 10 . 1 1 127 127 LYS N N 127 124.796 124.796 124.508 0.288 19700 1714 1 10 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.444 -0.227 19700 1715 1 10 . 1 1 127 127 LYS H H 127 9.498 9.498 8.420 1.078 19700 1716 1 10 . 1 1 128 128 LEU N N 128 126.430 126.430 120.124 6.306 19700 1717 1 10 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.363 1.078 19700 1718 1 10 . 1 1 128 128 LEU H H 128 9.105 9.105 8.506 0.599 19700 1719 1 10 . 1 1 129 129 HIS N N 129 124.315 124.315 124.584 -0.269 19700 1720 1 10 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.620 0.310 19700 1721 1 10 . 1 1 129 129 HIS H H 129 9.123 9.123 8.696 0.427 19700 1722 1 10 . 1 1 130 130 GLN N N 130 120.311 120.311 114.935 5.376 19700 1723 1 10 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.377 0.007 19700 1724 1 10 . 1 1 130 130 GLN H H 130 8.246 8.246 7.596 0.650 19700 1725 1 10 . 1 1 131 131 ARG N N 131 123.995 123.995 121.502 2.493 19700 1726 1 10 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.609 -0.319 19700 1727 1 10 . 1 1 131 131 ARG H H 131 8.510 8.510 8.802 -0.292 19700 1728 1 10 . 1 1 132 132 ARG N N 132 121.592 121.592 120.287 1.305 19700 1729 1 10 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.224 0.084 19700 1730 1 10 . 1 1 132 132 ARG H H 132 8.183 8.183 8.194 -0.011 19700 1731 1 10 . 1 1 133 133 ALA N N 133 124.315 124.315 121.805 2.510 19700 1732 1 10 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.161 0.075 19700 1733 1 10 . 1 1 133 133 ALA H H 133 8.249 8.249 7.584 0.665 19700 1734 1 10 . 1 1 134 134 LEU N N 134 119.576 119.576 117.620 1.956 19700 1735 1 10 . 1 1 134 134 LEU HA H 134 4.265 4.265 3.510 0.755 19700 1736 1 10 . 1 1 134 134 LEU H H 134 8.146 8.146 8.095 0.051 19700 1737 1 10 . 1 1 135 135 SER N N 135 113.103 113.103 113.934 -0.831 19700 1738 1 10 . 1 1 135 135 SER HA H 135 4.504 4.504 4.030 0.474 19700 1739 1 10 . 1 1 135 135 SER H H 135 7.980 7.980 7.562 0.418 19700 1740 1 10 . 1 1 136 136 TRP N N 136 123.354 123.354 123.076 0.278 19700 1741 1 10 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.636 0.217 19700 1742 1 10 . 1 1 136 136 TRP H H 136 8.027 8.027 7.384 0.643 19700 1743 1 10 . 1 1 137 137 ARG N N 137 120.614 120.614 117.783 2.831 19700 1744 1 10 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.437 0.237 19700 1745 1 10 . 1 1 137 137 ARG H H 137 7.991 7.991 7.824 0.167 19700 1746 1 10 . 1 1 138 138 TYR N N 138 119.354 119.354 116.189 3.165 19700 1747 1 10 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.083 0.331 19700 1748 1 10 . 1 1 138 138 TYR H H 138 9.191 9.191 7.872 1.319 19700 1749 1 10 . 1 1 139 139 ILE N N 139 119.510 119.510 123.111 -3.601 19700 1750 1 10 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.348 -0.030 19700 1751 1 10 . 1 1 139 139 ILE H H 139 9.104 9.104 9.044 0.060 19700 1752 1 10 . 1 1 140 140 ARG N N 140 125.596 125.596 126.277 -0.681 19700 1753 1 10 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.095 -0.279 19700 1754 1 10 . 1 1 140 140 ARG H H 140 8.393 8.393 8.338 0.055 19700 1755 1 10 . 1 1 141 141 GLY N N 141 103.964 103.964 109.536 -5.572 19700 1756 1 10 . 1 1 141 141 GLY H H 141 6.307 6.307 7.634 -1.327 19700 1757 1 10 . 1 1 142 142 CYS N N 142 117.908 117.908 119.682 -1.774 19700 1758 1 10 . 1 1 142 142 CYS HA H 142 5.756 5.756 5.004 0.752 19700 1759 1 10 . 1 1 142 142 CYS H H 142 8.184 8.184 8.658 -0.474 19700 1760 1 10 . 1 1 143 143 ALA N N 143 121.268 121.268 122.924 -1.656 19700 1761 1 10 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.830 -0.035 19700 1762 1 10 . 1 1 143 143 ALA H H 143 9.508 9.508 8.845 0.663 19700 1763 1 10 . 1 1 144 144 ASP N N 144 118.068 118.068 118.780 -0.712 19700 1764 1 10 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.625 0.267 19700 1765 1 10 . 1 1 144 144 ASP H H 144 9.030 9.030 8.668 0.362 19700 1766 1 10 . 1 1 145 145 THR N N 145 108.476 108.476 110.524 -2.048 19700 1767 1 10 . 1 1 145 145 THR HA H 145 4.422 4.422 4.399 0.023 19700 1768 1 10 . 1 1 145 145 THR H H 145 7.401 7.401 7.637 -0.236 19700 1769 1 10 . 1 1 146 146 CYS N N 146 123.516 123.516 124.203 -0.687 19700 1770 1 10 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.433 0.280 19700 1771 1 10 . 1 1 146 146 CYS H H 146 8.850 8.850 8.658 0.192 19700 1772 1 10 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.416 -0.160 19700 1773 1 10 . 1 1 148 148 VAL N N 148 118.686 118.686 122.238 -3.552 19700 1774 1 10 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.041 0.045 19700 1775 1 10 . 1 1 148 148 VAL H H 148 7.857 7.857 8.130 -0.273 19700 1776 1 10 . 1 1 149 149 GLY N N 149 113.423 113.423 112.093 1.330 19700 1777 1 10 . 1 1 149 149 GLY H H 149 8.357 8.357 8.155 0.202 19700 1778 1 10 . 1 1 150 150 LYS N N 150 121.492 121.492 120.430 1.062 19700 1779 1 10 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.461 0.166 19700 1780 1 10 . 1 1 150 150 LYS H H 150 8.574 8.574 8.223 0.351 19700 1781 1 10 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.352 -0.010 19700 1782 1 10 . 1 1 152 152 TYR N N 152 111.257 111.257 115.157 -3.900 19700 1783 1 10 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.781 -0.257 19700 1784 1 10 . 1 1 152 152 TYR H H 152 7.127 7.127 8.034 -0.907 19700 1785 1 10 . 1 1 153 153 GLU N N 153 119.670 119.670 119.995 -0.325 19700 1786 1 10 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.352 0.055 19700 1787 1 10 . 1 1 153 153 GLU H H 153 7.603 7.603 7.365 0.238 19700 1788 1 10 . 1 1 154 154 MET N N 154 117.748 117.748 115.968 1.780 19700 1789 1 10 . 1 1 154 154 MET HA H 154 4.335 4.335 4.070 0.265 19700 1790 1 10 . 1 1 154 154 MET H H 154 8.052 8.052 7.382 0.670 19700 1791 1 10 . 1 1 155 155 ILE N N 155 121.057 121.057 118.886 2.171 19700 1792 1 10 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.064 0.480 19700 1793 1 10 . 1 1 155 155 ILE H H 155 8.393 8.393 8.226 0.167 19700 1794 1 10 . 1 1 156 156 GLU N N 156 127.999 127.999 129.452 -1.453 19700 1795 1 10 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.671 0.201 19700 1796 1 10 . 1 1 156 156 GLU H H 156 8.994 8.994 8.235 0.759 19700 1797 1 10 . 1 1 157 157 CYS N N 157 123.034 123.034 121.972 1.062 19700 1798 1 10 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.626 -0.108 19700 1799 1 10 . 1 1 157 157 CYS H H 157 9.029 9.029 8.619 0.410 19700 1800 1 10 . 1 1 158 158 CYS N N 158 119.670 119.670 119.472 0.198 19700 1801 1 10 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.696 0.475 19700 1802 1 10 . 1 1 158 158 CYS H H 158 9.344 9.344 8.906 0.438 19700 1803 1 10 . 1 1 159 159 SER N N 159 114.684 114.684 116.487 -1.803 19700 1804 1 10 . 1 1 159 159 SER HA H 159 5.112 5.112 4.768 0.344 19700 1805 1 10 . 1 1 159 159 SER H H 159 9.064 9.064 8.617 0.447 19700 1806 1 10 . 1 1 160 160 THR N N 160 111.828 111.828 113.353 -1.525 19700 1807 1 10 . 1 1 160 160 THR HA H 160 4.784 4.784 4.531 0.253 19700 1808 1 10 . 1 1 160 160 THR H H 160 7.626 7.626 7.537 0.089 19700 1809 1 10 . 1 1 161 161 ASP N N 161 118.279 118.279 122.995 -4.716 19700 1810 1 10 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.378 0.478 19700 1811 1 10 . 1 1 161 161 ASP H H 161 8.332 8.332 8.482 -0.150 19700 1812 1 10 . 1 1 162 162 LYS N N 162 116.091 116.091 117.322 -1.231 19700 1813 1 10 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.756 -0.304 19700 1814 1 10 . 1 1 162 162 LYS H H 162 9.460 9.460 8.529 0.931 19700 1815 1 10 . 1 1 163 163 CYS N N 163 111.859 111.859 116.113 -4.254 19700 1816 1 10 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.280 0.136 19700 1817 1 10 . 1 1 163 163 CYS H H 163 7.751 7.751 8.605 -0.854 19700 1818 1 10 . 1 1 164 164 ASN N N 164 122.713 122.713 116.723 5.990 19700 1819 1 10 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.573 0.111 19700 1820 1 10 . 1 1 164 164 ASN H H 164 9.396 9.396 8.420 0.976 19700 1821 1 11 . 1 1 101 101 LEU N N 101 128.488 128.488 122.614 5.874 19700 1822 1 11 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.823 -0.101 19700 1823 1 11 . 1 1 101 101 LEU H H 101 8.706 8.706 8.439 0.267 19700 1824 1 11 . 1 1 102 102 THR N N 102 117.086 117.086 120.020 -2.934 19700 1825 1 11 . 1 1 102 102 THR HA H 102 5.198 5.198 5.030 0.168 19700 1826 1 11 . 1 1 102 102 THR H H 102 7.729 7.729 8.332 -0.603 19700 1827 1 11 . 1 1 103 103 CYS N N 103 119.021 119.021 124.969 -5.948 19700 1828 1 11 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.783 0.345 19700 1829 1 11 . 1 1 103 103 CYS H H 103 8.514 8.514 8.890 -0.376 19700 1830 1 11 . 1 1 104 104 LEU N N 104 123.028 123.028 121.581 1.447 19700 1831 1 11 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.594 0.217 19700 1832 1 11 . 1 1 104 104 LEU H H 104 9.147 9.147 8.270 0.878 19700 1833 1 11 . 1 1 105 105 ASN N N 105 119.029 119.029 115.924 3.105 19700 1834 1 11 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.898 -0.092 19700 1835 1 11 . 1 1 105 105 ASN H H 105 8.611 8.611 8.644 -0.033 19700 1836 1 11 . 1 1 106 106 CYS N N 106 117.427 117.427 115.474 1.953 19700 1837 1 11 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.873 0.354 19700 1838 1 11 . 1 1 106 106 CYS H H 106 7.210 7.210 7.812 -0.602 19700 1839 1 11 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.659 0.405 19700 1840 1 11 . 1 1 108 108 GLU N N 108 119.996 119.996 118.144 1.852 19700 1841 1 11 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.316 0.260 19700 1842 1 11 . 1 1 108 108 GLU H H 108 7.777 7.777 8.254 -0.477 19700 1843 1 11 . 1 1 109 109 MET N N 109 121.587 121.587 120.076 1.511 19700 1844 1 11 . 1 1 109 109 MET HA H 109 3.879 3.879 4.220 -0.341 19700 1845 1 11 . 1 1 109 109 MET H H 109 8.954 8.954 8.742 0.212 19700 1846 1 11 . 1 1 110 110 PHE N N 110 114.224 114.224 120.134 -5.910 19700 1847 1 11 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.567 0.380 19700 1848 1 11 . 1 1 110 110 PHE H H 110 7.943 7.943 8.623 -0.680 19700 1849 1 11 . 1 1 111 111 CYS N N 111 117.718 117.718 117.865 -0.147 19700 1850 1 11 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.814 0.039 19700 1851 1 11 . 1 1 111 111 CYS H H 111 8.141 8.141 7.682 0.459 19700 1852 1 11 . 1 1 112 112 GLY N N 112 106.232 106.232 107.596 -1.364 19700 1853 1 11 . 1 1 112 112 GLY H H 112 8.738 8.738 8.627 0.111 19700 1854 1 11 . 1 1 113 113 LYS N N 113 123.354 123.354 123.854 -0.500 19700 1855 1 11 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.667 -0.276 19700 1856 1 11 . 1 1 113 113 LYS H H 113 7.064 7.064 7.751 -0.687 19700 1857 1 11 . 1 1 114 114 PHE N N 114 117.507 117.507 120.854 -3.347 19700 1858 1 11 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.221 0.123 19700 1859 1 11 . 1 1 114 114 PHE H H 114 7.823 7.823 7.940 -0.117 19700 1860 1 11 . 1 1 115 115 GLN N N 115 117.426 117.426 117.815 -0.389 19700 1861 1 11 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.589 0.199 19700 1862 1 11 . 1 1 115 115 GLN H H 115 9.044 9.044 8.825 0.219 19700 1863 1 11 . 1 1 116 116 ILE N N 116 124.941 124.941 123.185 1.756 19700 1864 1 11 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.490 -0.123 19700 1865 1 11 . 1 1 116 116 ILE H H 116 8.705 8.705 8.413 0.292 19700 1866 1 11 . 1 1 117 117 CYS N N 117 127.674 127.674 127.665 0.009 19700 1867 1 11 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.614 0.234 19700 1868 1 11 . 1 1 117 117 CYS H H 117 9.103 9.103 9.024 0.079 19700 1869 1 11 . 1 1 118 118 ARG N N 118 120.976 120.976 123.910 -2.934 19700 1870 1 11 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.548 -0.036 19700 1871 1 11 . 1 1 118 118 ARG H H 118 8.396 8.396 8.559 -0.163 19700 1872 1 11 . 1 1 119 119 ASN N N 119 119.240 119.240 118.393 0.847 19700 1873 1 11 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.484 0.076 19700 1874 1 11 . 1 1 119 119 ASN H H 119 8.836 8.836 8.452 0.384 19700 1875 1 11 . 1 1 120 120 GLY N N 120 111.230 111.230 108.493 2.737 19700 1876 1 11 . 1 1 120 120 GLY H H 120 8.755 8.755 8.579 0.176 19700 1877 1 11 . 1 1 121 121 GLU N N 121 119.650 119.650 120.882 -1.232 19700 1878 1 11 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.709 -0.459 19700 1879 1 11 . 1 1 121 121 GLU H H 121 8.158 8.158 7.672 0.486 19700 1880 1 11 . 1 1 122 122 LYS N N 122 120.471 120.471 121.919 -1.448 19700 1881 1 11 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.538 0.021 19700 1882 1 11 . 1 1 122 122 LYS H H 122 7.622 7.622 8.419 -0.797 19700 1883 1 11 . 1 1 123 123 ILE N N 123 118.223 118.223 113.941 4.282 19700 1884 1 11 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.668 0.088 19700 1885 1 11 . 1 1 123 123 ILE H H 123 8.142 8.142 7.702 0.440 19700 1886 1 11 . 1 1 124 124 CYS N N 124 118.872 118.872 120.123 -1.251 19700 1887 1 11 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.573 0.412 19700 1888 1 11 . 1 1 124 124 CYS H H 124 9.196 9.196 8.820 0.376 19700 1889 1 11 . 1 1 125 125 PHE N N 125 116.458 116.458 114.804 1.654 19700 1890 1 11 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.587 0.730 19700 1891 1 11 . 1 1 125 125 PHE H H 125 8.958 8.958 8.955 0.003 19700 1892 1 11 . 1 1 126 126 LYS N N 126 125.559 125.559 122.110 3.449 19700 1893 1 11 . 1 1 126 126 LYS HA H 126 5.151 5.151 5.011 0.140 19700 1894 1 11 . 1 1 126 126 LYS H H 126 9.109 9.109 8.658 0.451 19700 1895 1 11 . 1 1 127 127 LYS N N 127 124.796 124.796 127.184 -2.388 19700 1896 1 11 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.446 -0.229 19700 1897 1 11 . 1 1 127 127 LYS H H 127 9.498 9.498 8.505 0.993 19700 1898 1 11 . 1 1 128 128 LEU N N 128 126.430 126.430 122.794 3.636 19700 1899 1 11 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.179 1.262 19700 1900 1 11 . 1 1 128 128 LEU H H 128 9.105 9.105 8.503 0.602 19700 1901 1 11 . 1 1 129 129 HIS N N 129 124.315 124.315 123.211 1.104 19700 1902 1 11 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.455 0.475 19700 1903 1 11 . 1 1 129 129 HIS H H 129 9.123 9.123 7.592 1.531 19700 1904 1 11 . 1 1 130 130 GLN N N 130 120.311 120.311 115.462 4.849 19700 1905 1 11 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.392 -0.008 19700 1906 1 11 . 1 1 130 130 GLN H H 130 8.246 8.246 7.862 0.384 19700 1907 1 11 . 1 1 131 131 ARG N N 131 123.995 123.995 122.812 1.183 19700 1908 1 11 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.680 -0.390 19700 1909 1 11 . 1 1 131 131 ARG H H 131 8.510 8.510 8.655 -0.145 19700 1910 1 11 . 1 1 132 132 ARG N N 132 121.592 121.592 119.566 2.026 19700 1911 1 11 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.314 -0.006 19700 1912 1 11 . 1 1 132 132 ARG H H 132 8.183 8.183 7.949 0.234 19700 1913 1 11 . 1 1 133 133 ALA N N 133 124.315 124.315 120.633 3.682 19700 1914 1 11 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.716 -0.480 19700 1915 1 11 . 1 1 133 133 ALA H H 133 8.249 8.249 7.251 0.998 19700 1916 1 11 . 1 1 134 134 LEU N N 134 119.576 119.576 118.493 1.083 19700 1917 1 11 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.260 0.005 19700 1918 1 11 . 1 1 134 134 LEU H H 134 8.146 8.146 8.292 -0.146 19700 1919 1 11 . 1 1 135 135 SER N N 135 113.103 113.103 114.356 -1.253 19700 1920 1 11 . 1 1 135 135 SER HA H 135 4.504 4.504 4.408 0.096 19700 1921 1 11 . 1 1 135 135 SER H H 135 7.980 7.980 7.822 0.158 19700 1922 1 11 . 1 1 136 136 TRP N N 136 123.354 123.354 126.283 -2.929 19700 1923 1 11 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.943 -0.090 19700 1924 1 11 . 1 1 136 136 TRP H H 136 8.027 8.027 8.373 -0.346 19700 1925 1 11 . 1 1 137 137 ARG N N 137 120.614 120.614 118.865 1.749 19700 1926 1 11 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.729 -0.055 19700 1927 1 11 . 1 1 137 137 ARG H H 137 7.991 7.991 8.057 -0.066 19700 1928 1 11 . 1 1 138 138 TYR N N 138 119.354 119.354 115.254 4.100 19700 1929 1 11 . 1 1 138 138 TYR HA H 138 5.414 5.414 4.823 0.591 19700 1930 1 11 . 1 1 138 138 TYR H H 138 9.191 9.191 7.784 1.407 19700 1931 1 11 . 1 1 139 139 ILE N N 139 119.510 119.510 122.830 -3.320 19700 1932 1 11 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.378 -0.060 19700 1933 1 11 . 1 1 139 139 ILE H H 139 9.104 9.104 8.999 0.105 19700 1934 1 11 . 1 1 140 140 ARG N N 140 125.596 125.596 126.352 -0.756 19700 1935 1 11 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.067 -0.251 19700 1936 1 11 . 1 1 140 140 ARG H H 140 8.393 8.393 8.370 0.023 19700 1937 1 11 . 1 1 141 141 GLY N N 141 103.964 103.964 109.891 -5.927 19700 1938 1 11 . 1 1 141 141 GLY H H 141 6.307 6.307 7.515 -1.208 19700 1939 1 11 . 1 1 142 142 CYS N N 142 117.908 117.908 119.628 -1.720 19700 1940 1 11 . 1 1 142 142 CYS HA H 142 5.756 5.756 5.504 0.252 19700 1941 1 11 . 1 1 142 142 CYS H H 142 8.184 8.184 8.571 -0.387 19700 1942 1 11 . 1 1 143 143 ALA N N 143 121.268 121.268 124.982 -3.714 19700 1943 1 11 . 1 1 143 143 ALA HA H 143 4.795 4.795 5.046 -0.251 19700 1944 1 11 . 1 1 143 143 ALA H H 143 9.508 9.508 9.039 0.469 19700 1945 1 11 . 1 1 144 144 ASP N N 144 118.068 118.068 118.865 -0.797 19700 1946 1 11 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.666 0.226 19700 1947 1 11 . 1 1 144 144 ASP H H 144 9.030 9.030 8.638 0.392 19700 1948 1 11 . 1 1 145 145 THR N N 145 108.476 108.476 109.207 -0.731 19700 1949 1 11 . 1 1 145 145 THR HA H 145 4.422 4.422 4.277 0.145 19700 1950 1 11 . 1 1 145 145 THR H H 145 7.401 7.401 7.566 -0.165 19700 1951 1 11 . 1 1 146 146 CYS N N 146 123.516 123.516 123.100 0.416 19700 1952 1 11 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.403 0.310 19700 1953 1 11 . 1 1 146 146 CYS H H 146 8.850 8.850 8.459 0.391 19700 1954 1 11 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.433 -0.177 19700 1955 1 11 . 1 1 148 148 VAL N N 148 118.686 118.686 120.392 -1.706 19700 1956 1 11 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.092 -0.006 19700 1957 1 11 . 1 1 148 148 VAL H H 148 7.857 7.857 8.188 -0.331 19700 1958 1 11 . 1 1 149 149 GLY N N 149 113.423 113.423 110.171 3.252 19700 1959 1 11 . 1 1 149 149 GLY H H 149 8.357 8.357 8.030 0.327 19700 1960 1 11 . 1 1 150 150 LYS N N 150 121.492 121.492 121.098 0.394 19700 1961 1 11 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.582 0.045 19700 1962 1 11 . 1 1 150 150 LYS H H 150 8.574 8.574 8.366 0.208 19700 1963 1 11 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.552 -0.210 19700 1964 1 11 . 1 1 152 152 TYR N N 152 111.257 111.257 119.400 -8.143 19700 1965 1 11 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.449 0.075 19700 1966 1 11 . 1 1 152 152 TYR H H 152 7.127 7.127 8.226 -1.099 19700 1967 1 11 . 1 1 153 153 GLU N N 153 119.670 119.670 117.278 2.392 19700 1968 1 11 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.313 0.094 19700 1969 1 11 . 1 1 153 153 GLU H H 153 7.603 7.603 7.786 -0.183 19700 1970 1 11 . 1 1 154 154 MET N N 154 117.748 117.748 116.818 0.930 19700 1971 1 11 . 1 1 154 154 MET HA H 154 4.335 4.335 4.055 0.280 19700 1972 1 11 . 1 1 154 154 MET H H 154 8.052 8.052 7.444 0.608 19700 1973 1 11 . 1 1 155 155 ILE N N 155 121.057 121.057 119.530 1.527 19700 1974 1 11 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.153 0.391 19700 1975 1 11 . 1 1 155 155 ILE H H 155 8.393 8.393 8.304 0.089 19700 1976 1 11 . 1 1 156 156 GLU N N 156 127.999 127.999 128.741 -0.742 19700 1977 1 11 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.526 0.346 19700 1978 1 11 . 1 1 156 156 GLU H H 156 8.994 8.994 8.297 0.697 19700 1979 1 11 . 1 1 157 157 CYS N N 157 123.034 123.034 119.792 3.242 19700 1980 1 11 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.690 -0.172 19700 1981 1 11 . 1 1 157 157 CYS H H 157 9.029 9.029 8.562 0.467 19700 1982 1 11 . 1 1 158 158 CYS N N 158 119.670 119.670 119.739 -0.069 19700 1983 1 11 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.927 0.244 19700 1984 1 11 . 1 1 158 158 CYS H H 158 9.344 9.344 9.140 0.204 19700 1985 1 11 . 1 1 159 159 SER N N 159 114.684 114.684 116.341 -1.657 19700 1986 1 11 . 1 1 159 159 SER HA H 159 5.112 5.112 4.747 0.365 19700 1987 1 11 . 1 1 159 159 SER H H 159 9.064 9.064 8.498 0.566 19700 1988 1 11 . 1 1 160 160 THR N N 160 111.828 111.828 112.609 -0.781 19700 1989 1 11 . 1 1 160 160 THR HA H 160 4.784 4.784 4.499 0.285 19700 1990 1 11 . 1 1 160 160 THR H H 160 7.626 7.626 7.455 0.171 19700 1991 1 11 . 1 1 161 161 ASP N N 161 118.279 118.279 123.262 -4.983 19700 1992 1 11 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.386 0.470 19700 1993 1 11 . 1 1 161 161 ASP H H 161 8.332 8.332 8.515 -0.183 19700 1994 1 11 . 1 1 162 162 LYS N N 162 116.091 116.091 118.155 -2.064 19700 1995 1 11 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.699 -0.247 19700 1996 1 11 . 1 1 162 162 LYS H H 162 9.460 9.460 8.576 0.884 19700 1997 1 11 . 1 1 163 163 CYS N N 163 111.859 111.859 114.966 -3.107 19700 1998 1 11 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.191 0.225 19700 1999 1 11 . 1 1 163 163 CYS H H 163 7.751 7.751 8.431 -0.680 19700 2000 1 11 . 1 1 164 164 ASN N N 164 122.713 122.713 117.303 5.410 19700 2001 1 11 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.566 0.118 19700 2002 1 11 . 1 1 164 164 ASN H H 164 9.396 9.396 8.145 1.251 19700 2003 1 12 . 1 1 101 101 LEU N N 101 128.488 128.488 123.054 5.434 19700 2004 1 12 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.892 -0.170 19700 2005 1 12 . 1 1 101 101 LEU H H 101 8.706 8.706 8.449 0.257 19700 2006 1 12 . 1 1 102 102 THR N N 102 117.086 117.086 119.844 -2.758 19700 2007 1 12 . 1 1 102 102 THR HA H 102 5.198 5.198 4.989 0.209 19700 2008 1 12 . 1 1 102 102 THR H H 102 7.729 7.729 8.439 -0.710 19700 2009 1 12 . 1 1 103 103 CYS N N 103 119.021 119.021 124.590 -5.569 19700 2010 1 12 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.817 0.311 19700 2011 1 12 . 1 1 103 103 CYS H H 103 8.514 8.514 9.419 -0.905 19700 2012 1 12 . 1 1 104 104 LEU N N 104 123.028 123.028 121.199 1.829 19700 2013 1 12 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.605 0.206 19700 2014 1 12 . 1 1 104 104 LEU H H 104 9.147 9.147 8.262 0.885 19700 2015 1 12 . 1 1 105 105 ASN N N 105 119.029 119.029 118.731 0.298 19700 2016 1 12 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.925 -0.119 19700 2017 1 12 . 1 1 105 105 ASN H H 105 8.611 8.611 8.660 -0.049 19700 2018 1 12 . 1 1 106 106 CYS N N 106 117.427 117.427 116.335 1.092 19700 2019 1 12 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.796 0.431 19700 2020 1 12 . 1 1 106 106 CYS H H 106 7.210 7.210 7.745 -0.535 19700 2021 1 12 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.354 0.710 19700 2022 1 12 . 1 1 108 108 GLU N N 108 119.996 119.996 118.458 1.538 19700 2023 1 12 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.269 0.307 19700 2024 1 12 . 1 1 108 108 GLU H H 108 7.777 7.777 7.983 -0.206 19700 2025 1 12 . 1 1 109 109 MET N N 109 121.587 121.587 120.989 0.598 19700 2026 1 12 . 1 1 109 109 MET HA H 109 3.879 3.879 4.300 -0.421 19700 2027 1 12 . 1 1 109 109 MET H H 109 8.954 8.954 8.624 0.330 19700 2028 1 12 . 1 1 110 110 PHE N N 110 114.224 114.224 120.645 -6.421 19700 2029 1 12 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.596 0.351 19700 2030 1 12 . 1 1 110 110 PHE H H 110 7.943 7.943 8.624 -0.681 19700 2031 1 12 . 1 1 111 111 CYS N N 111 117.718 117.718 118.385 -0.667 19700 2032 1 12 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.877 -0.024 19700 2033 1 12 . 1 1 111 111 CYS H H 111 8.141 8.141 7.728 0.413 19700 2034 1 12 . 1 1 112 112 GLY N N 112 106.232 106.232 107.329 -1.097 19700 2035 1 12 . 1 1 112 112 GLY H H 112 8.738 8.738 8.711 0.027 19700 2036 1 12 . 1 1 113 113 LYS N N 113 123.354 123.354 123.558 -0.204 19700 2037 1 12 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.662 -0.271 19700 2038 1 12 . 1 1 113 113 LYS H H 113 7.064 7.064 7.660 -0.596 19700 2039 1 12 . 1 1 114 114 PHE N N 114 117.507 117.507 121.094 -3.587 19700 2040 1 12 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.152 0.192 19700 2041 1 12 . 1 1 114 114 PHE H H 114 7.823 7.823 8.127 -0.304 19700 2042 1 12 . 1 1 115 115 GLN N N 115 117.426 117.426 118.065 -0.639 19700 2043 1 12 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.596 0.192 19700 2044 1 12 . 1 1 115 115 GLN H H 115 9.044 9.044 9.148 -0.104 19700 2045 1 12 . 1 1 116 116 ILE N N 116 124.941 124.941 123.372 1.569 19700 2046 1 12 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.618 -0.251 19700 2047 1 12 . 1 1 116 116 ILE H H 116 8.705 8.705 8.448 0.257 19700 2048 1 12 . 1 1 117 117 CYS N N 117 127.674 127.674 127.683 -0.009 19700 2049 1 12 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.615 0.233 19700 2050 1 12 . 1 1 117 117 CYS H H 117 9.103 9.103 8.928 0.175 19700 2051 1 12 . 1 1 118 118 ARG N N 118 120.976 120.976 123.523 -2.547 19700 2052 1 12 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.518 -0.006 19700 2053 1 12 . 1 1 118 118 ARG H H 118 8.396 8.396 8.524 -0.128 19700 2054 1 12 . 1 1 119 119 ASN N N 119 119.240 119.240 118.069 1.171 19700 2055 1 12 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.485 0.075 19700 2056 1 12 . 1 1 119 119 ASN H H 119 8.836 8.836 8.346 0.490 19700 2057 1 12 . 1 1 120 120 GLY N N 120 111.230 111.230 111.407 -0.177 19700 2058 1 12 . 1 1 120 120 GLY H H 120 8.755 8.755 8.504 0.251 19700 2059 1 12 . 1 1 121 121 GLU N N 121 119.650 119.650 119.956 -0.306 19700 2060 1 12 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.702 -0.452 19700 2061 1 12 . 1 1 121 121 GLU H H 121 8.158 8.158 7.607 0.551 19700 2062 1 12 . 1 1 122 122 LYS N N 122 120.471 120.471 121.431 -0.960 19700 2063 1 12 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.471 0.088 19700 2064 1 12 . 1 1 122 122 LYS H H 122 7.622 7.622 8.598 -0.976 19700 2065 1 12 . 1 1 123 123 ILE N N 123 118.223 118.223 112.879 5.344 19700 2066 1 12 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.843 -0.087 19700 2067 1 12 . 1 1 123 123 ILE H H 123 8.142 8.142 7.507 0.635 19700 2068 1 12 . 1 1 124 124 CYS N N 124 118.872 118.872 121.405 -2.533 19700 2069 1 12 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.460 0.525 19700 2070 1 12 . 1 1 124 124 CYS H H 124 9.196 9.196 8.732 0.464 19700 2071 1 12 . 1 1 125 125 PHE N N 125 116.458 116.458 114.962 1.496 19700 2072 1 12 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.761 0.556 19700 2073 1 12 . 1 1 125 125 PHE H H 125 8.958 8.958 9.032 -0.074 19700 2074 1 12 . 1 1 126 126 LYS N N 126 125.559 125.559 123.524 2.035 19700 2075 1 12 . 1 1 126 126 LYS HA H 126 5.151 5.151 5.074 0.077 19700 2076 1 12 . 1 1 126 126 LYS H H 126 9.109 9.109 9.132 -0.023 19700 2077 1 12 . 1 1 127 127 LYS N N 127 124.796 124.796 125.391 -0.595 19700 2078 1 12 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.442 -0.225 19700 2079 1 12 . 1 1 127 127 LYS H H 127 9.498 9.498 8.413 1.085 19700 2080 1 12 . 1 1 128 128 LEU N N 128 126.430 126.430 120.495 5.935 19700 2081 1 12 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.655 0.786 19700 2082 1 12 . 1 1 128 128 LEU H H 128 9.105 9.105 8.510 0.595 19700 2083 1 12 . 1 1 129 129 HIS N N 129 124.315 124.315 120.947 3.368 19700 2084 1 12 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.532 0.398 19700 2085 1 12 . 1 1 129 129 HIS H H 129 9.123 9.123 8.171 0.952 19700 2086 1 12 . 1 1 130 130 GLN N N 130 120.311 120.311 115.740 4.571 19700 2087 1 12 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.492 -0.108 19700 2088 1 12 . 1 1 130 130 GLN H H 130 8.246 8.246 7.787 0.459 19700 2089 1 12 . 1 1 131 131 ARG N N 131 123.995 123.995 121.738 2.257 19700 2090 1 12 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.387 -0.097 19700 2091 1 12 . 1 1 131 131 ARG H H 131 8.510 8.510 8.743 -0.234 19700 2092 1 12 . 1 1 132 132 ARG N N 132 121.592 121.592 119.874 1.718 19700 2093 1 12 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.282 0.026 19700 2094 1 12 . 1 1 132 132 ARG H H 132 8.183 8.183 8.372 -0.189 19700 2095 1 12 . 1 1 133 133 ALA N N 133 124.315 124.315 122.725 1.590 19700 2096 1 12 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.223 0.013 19700 2097 1 12 . 1 1 133 133 ALA H H 133 8.249 8.249 8.032 0.217 19700 2098 1 12 . 1 1 134 134 LEU N N 134 119.576 119.576 121.234 -1.658 19700 2099 1 12 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.567 -0.302 19700 2100 1 12 . 1 1 134 134 LEU H H 134 8.146 8.146 8.255 -0.109 19700 2101 1 12 . 1 1 135 135 SER N N 135 113.103 113.103 115.839 -2.736 19700 2102 1 12 . 1 1 135 135 SER HA H 135 4.504 4.504 4.130 0.374 19700 2103 1 12 . 1 1 135 135 SER H H 135 7.980 7.980 7.965 0.015 19700 2104 1 12 . 1 1 136 136 TRP N N 136 123.354 123.354 120.597 2.757 19700 2105 1 12 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.357 0.496 19700 2106 1 12 . 1 1 136 136 TRP H H 136 8.027 8.027 7.811 0.216 19700 2107 1 12 . 1 1 137 137 ARG N N 137 120.614 120.614 120.619 -0.005 19700 2108 1 12 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.646 0.028 19700 2109 1 12 . 1 1 137 137 ARG H H 137 7.991 7.991 8.278 -0.287 19700 2110 1 12 . 1 1 138 138 TYR N N 138 119.354 119.354 119.260 0.094 19700 2111 1 12 . 1 1 138 138 TYR HA H 138 5.414 5.414 4.547 0.867 19700 2112 1 12 . 1 1 138 138 TYR H H 138 9.191 9.191 8.828 0.363 19700 2113 1 12 . 1 1 139 139 ILE N N 139 119.510 119.510 123.041 -3.531 19700 2114 1 12 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.408 -0.090 19700 2115 1 12 . 1 1 139 139 ILE H H 139 9.104 9.104 9.203 -0.099 19700 2116 1 12 . 1 1 140 140 ARG N N 140 125.596 125.596 126.878 -1.282 19700 2117 1 12 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.078 -0.262 19700 2118 1 12 . 1 1 140 140 ARG H H 140 8.393 8.393 8.661 -0.268 19700 2119 1 12 . 1 1 141 141 GLY N N 141 103.964 103.964 110.338 -6.374 19700 2120 1 12 . 1 1 141 141 GLY H H 141 6.307 6.307 7.566 -1.259 19700 2121 1 12 . 1 1 142 142 CYS N N 142 117.908 117.908 119.576 -1.668 19700 2122 1 12 . 1 1 142 142 CYS HA H 142 5.756 5.756 5.151 0.605 19700 2123 1 12 . 1 1 142 142 CYS H H 142 8.184 8.184 8.663 -0.479 19700 2124 1 12 . 1 1 143 143 ALA N N 143 121.268 121.268 122.490 -1.222 19700 2125 1 12 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.869 -0.074 19700 2126 1 12 . 1 1 143 143 ALA H H 143 9.508 9.508 8.738 0.770 19700 2127 1 12 . 1 1 144 144 ASP N N 144 118.068 118.068 118.565 -0.497 19700 2128 1 12 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.657 0.235 19700 2129 1 12 . 1 1 144 144 ASP H H 144 9.030 9.030 8.599 0.431 19700 2130 1 12 . 1 1 145 145 THR N N 145 108.476 108.476 110.776 -2.300 19700 2131 1 12 . 1 1 145 145 THR HA H 145 4.422 4.422 4.347 0.075 19700 2132 1 12 . 1 1 145 145 THR H H 145 7.401 7.401 7.650 -0.249 19700 2133 1 12 . 1 1 146 146 CYS N N 146 123.516 123.516 124.888 -1.372 19700 2134 1 12 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.428 0.285 19700 2135 1 12 . 1 1 146 146 CYS H H 146 8.850 8.850 8.726 0.124 19700 2136 1 12 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.439 -0.183 19700 2137 1 12 . 1 1 148 148 VAL N N 148 118.686 118.686 121.091 -2.405 19700 2138 1 12 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.123 -0.037 19700 2139 1 12 . 1 1 148 148 VAL H H 148 7.857 7.857 8.194 -0.337 19700 2140 1 12 . 1 1 149 149 GLY N N 149 113.423 113.423 110.950 2.473 19700 2141 1 12 . 1 1 149 149 GLY H H 149 8.357 8.357 8.027 0.330 19700 2142 1 12 . 1 1 150 150 LYS N N 150 121.492 121.492 120.288 1.204 19700 2143 1 12 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.371 0.256 19700 2144 1 12 . 1 1 150 150 LYS H H 150 8.574 8.574 8.138 0.436 19700 2145 1 12 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.337 0.005 19700 2146 1 12 . 1 1 152 152 TYR N N 152 111.257 111.257 114.545 -3.288 19700 2147 1 12 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.750 -0.226 19700 2148 1 12 . 1 1 152 152 TYR H H 152 7.127 7.127 7.524 -0.397 19700 2149 1 12 . 1 1 153 153 GLU N N 153 119.670 119.670 118.466 1.204 19700 2150 1 12 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.341 0.066 19700 2151 1 12 . 1 1 153 153 GLU H H 153 7.603 7.603 7.181 0.422 19700 2152 1 12 . 1 1 154 154 MET N N 154 117.748 117.748 115.759 1.989 19700 2153 1 12 . 1 1 154 154 MET HA H 154 4.335 4.335 4.053 0.282 19700 2154 1 12 . 1 1 154 154 MET H H 154 8.052 8.052 7.355 0.697 19700 2155 1 12 . 1 1 155 155 ILE N N 155 121.057 121.057 119.081 1.976 19700 2156 1 12 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.038 0.506 19700 2157 1 12 . 1 1 155 155 ILE H H 155 8.393 8.393 8.222 0.171 19700 2158 1 12 . 1 1 156 156 GLU N N 156 127.999 127.999 129.583 -1.584 19700 2159 1 12 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.687 0.185 19700 2160 1 12 . 1 1 156 156 GLU H H 156 8.994 8.994 8.563 0.431 19700 2161 1 12 . 1 1 157 157 CYS N N 157 123.034 123.034 121.777 1.257 19700 2162 1 12 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.634 -0.116 19700 2163 1 12 . 1 1 157 157 CYS H H 157 9.029 9.029 8.606 0.423 19700 2164 1 12 . 1 1 158 158 CYS N N 158 119.670 119.670 118.796 0.874 19700 2165 1 12 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.731 0.440 19700 2166 1 12 . 1 1 158 158 CYS H H 158 9.344 9.344 8.923 0.421 19700 2167 1 12 . 1 1 159 159 SER N N 159 114.684 114.684 115.354 -0.670 19700 2168 1 12 . 1 1 159 159 SER HA H 159 5.112 5.112 4.672 0.440 19700 2169 1 12 . 1 1 159 159 SER H H 159 9.064 9.064 8.497 0.567 19700 2170 1 12 . 1 1 160 160 THR N N 160 111.828 111.828 113.353 -1.525 19700 2171 1 12 . 1 1 160 160 THR HA H 160 4.784 4.784 4.598 0.186 19700 2172 1 12 . 1 1 160 160 THR H H 160 7.626 7.626 7.479 0.147 19700 2173 1 12 . 1 1 161 161 ASP N N 161 118.279 118.279 122.988 -4.709 19700 2174 1 12 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.403 0.453 19700 2175 1 12 . 1 1 161 161 ASP H H 161 8.332 8.332 8.486 -0.154 19700 2176 1 12 . 1 1 162 162 LYS N N 162 116.091 116.091 117.550 -1.459 19700 2177 1 12 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.732 -0.280 19700 2178 1 12 . 1 1 162 162 LYS H H 162 9.460 9.460 8.402 1.058 19700 2179 1 12 . 1 1 163 163 CYS N N 163 111.859 111.859 115.644 -3.785 19700 2180 1 12 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.228 0.188 19700 2181 1 12 . 1 1 163 163 CYS H H 163 7.751 7.751 8.578 -0.827 19700 2182 1 12 . 1 1 164 164 ASN N N 164 122.713 122.713 117.113 5.600 19700 2183 1 12 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.621 0.063 19700 2184 1 12 . 1 1 164 164 ASN H H 164 9.396 9.396 8.255 1.141 19700 2185 1 13 . 1 1 101 101 LEU N N 101 128.488 128.488 123.064 5.424 19700 2186 1 13 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.870 -0.148 19700 2187 1 13 . 1 1 101 101 LEU H H 101 8.706 8.706 8.544 0.162 19700 2188 1 13 . 1 1 102 102 THR N N 102 117.086 117.086 119.757 -2.671 19700 2189 1 13 . 1 1 102 102 THR HA H 102 5.198 5.198 4.939 0.259 19700 2190 1 13 . 1 1 102 102 THR H H 102 7.729 7.729 8.292 -0.563 19700 2191 1 13 . 1 1 103 103 CYS N N 103 119.021 119.021 125.229 -6.208 19700 2192 1 13 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.806 0.322 19700 2193 1 13 . 1 1 103 103 CYS H H 103 8.514 8.514 9.345 -0.831 19700 2194 1 13 . 1 1 104 104 LEU N N 104 123.028 123.028 121.670 1.358 19700 2195 1 13 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.472 0.339 19700 2196 1 13 . 1 1 104 104 LEU H H 104 9.147 9.147 8.307 0.840 19700 2197 1 13 . 1 1 105 105 ASN N N 105 119.029 119.029 117.504 1.525 19700 2198 1 13 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.869 -0.063 19700 2199 1 13 . 1 1 105 105 ASN H H 105 8.611 8.611 8.732 -0.121 19700 2200 1 13 . 1 1 106 106 CYS N N 106 117.427 117.427 117.193 0.234 19700 2201 1 13 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.885 0.342 19700 2202 1 13 . 1 1 106 106 CYS H H 106 7.210 7.210 8.096 -0.886 19700 2203 1 13 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.347 0.717 19700 2204 1 13 . 1 1 108 108 GLU N N 108 119.996 119.996 118.551 1.445 19700 2205 1 13 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.309 0.267 19700 2206 1 13 . 1 1 108 108 GLU H H 108 7.777 7.777 8.096 -0.319 19700 2207 1 13 . 1 1 109 109 MET N N 109 121.587 121.587 119.929 1.658 19700 2208 1 13 . 1 1 109 109 MET HA H 109 3.879 3.879 4.073 -0.194 19700 2209 1 13 . 1 1 109 109 MET H H 109 8.954 8.954 8.460 0.494 19700 2210 1 13 . 1 1 110 110 PHE N N 110 114.224 114.224 120.436 -6.212 19700 2211 1 13 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.586 0.361 19700 2212 1 13 . 1 1 110 110 PHE H H 110 7.943 7.943 7.958 -0.015 19700 2213 1 13 . 1 1 111 111 CYS N N 111 117.718 117.718 119.122 -1.404 19700 2214 1 13 . 1 1 111 111 CYS HA H 111 4.853 4.853 5.028 -0.175 19700 2215 1 13 . 1 1 111 111 CYS H H 111 8.141 8.141 8.165 -0.024 19700 2216 1 13 . 1 1 112 112 GLY N N 112 106.232 106.232 107.979 -1.747 19700 2217 1 13 . 1 1 112 112 GLY H H 112 8.738 8.738 8.618 0.120 19700 2218 1 13 . 1 1 113 113 LYS N N 113 123.354 123.354 123.356 -0.002 19700 2219 1 13 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.570 -0.179 19700 2220 1 13 . 1 1 113 113 LYS H H 113 7.064 7.064 7.683 -0.619 19700 2221 1 13 . 1 1 114 114 PHE N N 114 117.507 117.507 119.948 -2.441 19700 2222 1 13 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.099 0.245 19700 2223 1 13 . 1 1 114 114 PHE H H 114 7.823 7.823 8.059 -0.236 19700 2224 1 13 . 1 1 115 115 GLN N N 115 117.426 117.426 118.516 -1.090 19700 2225 1 13 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.727 0.061 19700 2226 1 13 . 1 1 115 115 GLN H H 115 9.044 9.044 9.256 -0.212 19700 2227 1 13 . 1 1 116 116 ILE N N 116 124.941 124.941 123.540 1.401 19700 2228 1 13 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.508 -0.141 19700 2229 1 13 . 1 1 116 116 ILE H H 116 8.705 8.705 8.423 0.282 19700 2230 1 13 . 1 1 117 117 CYS N N 117 127.674 127.674 127.603 0.071 19700 2231 1 13 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.582 0.266 19700 2232 1 13 . 1 1 117 117 CYS H H 117 9.103 9.103 8.915 0.188 19700 2233 1 13 . 1 1 118 118 ARG N N 118 120.976 120.976 124.187 -3.211 19700 2234 1 13 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.566 -0.054 19700 2235 1 13 . 1 1 118 118 ARG H H 118 8.396 8.396 8.543 -0.147 19700 2236 1 13 . 1 1 119 119 ASN N N 119 119.240 119.240 118.701 0.539 19700 2237 1 13 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.449 0.111 19700 2238 1 13 . 1 1 119 119 ASN H H 119 8.836 8.836 8.401 0.435 19700 2239 1 13 . 1 1 120 120 GLY N N 120 111.230 111.230 111.316 -0.086 19700 2240 1 13 . 1 1 120 120 GLY H H 120 8.755 8.755 8.591 0.164 19700 2241 1 13 . 1 1 121 121 GLU N N 121 119.650 119.650 120.068 -0.418 19700 2242 1 13 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.678 -0.428 19700 2243 1 13 . 1 1 121 121 GLU H H 121 8.158 8.158 7.616 0.542 19700 2244 1 13 . 1 1 122 122 LYS N N 122 120.471 120.471 121.743 -1.272 19700 2245 1 13 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.437 0.122 19700 2246 1 13 . 1 1 122 122 LYS H H 122 7.622 7.622 8.610 -0.988 19700 2247 1 13 . 1 1 123 123 ILE N N 123 118.223 118.223 114.604 3.619 19700 2248 1 13 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.610 0.146 19700 2249 1 13 . 1 1 123 123 ILE H H 123 8.142 8.142 7.550 0.592 19700 2250 1 13 . 1 1 124 124 CYS N N 124 118.872 118.872 120.683 -1.811 19700 2251 1 13 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.457 0.528 19700 2252 1 13 . 1 1 124 124 CYS H H 124 9.196 9.196 8.755 0.441 19700 2253 1 13 . 1 1 125 125 PHE N N 125 116.458 116.458 114.837 1.621 19700 2254 1 13 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.776 0.541 19700 2255 1 13 . 1 1 125 125 PHE H H 125 8.958 8.958 8.985 -0.027 19700 2256 1 13 . 1 1 126 126 LYS N N 126 125.559 125.559 123.178 2.381 19700 2257 1 13 . 1 1 126 126 LYS HA H 126 5.151 5.151 5.008 0.143 19700 2258 1 13 . 1 1 126 126 LYS H H 126 9.109 9.109 8.878 0.231 19700 2259 1 13 . 1 1 127 127 LYS N N 127 124.796 124.796 124.707 0.089 19700 2260 1 13 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.526 -0.309 19700 2261 1 13 . 1 1 127 127 LYS H H 127 9.498 9.498 8.317 1.181 19700 2262 1 13 . 1 1 128 128 LEU N N 128 126.430 126.430 120.855 5.575 19700 2263 1 13 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.939 0.502 19700 2264 1 13 . 1 1 128 128 LEU H H 128 9.105 9.105 8.608 0.497 19700 2265 1 13 . 1 1 129 129 HIS N N 129 124.315 124.315 123.483 0.832 19700 2266 1 13 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.787 0.143 19700 2267 1 13 . 1 1 129 129 HIS H H 129 9.123 9.123 8.637 0.486 19700 2268 1 13 . 1 1 130 130 GLN N N 130 120.311 120.311 117.410 2.901 19700 2269 1 13 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.323 0.061 19700 2270 1 13 . 1 1 130 130 GLN H H 130 8.246 8.246 7.310 0.936 19700 2271 1 13 . 1 1 131 131 ARG N N 131 123.995 123.995 123.410 0.585 19700 2272 1 13 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.070 0.220 19700 2273 1 13 . 1 1 131 131 ARG H H 131 8.510 8.510 8.649 -0.139 19700 2274 1 13 . 1 1 132 132 ARG N N 132 121.592 121.592 118.280 3.312 19700 2275 1 13 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.417 -0.108 19700 2276 1 13 . 1 1 132 132 ARG H H 132 8.183 8.183 8.186 -0.003 19700 2277 1 13 . 1 1 133 133 ALA N N 133 124.315 124.315 124.962 -0.647 19700 2278 1 13 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.558 -0.322 19700 2279 1 13 . 1 1 133 133 ALA H H 133 8.249 8.249 8.048 0.201 19700 2280 1 13 . 1 1 134 134 LEU N N 134 119.576 119.576 117.209 2.367 19700 2281 1 13 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.348 -0.083 19700 2282 1 13 . 1 1 134 134 LEU H H 134 8.146 8.146 8.388 -0.242 19700 2283 1 13 . 1 1 135 135 SER N N 135 113.103 113.103 114.693 -1.590 19700 2284 1 13 . 1 1 135 135 SER HA H 135 4.504 4.504 4.324 0.180 19700 2285 1 13 . 1 1 135 135 SER H H 135 7.980 7.980 7.548 0.432 19700 2286 1 13 . 1 1 136 136 TRP N N 136 123.354 123.354 116.673 6.681 19700 2287 1 13 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.668 0.185 19700 2288 1 13 . 1 1 136 136 TRP H H 136 8.027 8.027 7.736 0.291 19700 2289 1 13 . 1 1 137 137 ARG N N 137 120.614 120.614 118.911 1.703 19700 2290 1 13 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.611 0.063 19700 2291 1 13 . 1 1 137 137 ARG H H 137 7.991 7.991 8.966 -0.975 19700 2292 1 13 . 1 1 138 138 TYR N N 138 119.354 119.354 117.139 2.215 19700 2293 1 13 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.431 -0.017 19700 2294 1 13 . 1 1 138 138 TYR H H 138 9.191 9.191 7.791 1.400 19700 2295 1 13 . 1 1 139 139 ILE N N 139 119.510 119.510 123.367 -3.857 19700 2296 1 13 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.329 -0.011 19700 2297 1 13 . 1 1 139 139 ILE H H 139 9.104 9.104 9.301 -0.197 19700 2298 1 13 . 1 1 140 140 ARG N N 140 125.596 125.596 126.235 -0.639 19700 2299 1 13 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.069 -0.253 19700 2300 1 13 . 1 1 140 140 ARG H H 140 8.393 8.393 8.615 -0.222 19700 2301 1 13 . 1 1 141 141 GLY N N 141 103.964 103.964 109.930 -5.966 19700 2302 1 13 . 1 1 141 141 GLY H H 141 6.307 6.307 7.593 -1.286 19700 2303 1 13 . 1 1 142 142 CYS N N 142 117.908 117.908 119.060 -1.152 19700 2304 1 13 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.882 0.874 19700 2305 1 13 . 1 1 142 142 CYS H H 142 8.184 8.184 8.682 -0.498 19700 2306 1 13 . 1 1 143 143 ALA N N 143 121.268 121.268 123.412 -2.144 19700 2307 1 13 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.804 -0.009 19700 2308 1 13 . 1 1 143 143 ALA H H 143 9.508 9.508 8.822 0.686 19700 2309 1 13 . 1 1 144 144 ASP N N 144 118.068 118.068 118.785 -0.717 19700 2310 1 13 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.658 0.234 19700 2311 1 13 . 1 1 144 144 ASP H H 144 9.030 9.030 8.599 0.431 19700 2312 1 13 . 1 1 145 145 THR N N 145 108.476 108.476 109.927 -1.451 19700 2313 1 13 . 1 1 145 145 THR HA H 145 4.422 4.422 4.400 0.022 19700 2314 1 13 . 1 1 145 145 THR H H 145 7.401 7.401 7.518 -0.117 19700 2315 1 13 . 1 1 146 146 CYS N N 146 123.516 123.516 123.632 -0.116 19700 2316 1 13 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.474 0.239 19700 2317 1 13 . 1 1 146 146 CYS H H 146 8.850 8.850 8.401 0.449 19700 2318 1 13 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.453 -0.197 19700 2319 1 13 . 1 1 148 148 VAL N N 148 118.686 118.686 118.975 -0.289 19700 2320 1 13 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.244 -0.158 19700 2321 1 13 . 1 1 148 148 VAL H H 148 7.857 7.857 8.144 -0.287 19700 2322 1 13 . 1 1 149 149 GLY N N 149 113.423 113.423 110.702 2.721 19700 2323 1 13 . 1 1 149 149 GLY H H 149 8.357 8.357 8.147 0.210 19700 2324 1 13 . 1 1 150 150 LYS N N 150 121.492 121.492 120.589 0.903 19700 2325 1 13 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.457 0.170 19700 2326 1 13 . 1 1 150 150 LYS H H 150 8.574 8.574 8.561 0.013 19700 2327 1 13 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.401 -0.059 19700 2328 1 13 . 1 1 152 152 TYR N N 152 111.257 111.257 117.861 -6.604 19700 2329 1 13 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.527 -0.003 19700 2330 1 13 . 1 1 152 152 TYR H H 152 7.127 7.127 8.488 -1.361 19700 2331 1 13 . 1 1 153 153 GLU N N 153 119.670 119.670 119.146 0.524 19700 2332 1 13 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.299 0.108 19700 2333 1 13 . 1 1 153 153 GLU H H 153 7.603 7.603 7.703 -0.100 19700 2334 1 13 . 1 1 154 154 MET N N 154 117.748 117.748 116.027 1.721 19700 2335 1 13 . 1 1 154 154 MET HA H 154 4.335 4.335 4.049 0.286 19700 2336 1 13 . 1 1 154 154 MET H H 154 8.052 8.052 7.399 0.653 19700 2337 1 13 . 1 1 155 155 ILE N N 155 121.057 121.057 118.786 2.271 19700 2338 1 13 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.183 0.361 19700 2339 1 13 . 1 1 155 155 ILE H H 155 8.393 8.393 8.279 0.114 19700 2340 1 13 . 1 1 156 156 GLU N N 156 127.999 127.999 129.112 -1.113 19700 2341 1 13 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.691 0.181 19700 2342 1 13 . 1 1 156 156 GLU H H 156 8.994 8.994 8.667 0.327 19700 2343 1 13 . 1 1 157 157 CYS N N 157 123.034 123.034 121.904 1.130 19700 2344 1 13 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.661 -0.143 19700 2345 1 13 . 1 1 157 157 CYS H H 157 9.029 9.029 8.642 0.387 19700 2346 1 13 . 1 1 158 158 CYS N N 158 119.670 119.670 119.752 -0.082 19700 2347 1 13 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.961 0.210 19700 2348 1 13 . 1 1 158 158 CYS H H 158 9.344 9.344 9.064 0.280 19700 2349 1 13 . 1 1 159 159 SER N N 159 114.684 114.684 116.157 -1.473 19700 2350 1 13 . 1 1 159 159 SER HA H 159 5.112 5.112 4.749 0.363 19700 2351 1 13 . 1 1 159 159 SER H H 159 9.064 9.064 8.490 0.574 19700 2352 1 13 . 1 1 160 160 THR N N 160 111.828 111.828 112.414 -0.586 19700 2353 1 13 . 1 1 160 160 THR HA H 160 4.784 4.784 4.485 0.299 19700 2354 1 13 . 1 1 160 160 THR H H 160 7.626 7.626 7.454 0.172 19700 2355 1 13 . 1 1 161 161 ASP N N 161 118.279 118.279 123.333 -5.054 19700 2356 1 13 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.367 0.489 19700 2357 1 13 . 1 1 161 161 ASP H H 161 8.332 8.332 8.524 -0.192 19700 2358 1 13 . 1 1 162 162 LYS N N 162 116.091 116.091 117.884 -1.793 19700 2359 1 13 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.709 -0.257 19700 2360 1 13 . 1 1 162 162 LYS H H 162 9.460 9.460 8.339 1.121 19700 2361 1 13 . 1 1 163 163 CYS N N 163 111.859 111.859 114.850 -2.991 19700 2362 1 13 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.193 0.223 19700 2363 1 13 . 1 1 163 163 CYS H H 163 7.751 7.751 8.464 -0.713 19700 2364 1 13 . 1 1 164 164 ASN N N 164 122.713 122.713 117.490 5.223 19700 2365 1 13 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.596 0.088 19700 2366 1 13 . 1 1 164 164 ASN H H 164 9.396 9.396 8.108 1.288 19700 2367 1 14 . 1 1 101 101 LEU N N 101 128.488 128.488 122.454 6.034 19700 2368 1 14 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.853 -0.131 19700 2369 1 14 . 1 1 101 101 LEU H H 101 8.706 8.706 8.439 0.267 19700 2370 1 14 . 1 1 102 102 THR N N 102 117.086 117.086 119.984 -2.898 19700 2371 1 14 . 1 1 102 102 THR HA H 102 5.198 5.198 4.934 0.264 19700 2372 1 14 . 1 1 102 102 THR H H 102 7.729 7.729 8.329 -0.600 19700 2373 1 14 . 1 1 103 103 CYS N N 103 119.021 119.021 124.663 -5.642 19700 2374 1 14 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.760 0.368 19700 2375 1 14 . 1 1 103 103 CYS H H 103 8.514 8.514 9.221 -0.707 19700 2376 1 14 . 1 1 104 104 LEU N N 104 123.028 123.028 122.105 0.923 19700 2377 1 14 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.477 0.334 19700 2378 1 14 . 1 1 104 104 LEU H H 104 9.147 9.147 8.331 0.816 19700 2379 1 14 . 1 1 105 105 ASN N N 105 119.029 119.029 117.650 1.379 19700 2380 1 14 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.085 -0.279 19700 2381 1 14 . 1 1 105 105 ASN H H 105 8.611 8.611 8.634 -0.023 19700 2382 1 14 . 1 1 106 106 CYS N N 106 117.427 117.427 115.484 1.943 19700 2383 1 14 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.883 0.344 19700 2384 1 14 . 1 1 106 106 CYS H H 106 7.210 7.210 7.813 -0.603 19700 2385 1 14 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.829 0.235 19700 2386 1 14 . 1 1 108 108 GLU N N 108 119.996 119.996 117.982 2.014 19700 2387 1 14 . 1 1 108 108 GLU HA H 108 4.576 4.576 3.867 0.709 19700 2388 1 14 . 1 1 108 108 GLU H H 108 7.777 7.777 8.113 -0.336 19700 2389 1 14 . 1 1 109 109 MET N N 109 121.587 121.587 117.706 3.881 19700 2390 1 14 . 1 1 109 109 MET HA H 109 3.879 3.879 3.995 -0.116 19700 2391 1 14 . 1 1 109 109 MET H H 109 8.954 8.954 6.519 2.435 19700 2392 1 14 . 1 1 110 110 PHE N N 110 114.224 114.224 119.830 -5.606 19700 2393 1 14 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.416 0.531 19700 2394 1 14 . 1 1 110 110 PHE H H 110 7.943 7.943 8.078 -0.135 19700 2395 1 14 . 1 1 111 111 CYS N N 111 117.718 117.718 117.565 0.153 19700 2396 1 14 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.770 0.083 19700 2397 1 14 . 1 1 111 111 CYS H H 111 8.141 8.141 7.529 0.612 19700 2398 1 14 . 1 1 112 112 GLY N N 112 106.232 106.232 106.339 -0.107 19700 2399 1 14 . 1 1 112 112 GLY H H 112 8.738 8.738 8.646 0.092 19700 2400 1 14 . 1 1 113 113 LYS N N 113 123.354 123.354 123.610 -0.256 19700 2401 1 14 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.612 -0.221 19700 2402 1 14 . 1 1 113 113 LYS H H 113 7.064 7.064 7.763 -0.699 19700 2403 1 14 . 1 1 114 114 PHE N N 114 117.507 117.507 120.810 -3.303 19700 2404 1 14 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.104 0.240 19700 2405 1 14 . 1 1 114 114 PHE H H 114 7.823 7.823 8.073 -0.250 19700 2406 1 14 . 1 1 115 115 GLN N N 115 117.426 117.426 117.622 -0.196 19700 2407 1 14 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.603 0.185 19700 2408 1 14 . 1 1 115 115 GLN H H 115 9.044 9.044 9.185 -0.141 19700 2409 1 14 . 1 1 116 116 ILE N N 116 124.941 124.941 122.923 2.018 19700 2410 1 14 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.447 -0.080 19700 2411 1 14 . 1 1 116 116 ILE H H 116 8.705 8.705 8.501 0.204 19700 2412 1 14 . 1 1 117 117 CYS N N 117 127.674 127.674 127.825 -0.151 19700 2413 1 14 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.600 0.248 19700 2414 1 14 . 1 1 117 117 CYS H H 117 9.103 9.103 8.958 0.145 19700 2415 1 14 . 1 1 118 118 ARG N N 118 120.976 120.976 123.868 -2.892 19700 2416 1 14 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.577 -0.065 19700 2417 1 14 . 1 1 118 118 ARG H H 118 8.396 8.396 8.642 -0.246 19700 2418 1 14 . 1 1 119 119 ASN N N 119 119.240 119.240 118.421 0.819 19700 2419 1 14 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.462 0.098 19700 2420 1 14 . 1 1 119 119 ASN H H 119 8.836 8.836 8.514 0.322 19700 2421 1 14 . 1 1 120 120 GLY N N 120 111.230 111.230 108.190 3.040 19700 2422 1 14 . 1 1 120 120 GLY H H 120 8.755 8.755 8.623 0.132 19700 2423 1 14 . 1 1 121 121 GLU N N 121 119.650 119.650 120.588 -0.938 19700 2424 1 14 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.660 -0.410 19700 2425 1 14 . 1 1 121 121 GLU H H 121 8.158 8.158 7.673 0.485 19700 2426 1 14 . 1 1 122 122 LYS N N 122 120.471 120.471 121.443 -0.972 19700 2427 1 14 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.457 0.102 19700 2428 1 14 . 1 1 122 122 LYS H H 122 7.622 7.622 8.565 -0.943 19700 2429 1 14 . 1 1 123 123 ILE N N 123 118.223 118.223 119.715 -1.492 19700 2430 1 14 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.450 0.306 19700 2431 1 14 . 1 1 123 123 ILE H H 123 8.142 8.142 7.664 0.478 19700 2432 1 14 . 1 1 124 124 CYS N N 124 118.872 118.872 123.804 -4.932 19700 2433 1 14 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.343 0.642 19700 2434 1 14 . 1 1 124 124 CYS H H 124 9.196 9.196 9.168 0.029 19700 2435 1 14 . 1 1 125 125 PHE N N 125 116.458 116.458 114.761 1.697 19700 2436 1 14 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.704 0.613 19700 2437 1 14 . 1 1 125 125 PHE H H 125 8.958 8.958 8.943 0.015 19700 2438 1 14 . 1 1 126 126 LYS N N 126 125.559 125.559 123.230 2.329 19700 2439 1 14 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.930 0.221 19700 2440 1 14 . 1 1 126 126 LYS H H 126 9.109 9.109 8.529 0.580 19700 2441 1 14 . 1 1 127 127 LYS N N 127 124.796 124.796 124.173 0.623 19700 2442 1 14 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.402 -0.185 19700 2443 1 14 . 1 1 127 127 LYS H H 127 9.498 9.498 8.366 1.132 19700 2444 1 14 . 1 1 128 128 LEU N N 128 126.430 126.430 120.702 5.728 19700 2445 1 14 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.759 0.682 19700 2446 1 14 . 1 1 128 128 LEU H H 128 9.105 9.105 8.737 0.368 19700 2447 1 14 . 1 1 129 129 HIS N N 129 124.315 124.315 122.395 1.920 19700 2448 1 14 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.754 0.176 19700 2449 1 14 . 1 1 129 129 HIS H H 129 9.123 9.123 8.663 0.460 19700 2450 1 14 . 1 1 130 130 GLN N N 130 120.311 120.311 117.204 3.107 19700 2451 1 14 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.570 -0.186 19700 2452 1 14 . 1 1 130 130 GLN H H 130 8.246 8.246 7.454 0.792 19700 2453 1 14 . 1 1 131 131 ARG N N 131 123.995 123.995 119.932 4.063 19700 2454 1 14 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.128 0.162 19700 2455 1 14 . 1 1 131 131 ARG H H 131 8.510 8.510 8.442 0.068 19700 2456 1 14 . 1 1 132 132 ARG N N 132 121.592 121.592 120.539 1.053 19700 2457 1 14 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.155 0.153 19700 2458 1 14 . 1 1 132 132 ARG H H 132 8.183 8.183 7.802 0.381 19700 2459 1 14 . 1 1 133 133 ALA N N 133 124.315 124.315 126.051 -1.736 19700 2460 1 14 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.342 -0.106 19700 2461 1 14 . 1 1 133 133 ALA H H 133 8.249 8.249 8.253 -0.004 19700 2462 1 14 . 1 1 134 134 LEU N N 134 119.576 119.576 116.843 2.733 19700 2463 1 14 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.102 0.163 19700 2464 1 14 . 1 1 134 134 LEU H H 134 8.146 8.146 7.966 0.180 19700 2465 1 14 . 1 1 135 135 SER N N 135 113.103 113.103 112.337 0.766 19700 2466 1 14 . 1 1 135 135 SER HA H 135 4.504 4.504 4.104 0.400 19700 2467 1 14 . 1 1 135 135 SER H H 135 7.980 7.980 7.634 0.346 19700 2468 1 14 . 1 1 136 136 TRP N N 136 123.354 123.354 125.418 -2.064 19700 2469 1 14 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.600 0.253 19700 2470 1 14 . 1 1 136 136 TRP H H 136 8.027 8.027 8.274 -0.247 19700 2471 1 14 . 1 1 137 137 ARG N N 137 120.614 120.614 115.342 5.272 19700 2472 1 14 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.096 0.578 19700 2473 1 14 . 1 1 137 137 ARG H H 137 7.991 7.991 8.781 -0.790 19700 2474 1 14 . 1 1 138 138 TYR N N 138 119.354 119.354 118.741 0.613 19700 2475 1 14 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.048 0.366 19700 2476 1 14 . 1 1 138 138 TYR H H 138 9.191 9.191 7.668 1.523 19700 2477 1 14 . 1 1 139 139 ILE N N 139 119.510 119.510 122.959 -3.449 19700 2478 1 14 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.279 0.039 19700 2479 1 14 . 1 1 139 139 ILE H H 139 9.104 9.104 9.027 0.077 19700 2480 1 14 . 1 1 140 140 ARG N N 140 125.596 125.596 126.452 -0.856 19700 2481 1 14 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.120 -0.304 19700 2482 1 14 . 1 1 140 140 ARG H H 140 8.393 8.393 8.016 0.377 19700 2483 1 14 . 1 1 141 141 GLY N N 141 103.964 103.964 109.712 -5.748 19700 2484 1 14 . 1 1 141 141 GLY H H 141 6.307 6.307 7.601 -1.294 19700 2485 1 14 . 1 1 142 142 CYS N N 142 117.908 117.908 119.507 -1.599 19700 2486 1 14 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.697 1.059 19700 2487 1 14 . 1 1 142 142 CYS H H 142 8.184 8.184 8.598 -0.414 19700 2488 1 14 . 1 1 143 143 ALA N N 143 121.268 121.268 123.131 -1.863 19700 2489 1 14 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.919 -0.124 19700 2490 1 14 . 1 1 143 143 ALA H H 143 9.508 9.508 8.477 1.031 19700 2491 1 14 . 1 1 144 144 ASP N N 144 118.068 118.068 117.980 0.088 19700 2492 1 14 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.639 0.253 19700 2493 1 14 . 1 1 144 144 ASP H H 144 9.030 9.030 8.853 0.177 19700 2494 1 14 . 1 1 145 145 THR N N 145 108.476 108.476 109.887 -1.411 19700 2495 1 14 . 1 1 145 145 THR HA H 145 4.422 4.422 4.351 0.071 19700 2496 1 14 . 1 1 145 145 THR H H 145 7.401 7.401 7.559 -0.158 19700 2497 1 14 . 1 1 146 146 CYS N N 146 123.516 123.516 123.555 -0.039 19700 2498 1 14 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.470 0.243 19700 2499 1 14 . 1 1 146 146 CYS H H 146 8.850 8.850 8.369 0.481 19700 2500 1 14 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.393 -0.137 19700 2501 1 14 . 1 1 148 148 VAL N N 148 118.686 118.686 119.347 -0.661 19700 2502 1 14 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.264 -0.178 19700 2503 1 14 . 1 1 148 148 VAL H H 148 7.857 7.857 8.164 -0.307 19700 2504 1 14 . 1 1 149 149 GLY N N 149 113.423 113.423 110.420 3.003 19700 2505 1 14 . 1 1 149 149 GLY H H 149 8.357 8.357 8.025 0.332 19700 2506 1 14 . 1 1 150 150 LYS N N 150 121.492 121.492 120.677 0.815 19700 2507 1 14 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.524 0.103 19700 2508 1 14 . 1 1 150 150 LYS H H 150 8.574 8.574 8.550 0.024 19700 2509 1 14 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.426 -0.084 19700 2510 1 14 . 1 1 152 152 TYR N N 152 111.257 111.257 117.698 -6.441 19700 2511 1 14 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.523 0.001 19700 2512 1 14 . 1 1 152 152 TYR H H 152 7.127 7.127 8.011 -0.884 19700 2513 1 14 . 1 1 153 153 GLU N N 153 119.670 119.670 117.112 2.558 19700 2514 1 14 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.392 0.015 19700 2515 1 14 . 1 1 153 153 GLU H H 153 7.603 7.603 7.481 0.122 19700 2516 1 14 . 1 1 154 154 MET N N 154 117.748 117.748 115.910 1.838 19700 2517 1 14 . 1 1 154 154 MET HA H 154 4.335 4.335 4.074 0.261 19700 2518 1 14 . 1 1 154 154 MET H H 154 8.052 8.052 7.431 0.621 19700 2519 1 14 . 1 1 155 155 ILE N N 155 121.057 121.057 118.993 2.064 19700 2520 1 14 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.081 0.463 19700 2521 1 14 . 1 1 155 155 ILE H H 155 8.393 8.393 8.258 0.135 19700 2522 1 14 . 1 1 156 156 GLU N N 156 127.999 127.999 128.873 -0.874 19700 2523 1 14 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.661 0.211 19700 2524 1 14 . 1 1 156 156 GLU H H 156 8.994 8.994 8.191 0.803 19700 2525 1 14 . 1 1 157 157 CYS N N 157 123.034 123.034 120.334 2.700 19700 2526 1 14 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.665 -0.147 19700 2527 1 14 . 1 1 157 157 CYS H H 157 9.029 9.029 8.591 0.438 19700 2528 1 14 . 1 1 158 158 CYS N N 158 119.670 119.670 120.279 -0.609 19700 2529 1 14 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.882 0.289 19700 2530 1 14 . 1 1 158 158 CYS H H 158 9.344 9.344 9.009 0.335 19700 2531 1 14 . 1 1 159 159 SER N N 159 114.684 114.684 115.179 -0.495 19700 2532 1 14 . 1 1 159 159 SER HA H 159 5.112 5.112 4.784 0.328 19700 2533 1 14 . 1 1 159 159 SER H H 159 9.064 9.064 8.574 0.490 19700 2534 1 14 . 1 1 160 160 THR N N 160 111.828 111.828 112.119 -0.291 19700 2535 1 14 . 1 1 160 160 THR HA H 160 4.784 4.784 4.521 0.263 19700 2536 1 14 . 1 1 160 160 THR H H 160 7.626 7.626 7.377 0.249 19700 2537 1 14 . 1 1 161 161 ASP N N 161 118.279 118.279 123.395 -5.116 19700 2538 1 14 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.342 0.514 19700 2539 1 14 . 1 1 161 161 ASP H H 161 8.332 8.332 8.565 -0.233 19700 2540 1 14 . 1 1 162 162 LYS N N 162 116.091 116.091 118.095 -2.004 19700 2541 1 14 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.701 -0.249 19700 2542 1 14 . 1 1 162 162 LYS H H 162 9.460 9.460 8.162 1.298 19700 2543 1 14 . 1 1 163 163 CYS N N 163 111.859 111.859 115.934 -4.075 19700 2544 1 14 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.218 0.198 19700 2545 1 14 . 1 1 163 163 CYS H H 163 7.751 7.751 8.596 -0.845 19700 2546 1 14 . 1 1 164 164 ASN N N 164 122.713 122.713 117.004 5.709 19700 2547 1 14 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.604 0.080 19700 2548 1 14 . 1 1 164 164 ASN H H 164 9.396 9.396 8.326 1.070 19700 2549 1 15 . 1 1 101 101 LEU N N 101 128.488 128.488 123.308 5.180 19700 2550 1 15 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.785 -0.063 19700 2551 1 15 . 1 1 101 101 LEU H H 101 8.706 8.706 8.519 0.187 19700 2552 1 15 . 1 1 102 102 THR N N 102 117.086 117.086 117.863 -0.777 19700 2553 1 15 . 1 1 102 102 THR HA H 102 5.198 5.198 5.037 0.161 19700 2554 1 15 . 1 1 102 102 THR H H 102 7.729 7.729 8.426 -0.697 19700 2555 1 15 . 1 1 103 103 CYS N N 103 119.021 119.021 124.877 -5.856 19700 2556 1 15 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.790 0.338 19700 2557 1 15 . 1 1 103 103 CYS H H 103 8.514 8.514 8.934 -0.420 19700 2558 1 15 . 1 1 104 104 LEU N N 104 123.028 123.028 121.536 1.492 19700 2559 1 15 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.597 0.214 19700 2560 1 15 . 1 1 104 104 LEU H H 104 9.147 9.147 8.372 0.775 19700 2561 1 15 . 1 1 105 105 ASN N N 105 119.029 119.029 114.159 4.870 19700 2562 1 15 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.194 -0.388 19700 2563 1 15 . 1 1 105 105 ASN H H 105 8.611 8.611 8.589 0.022 19700 2564 1 15 . 1 1 106 106 CYS N N 106 117.427 117.427 116.326 1.101 19700 2565 1 15 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.906 0.321 19700 2566 1 15 . 1 1 106 106 CYS H H 106 7.210 7.210 7.941 -0.731 19700 2567 1 15 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.724 0.340 19700 2568 1 15 . 1 1 108 108 GLU N N 108 119.996 119.996 117.997 1.999 19700 2569 1 15 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.447 0.129 19700 2570 1 15 . 1 1 108 108 GLU H H 108 7.777 7.777 8.343 -0.566 19700 2571 1 15 . 1 1 109 109 MET N N 109 121.587 121.587 121.697 -0.110 19700 2572 1 15 . 1 1 109 109 MET HA H 109 3.879 3.879 4.176 -0.297 19700 2573 1 15 . 1 1 109 109 MET H H 109 8.954 8.954 8.789 0.165 19700 2574 1 15 . 1 1 110 110 PHE N N 110 114.224 114.224 117.940 -3.716 19700 2575 1 15 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.708 0.239 19700 2576 1 15 . 1 1 110 110 PHE H H 110 7.943 7.943 8.289 -0.346 19700 2577 1 15 . 1 1 111 111 CYS N N 111 117.718 117.718 117.894 -0.176 19700 2578 1 15 . 1 1 111 111 CYS HA H 111 4.853 4.853 5.083 -0.230 19700 2579 1 15 . 1 1 111 111 CYS H H 111 8.141 8.141 7.969 0.172 19700 2580 1 15 . 1 1 112 112 GLY N N 112 106.232 106.232 105.856 0.376 19700 2581 1 15 . 1 1 112 112 GLY H H 112 8.738 8.738 8.523 0.215 19700 2582 1 15 . 1 1 113 113 LYS N N 113 123.354 123.354 123.884 -0.530 19700 2583 1 15 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.683 -0.292 19700 2584 1 15 . 1 1 113 113 LYS H H 113 7.064 7.064 7.709 -0.645 19700 2585 1 15 . 1 1 114 114 PHE N N 114 117.507 117.507 120.153 -2.646 19700 2586 1 15 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.112 0.232 19700 2587 1 15 . 1 1 114 114 PHE H H 114 7.823 7.823 8.068 -0.245 19700 2588 1 15 . 1 1 115 115 GLN N N 115 117.426 117.426 118.098 -0.672 19700 2589 1 15 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.633 0.155 19700 2590 1 15 . 1 1 115 115 GLN H H 115 9.044 9.044 9.012 0.031 19700 2591 1 15 . 1 1 116 116 ILE N N 116 124.941 124.941 123.364 1.577 19700 2592 1 15 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.484 -0.117 19700 2593 1 15 . 1 1 116 116 ILE H H 116 8.705 8.705 8.516 0.189 19700 2594 1 15 . 1 1 117 117 CYS N N 117 127.674 127.674 127.790 -0.116 19700 2595 1 15 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.595 0.253 19700 2596 1 15 . 1 1 117 117 CYS H H 117 9.103 9.103 9.000 0.103 19700 2597 1 15 . 1 1 118 118 ARG N N 118 120.976 120.976 123.827 -2.851 19700 2598 1 15 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.511 0.001 19700 2599 1 15 . 1 1 118 118 ARG H H 118 8.396 8.396 8.645 -0.249 19700 2600 1 15 . 1 1 119 119 ASN N N 119 119.240 119.240 118.284 0.956 19700 2601 1 15 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.453 0.107 19700 2602 1 15 . 1 1 119 119 ASN H H 119 8.836 8.836 8.502 0.334 19700 2603 1 15 . 1 1 120 120 GLY N N 120 111.230 111.230 107.410 3.820 19700 2604 1 15 . 1 1 120 120 GLY H H 120 8.755 8.755 8.647 0.108 19700 2605 1 15 . 1 1 121 121 GLU N N 121 119.650 119.650 120.344 -0.694 19700 2606 1 15 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.725 -0.475 19700 2607 1 15 . 1 1 121 121 GLU H H 121 8.158 8.158 7.632 0.526 19700 2608 1 15 . 1 1 122 122 LYS N N 122 120.471 120.471 121.398 -0.927 19700 2609 1 15 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.473 0.086 19700 2610 1 15 . 1 1 122 122 LYS H H 122 7.622 7.622 8.465 -0.843 19700 2611 1 15 . 1 1 123 123 ILE N N 123 118.223 118.223 119.683 -1.460 19700 2612 1 15 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.462 0.294 19700 2613 1 15 . 1 1 123 123 ILE H H 123 8.142 8.142 7.627 0.515 19700 2614 1 15 . 1 1 124 124 CYS N N 124 118.872 118.872 124.906 -6.034 19700 2615 1 15 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.449 0.536 19700 2616 1 15 . 1 1 124 124 CYS H H 124 9.196 9.196 9.069 0.127 19700 2617 1 15 . 1 1 125 125 PHE N N 125 116.458 116.458 114.717 1.741 19700 2618 1 15 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.667 0.650 19700 2619 1 15 . 1 1 125 125 PHE H H 125 8.958 8.958 8.844 0.114 19700 2620 1 15 . 1 1 126 126 LYS N N 126 125.559 125.559 123.319 2.240 19700 2621 1 15 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.967 0.184 19700 2622 1 15 . 1 1 126 126 LYS H H 126 9.109 9.109 8.946 0.163 19700 2623 1 15 . 1 1 127 127 LYS N N 127 124.796 124.796 124.627 0.169 19700 2624 1 15 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.427 -0.210 19700 2625 1 15 . 1 1 127 127 LYS H H 127 9.498 9.498 8.376 1.122 19700 2626 1 15 . 1 1 128 128 LEU N N 128 126.430 126.430 121.650 4.780 19700 2627 1 15 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.850 0.591 19700 2628 1 15 . 1 1 128 128 LEU H H 128 9.105 9.105 8.702 0.403 19700 2629 1 15 . 1 1 129 129 HIS N N 129 124.315 124.315 122.363 1.952 19700 2630 1 15 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.760 0.170 19700 2631 1 15 . 1 1 129 129 HIS H H 129 9.123 9.123 8.917 0.206 19700 2632 1 15 . 1 1 130 130 GLN N N 130 120.311 120.311 117.573 2.738 19700 2633 1 15 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.416 -0.032 19700 2634 1 15 . 1 1 130 130 GLN H H 130 8.246 8.246 7.372 0.874 19700 2635 1 15 . 1 1 131 131 ARG N N 131 123.995 123.995 122.129 1.866 19700 2636 1 15 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.421 -0.131 19700 2637 1 15 . 1 1 131 131 ARG H H 131 8.510 8.510 8.642 -0.132 19700 2638 1 15 . 1 1 132 132 ARG N N 132 121.592 121.592 120.948 0.644 19700 2639 1 15 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.164 0.144 19700 2640 1 15 . 1 1 132 132 ARG H H 132 8.183 8.183 7.848 0.335 19700 2641 1 15 . 1 1 133 133 ALA N N 133 124.315 124.315 124.334 -0.019 19700 2642 1 15 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.314 -0.078 19700 2643 1 15 . 1 1 133 133 ALA H H 133 8.249 8.249 8.428 -0.179 19700 2644 1 15 . 1 1 134 134 LEU N N 134 119.576 119.576 116.505 3.071 19700 2645 1 15 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.246 0.019 19700 2646 1 15 . 1 1 134 134 LEU H H 134 8.146 8.146 8.010 0.136 19700 2647 1 15 . 1 1 135 135 SER N N 135 113.103 113.103 112.984 0.119 19700 2648 1 15 . 1 1 135 135 SER HA H 135 4.504 4.504 4.241 0.263 19700 2649 1 15 . 1 1 135 135 SER H H 135 7.980 7.980 7.501 0.479 19700 2650 1 15 . 1 1 136 136 TRP N N 136 123.354 123.354 121.026 2.328 19700 2651 1 15 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.922 -0.069 19700 2652 1 15 . 1 1 136 136 TRP H H 136 8.027 8.027 7.409 0.618 19700 2653 1 15 . 1 1 137 137 ARG N N 137 120.614 120.614 121.028 -0.414 19700 2654 1 15 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.813 -0.139 19700 2655 1 15 . 1 1 137 137 ARG H H 137 7.991 7.991 8.573 -0.582 19700 2656 1 15 . 1 1 138 138 TYR N N 138 119.354 119.354 118.579 0.775 19700 2657 1 15 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.244 0.170 19700 2658 1 15 . 1 1 138 138 TYR H H 138 9.191 9.191 8.733 0.458 19700 2659 1 15 . 1 1 139 139 ILE N N 139 119.510 119.510 122.353 -2.843 19700 2660 1 15 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.278 0.040 19700 2661 1 15 . 1 1 139 139 ILE H H 139 9.104 9.104 9.075 0.029 19700 2662 1 15 . 1 1 140 140 ARG N N 140 125.596 125.596 126.524 -0.928 19700 2663 1 15 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.117 -0.301 19700 2664 1 15 . 1 1 140 140 ARG H H 140 8.393 8.393 8.273 0.120 19700 2665 1 15 . 1 1 141 141 GLY N N 141 103.964 103.964 110.103 -6.139 19700 2666 1 15 . 1 1 141 141 GLY H H 141 6.307 6.307 7.574 -1.268 19700 2667 1 15 . 1 1 142 142 CYS N N 142 117.908 117.908 119.776 -1.868 19700 2668 1 15 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.851 0.905 19700 2669 1 15 . 1 1 142 142 CYS H H 142 8.184 8.184 8.628 -0.444 19700 2670 1 15 . 1 1 143 143 ALA N N 143 121.268 121.268 123.236 -1.968 19700 2671 1 15 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.858 -0.063 19700 2672 1 15 . 1 1 143 143 ALA H H 143 9.508 9.508 8.687 0.821 19700 2673 1 15 . 1 1 144 144 ASP N N 144 118.068 118.068 118.816 -0.748 19700 2674 1 15 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.672 0.220 19700 2675 1 15 . 1 1 144 144 ASP H H 144 9.030 9.030 8.625 0.405 19700 2676 1 15 . 1 1 145 145 THR N N 145 108.476 108.476 108.342 0.134 19700 2677 1 15 . 1 1 145 145 THR HA H 145 4.422 4.422 4.358 0.064 19700 2678 1 15 . 1 1 145 145 THR H H 145 7.401 7.401 7.441 -0.040 19700 2679 1 15 . 1 1 146 146 CYS N N 146 123.516 123.516 122.926 0.590 19700 2680 1 15 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.364 0.349 19700 2681 1 15 . 1 1 146 146 CYS H H 146 8.850 8.850 8.541 0.309 19700 2682 1 15 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.421 -0.165 19700 2683 1 15 . 1 1 148 148 VAL N N 148 118.686 118.686 122.846 -4.160 19700 2684 1 15 . 1 1 148 148 VAL HA H 148 4.086 4.086 3.947 0.139 19700 2685 1 15 . 1 1 148 148 VAL H H 148 7.857 7.857 8.151 -0.294 19700 2686 1 15 . 1 1 149 149 GLY N N 149 113.423 113.423 111.531 1.892 19700 2687 1 15 . 1 1 149 149 GLY H H 149 8.357 8.357 8.133 0.224 19700 2688 1 15 . 1 1 150 150 LYS N N 150 121.492 121.492 121.292 0.200 19700 2689 1 15 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.559 0.068 19700 2690 1 15 . 1 1 150 150 LYS H H 150 8.574 8.574 8.254 0.320 19700 2691 1 15 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.445 -0.103 19700 2692 1 15 . 1 1 152 152 TYR N N 152 111.257 111.257 118.842 -7.585 19700 2693 1 15 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.555 -0.031 19700 2694 1 15 . 1 1 152 152 TYR H H 152 7.127 7.127 7.871 -0.744 19700 2695 1 15 . 1 1 153 153 GLU N N 153 119.670 119.670 117.606 2.064 19700 2696 1 15 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.369 0.038 19700 2697 1 15 . 1 1 153 153 GLU H H 153 7.603 7.603 7.639 -0.036 19700 2698 1 15 . 1 1 154 154 MET N N 154 117.748 117.748 115.961 1.787 19700 2699 1 15 . 1 1 154 154 MET HA H 154 4.335 4.335 4.088 0.247 19700 2700 1 15 . 1 1 154 154 MET H H 154 8.052 8.052 7.453 0.599 19700 2701 1 15 . 1 1 155 155 ILE N N 155 121.057 121.057 118.964 2.093 19700 2702 1 15 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.050 0.494 19700 2703 1 15 . 1 1 155 155 ILE H H 155 8.393 8.393 8.294 0.099 19700 2704 1 15 . 1 1 156 156 GLU N N 156 127.999 127.999 129.130 -1.131 19700 2705 1 15 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.620 0.252 19700 2706 1 15 . 1 1 156 156 GLU H H 156 8.994 8.994 8.624 0.370 19700 2707 1 15 . 1 1 157 157 CYS N N 157 123.034 123.034 120.845 2.189 19700 2708 1 15 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.634 -0.116 19700 2709 1 15 . 1 1 157 157 CYS H H 157 9.029 9.029 8.564 0.465 19700 2710 1 15 . 1 1 158 158 CYS N N 158 119.670 119.670 119.381 0.289 19700 2711 1 15 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.912 0.259 19700 2712 1 15 . 1 1 158 158 CYS H H 158 9.344 9.344 9.096 0.248 19700 2713 1 15 . 1 1 159 159 SER N N 159 114.684 114.684 117.235 -2.551 19700 2714 1 15 . 1 1 159 159 SER HA H 159 5.112 5.112 4.779 0.333 19700 2715 1 15 . 1 1 159 159 SER H H 159 9.064 9.064 8.588 0.476 19700 2716 1 15 . 1 1 160 160 THR N N 160 111.828 111.828 113.813 -1.985 19700 2717 1 15 . 1 1 160 160 THR HA H 160 4.784 4.784 4.538 0.246 19700 2718 1 15 . 1 1 160 160 THR H H 160 7.626 7.626 7.530 0.096 19700 2719 1 15 . 1 1 161 161 ASP N N 161 118.279 118.279 123.297 -5.018 19700 2720 1 15 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.370 0.486 19700 2721 1 15 . 1 1 161 161 ASP H H 161 8.332 8.332 8.529 -0.197 19700 2722 1 15 . 1 1 162 162 LYS N N 162 116.091 116.091 117.054 -0.963 19700 2723 1 15 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.717 -0.265 19700 2724 1 15 . 1 1 162 162 LYS H H 162 9.460 9.460 8.686 0.774 19700 2725 1 15 . 1 1 163 163 CYS N N 163 111.859 111.859 115.918 -4.059 19700 2726 1 15 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.236 0.180 19700 2727 1 15 . 1 1 163 163 CYS H H 163 7.751 7.751 8.623 -0.872 19700 2728 1 15 . 1 1 164 164 ASN N N 164 122.713 122.713 116.640 6.073 19700 2729 1 15 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.564 0.120 19700 2730 1 15 . 1 1 164 164 ASN H H 164 9.396 9.396 8.383 1.013 19700 2731 1 16 . 1 1 101 101 LEU N N 101 128.488 128.488 121.910 6.578 19700 2732 1 16 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.829 -0.107 19700 2733 1 16 . 1 1 101 101 LEU H H 101 8.706 8.706 8.622 0.084 19700 2734 1 16 . 1 1 102 102 THR N N 102 117.086 117.086 119.735 -2.649 19700 2735 1 16 . 1 1 102 102 THR HA H 102 5.198 5.198 5.170 0.028 19700 2736 1 16 . 1 1 102 102 THR H H 102 7.729 7.729 8.316 -0.587 19700 2737 1 16 . 1 1 103 103 CYS N N 103 119.021 119.021 125.480 -6.459 19700 2738 1 16 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.768 0.360 19700 2739 1 16 . 1 1 103 103 CYS H H 103 8.514 8.514 9.340 -0.826 19700 2740 1 16 . 1 1 104 104 LEU N N 104 123.028 123.028 122.209 0.819 19700 2741 1 16 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.597 0.214 19700 2742 1 16 . 1 1 104 104 LEU H H 104 9.147 9.147 8.328 0.819 19700 2743 1 16 . 1 1 105 105 ASN N N 105 119.029 119.029 118.490 0.539 19700 2744 1 16 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.907 -0.101 19700 2745 1 16 . 1 1 105 105 ASN H H 105 8.611 8.611 8.751 -0.140 19700 2746 1 16 . 1 1 106 106 CYS N N 106 117.427 117.427 115.876 1.551 19700 2747 1 16 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.917 0.310 19700 2748 1 16 . 1 1 106 106 CYS H H 106 7.210 7.210 7.979 -0.769 19700 2749 1 16 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.353 0.711 19700 2750 1 16 . 1 1 108 108 GLU N N 108 119.996 119.996 118.093 1.903 19700 2751 1 16 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.322 0.254 19700 2752 1 16 . 1 1 108 108 GLU H H 108 7.777 7.777 7.890 -0.113 19700 2753 1 16 . 1 1 109 109 MET N N 109 121.587 121.587 123.072 -1.485 19700 2754 1 16 . 1 1 109 109 MET HA H 109 3.879 3.879 4.092 -0.213 19700 2755 1 16 . 1 1 109 109 MET H H 109 8.954 8.954 8.649 0.305 19700 2756 1 16 . 1 1 110 110 PHE N N 110 114.224 114.224 120.457 -6.233 19700 2757 1 16 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.613 0.334 19700 2758 1 16 . 1 1 110 110 PHE H H 110 7.943 7.943 8.240 -0.297 19700 2759 1 16 . 1 1 111 111 CYS N N 111 117.718 117.718 119.577 -1.859 19700 2760 1 16 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.949 -0.096 19700 2761 1 16 . 1 1 111 111 CYS H H 111 8.141 8.141 8.170 -0.029 19700 2762 1 16 . 1 1 112 112 GLY N N 112 106.232 106.232 107.541 -1.309 19700 2763 1 16 . 1 1 112 112 GLY H H 112 8.738 8.738 8.576 0.162 19700 2764 1 16 . 1 1 113 113 LYS N N 113 123.354 123.354 123.432 -0.078 19700 2765 1 16 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.585 -0.194 19700 2766 1 16 . 1 1 113 113 LYS H H 113 7.064 7.064 7.696 -0.632 19700 2767 1 16 . 1 1 114 114 PHE N N 114 117.507 117.507 120.174 -2.667 19700 2768 1 16 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.278 0.066 19700 2769 1 16 . 1 1 114 114 PHE H H 114 7.823 7.823 8.040 -0.217 19700 2770 1 16 . 1 1 115 115 GLN N N 115 117.426 117.426 118.125 -0.699 19700 2771 1 16 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.731 0.057 19700 2772 1 16 . 1 1 115 115 GLN H H 115 9.044 9.044 9.143 -0.099 19700 2773 1 16 . 1 1 116 116 ILE N N 116 124.941 124.941 122.842 2.099 19700 2774 1 16 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.603 -0.236 19700 2775 1 16 . 1 1 116 116 ILE H H 116 8.705 8.705 8.431 0.274 19700 2776 1 16 . 1 1 117 117 CYS N N 117 127.674 127.674 127.602 0.072 19700 2777 1 16 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.618 0.230 19700 2778 1 16 . 1 1 117 117 CYS H H 117 9.103 9.103 9.114 -0.011 19700 2779 1 16 . 1 1 118 118 ARG N N 118 120.976 120.976 123.698 -2.722 19700 2780 1 16 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.555 -0.043 19700 2781 1 16 . 1 1 118 118 ARG H H 118 8.396 8.396 8.574 -0.178 19700 2782 1 16 . 1 1 119 119 ASN N N 119 119.240 119.240 118.526 0.714 19700 2783 1 16 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.489 0.071 19700 2784 1 16 . 1 1 119 119 ASN H H 119 8.836 8.836 8.474 0.362 19700 2785 1 16 . 1 1 120 120 GLY N N 120 111.230 111.230 108.873 2.357 19700 2786 1 16 . 1 1 120 120 GLY H H 120 8.755 8.755 8.617 0.138 19700 2787 1 16 . 1 1 121 121 GLU N N 121 119.650 119.650 120.386 -0.736 19700 2788 1 16 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.655 -0.405 19700 2789 1 16 . 1 1 121 121 GLU H H 121 8.158 8.158 7.709 0.449 19700 2790 1 16 . 1 1 122 122 LYS N N 122 120.471 120.471 121.532 -1.061 19700 2791 1 16 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.448 0.111 19700 2792 1 16 . 1 1 122 122 LYS H H 122 7.622 7.622 8.523 -0.901 19700 2793 1 16 . 1 1 123 123 ILE N N 123 118.223 118.223 119.114 -0.891 19700 2794 1 16 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.325 0.431 19700 2795 1 16 . 1 1 123 123 ILE H H 123 8.142 8.142 7.584 0.558 19700 2796 1 16 . 1 1 124 124 CYS N N 124 118.872 118.872 125.314 -6.442 19700 2797 1 16 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.403 0.582 19700 2798 1 16 . 1 1 124 124 CYS H H 124 9.196 9.196 9.001 0.195 19700 2799 1 16 . 1 1 125 125 PHE N N 125 116.458 116.458 114.804 1.654 19700 2800 1 16 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.702 0.615 19700 2801 1 16 . 1 1 125 125 PHE H H 125 8.958 8.958 8.966 -0.008 19700 2802 1 16 . 1 1 126 126 LYS N N 126 125.559 125.559 123.577 1.982 19700 2803 1 16 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.925 0.226 19700 2804 1 16 . 1 1 126 126 LYS H H 126 9.109 9.109 8.718 0.391 19700 2805 1 16 . 1 1 127 127 LYS N N 127 124.796 124.796 125.150 -0.354 19700 2806 1 16 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.495 -0.278 19700 2807 1 16 . 1 1 127 127 LYS H H 127 9.498 9.498 8.284 1.214 19700 2808 1 16 . 1 1 128 128 LEU N N 128 126.430 126.430 120.733 5.697 19700 2809 1 16 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.695 0.746 19700 2810 1 16 . 1 1 128 128 LEU H H 128 9.105 9.105 8.697 0.408 19700 2811 1 16 . 1 1 129 129 HIS N N 129 124.315 124.315 124.141 0.174 19700 2812 1 16 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.675 0.255 19700 2813 1 16 . 1 1 129 129 HIS H H 129 9.123 9.123 8.684 0.439 19700 2814 1 16 . 1 1 130 130 GLN N N 130 120.311 120.311 117.837 2.474 19700 2815 1 16 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.376 0.008 19700 2816 1 16 . 1 1 130 130 GLN H H 130 8.246 8.246 7.420 0.826 19700 2817 1 16 . 1 1 131 131 ARG N N 131 123.995 123.995 123.890 0.105 19700 2818 1 16 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.542 -0.252 19700 2819 1 16 . 1 1 131 131 ARG H H 131 8.510 8.510 8.857 -0.347 19700 2820 1 16 . 1 1 132 132 ARG N N 132 121.592 121.592 119.361 2.231 19700 2821 1 16 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.079 0.229 19700 2822 1 16 . 1 1 132 132 ARG H H 132 8.183 8.183 8.209 -0.026 19700 2823 1 16 . 1 1 133 133 ALA N N 133 124.315 124.315 121.248 3.067 19700 2824 1 16 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.167 0.069 19700 2825 1 16 . 1 1 133 133 ALA H H 133 8.249 8.249 7.886 0.363 19700 2826 1 16 . 1 1 134 134 LEU N N 134 119.576 119.576 120.069 -0.493 19700 2827 1 16 . 1 1 134 134 LEU HA H 134 4.265 4.265 3.988 0.277 19700 2828 1 16 . 1 1 134 134 LEU H H 134 8.146 8.146 8.152 -0.006 19700 2829 1 16 . 1 1 135 135 SER N N 135 113.103 113.103 114.266 -1.163 19700 2830 1 16 . 1 1 135 135 SER HA H 135 4.504 4.504 4.158 0.346 19700 2831 1 16 . 1 1 135 135 SER H H 135 7.980 7.980 7.750 0.230 19700 2832 1 16 . 1 1 136 136 TRP N N 136 123.354 123.354 121.050 2.304 19700 2833 1 16 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.917 -0.064 19700 2834 1 16 . 1 1 136 136 TRP H H 136 8.027 8.027 8.419 -0.392 19700 2835 1 16 . 1 1 137 137 ARG N N 137 120.614 120.614 123.699 -3.085 19700 2836 1 16 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.931 -0.257 19700 2837 1 16 . 1 1 137 137 ARG H H 137 7.991 7.991 8.672 -0.681 19700 2838 1 16 . 1 1 138 138 TYR N N 138 119.354 119.354 120.595 -1.241 19700 2839 1 16 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.117 0.297 19700 2840 1 16 . 1 1 138 138 TYR H H 138 9.191 9.191 8.678 0.513 19700 2841 1 16 . 1 1 139 139 ILE N N 139 119.510 119.510 124.150 -4.640 19700 2842 1 16 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.345 -0.027 19700 2843 1 16 . 1 1 139 139 ILE H H 139 9.104 9.104 9.138 -0.034 19700 2844 1 16 . 1 1 140 140 ARG N N 140 125.596 125.596 126.476 -0.880 19700 2845 1 16 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.081 -0.265 19700 2846 1 16 . 1 1 140 140 ARG H H 140 8.393 8.393 8.290 0.103 19700 2847 1 16 . 1 1 141 141 GLY N N 141 103.964 103.964 109.171 -5.207 19700 2848 1 16 . 1 1 141 141 GLY H H 141 6.307 6.307 7.484 -1.177 19700 2849 1 16 . 1 1 142 142 CYS N N 142 117.908 117.908 118.784 -0.876 19700 2850 1 16 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.934 0.822 19700 2851 1 16 . 1 1 142 142 CYS H H 142 8.184 8.184 8.569 -0.385 19700 2852 1 16 . 1 1 143 143 ALA N N 143 121.268 121.268 122.189 -0.921 19700 2853 1 16 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.671 0.124 19700 2854 1 16 . 1 1 143 143 ALA H H 143 9.508 9.508 8.615 0.893 19700 2855 1 16 . 1 1 144 144 ASP N N 144 118.068 118.068 117.511 0.557 19700 2856 1 16 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.683 0.209 19700 2857 1 16 . 1 1 144 144 ASP H H 144 9.030 9.030 8.603 0.427 19700 2858 1 16 . 1 1 145 145 THR N N 145 108.476 108.476 108.376 0.100 19700 2859 1 16 . 1 1 145 145 THR HA H 145 4.422 4.422 4.358 0.064 19700 2860 1 16 . 1 1 145 145 THR H H 145 7.401 7.401 7.457 -0.056 19700 2861 1 16 . 1 1 146 146 CYS N N 146 123.516 123.516 124.007 -0.491 19700 2862 1 16 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.463 0.250 19700 2863 1 16 . 1 1 146 146 CYS H H 146 8.850 8.850 8.662 0.188 19700 2864 1 16 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.466 -0.210 19700 2865 1 16 . 1 1 148 148 VAL N N 148 118.686 118.686 118.922 -0.236 19700 2866 1 16 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.215 -0.129 19700 2867 1 16 . 1 1 148 148 VAL H H 148 7.857 7.857 8.049 -0.192 19700 2868 1 16 . 1 1 149 149 GLY N N 149 113.423 113.423 111.613 1.810 19700 2869 1 16 . 1 1 149 149 GLY H H 149 8.357 8.357 8.204 0.153 19700 2870 1 16 . 1 1 150 150 LYS N N 150 121.492 121.492 121.095 0.397 19700 2871 1 16 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.848 -0.221 19700 2872 1 16 . 1 1 150 150 LYS H H 150 8.574 8.574 8.348 0.226 19700 2873 1 16 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.365 -0.023 19700 2874 1 16 . 1 1 152 152 TYR N N 152 111.257 111.257 117.676 -6.419 19700 2875 1 16 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.455 0.069 19700 2876 1 16 . 1 1 152 152 TYR H H 152 7.127 7.127 8.111 -0.984 19700 2877 1 16 . 1 1 153 153 GLU N N 153 119.670 119.670 116.972 2.698 19700 2878 1 16 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.241 0.166 19700 2879 1 16 . 1 1 153 153 GLU H H 153 7.603 7.603 7.639 -0.036 19700 2880 1 16 . 1 1 154 154 MET N N 154 117.748 117.748 115.235 2.513 19700 2881 1 16 . 1 1 154 154 MET HA H 154 4.335 4.335 4.037 0.298 19700 2882 1 16 . 1 1 154 154 MET H H 154 8.052 8.052 7.377 0.675 19700 2883 1 16 . 1 1 155 155 ILE N N 155 121.057 121.057 118.838 2.219 19700 2884 1 16 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.032 0.512 19700 2885 1 16 . 1 1 155 155 ILE H H 155 8.393 8.393 8.184 0.209 19700 2886 1 16 . 1 1 156 156 GLU N N 156 127.999 127.999 129.379 -1.380 19700 2887 1 16 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.678 0.194 19700 2888 1 16 . 1 1 156 156 GLU H H 156 8.994 8.994 8.135 0.859 19700 2889 1 16 . 1 1 157 157 CYS N N 157 123.034 123.034 121.450 1.584 19700 2890 1 16 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.617 -0.099 19700 2891 1 16 . 1 1 157 157 CYS H H 157 9.029 9.029 8.562 0.467 19700 2892 1 16 . 1 1 158 158 CYS N N 158 119.670 119.670 119.940 -0.270 19700 2893 1 16 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.834 0.337 19700 2894 1 16 . 1 1 158 158 CYS H H 158 9.344 9.344 9.077 0.267 19700 2895 1 16 . 1 1 159 159 SER N N 159 114.684 114.684 116.704 -2.020 19700 2896 1 16 . 1 1 159 159 SER HA H 159 5.112 5.112 4.678 0.434 19700 2897 1 16 . 1 1 159 159 SER H H 159 9.064 9.064 8.622 0.442 19700 2898 1 16 . 1 1 160 160 THR N N 160 111.828 111.828 112.770 -0.942 19700 2899 1 16 . 1 1 160 160 THR HA H 160 4.784 4.784 4.563 0.221 19700 2900 1 16 . 1 1 160 160 THR H H 160 7.626 7.626 7.688 -0.062 19700 2901 1 16 . 1 1 161 161 ASP N N 161 118.279 118.279 123.325 -5.046 19700 2902 1 16 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.157 0.699 19700 2903 1 16 . 1 1 161 161 ASP H H 161 8.332 8.332 8.551 -0.219 19700 2904 1 16 . 1 1 162 162 LYS N N 162 116.091 116.091 117.351 -1.260 19700 2905 1 16 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.716 -0.264 19700 2906 1 16 . 1 1 162 162 LYS H H 162 9.460 9.460 8.174 1.286 19700 2907 1 16 . 1 1 163 163 CYS N N 163 111.859 111.859 115.865 -4.006 19700 2908 1 16 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.141 0.275 19700 2909 1 16 . 1 1 163 163 CYS H H 163 7.751 7.751 8.414 -0.663 19700 2910 1 16 . 1 1 164 164 ASN N N 164 122.713 122.713 117.562 5.151 19700 2911 1 16 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.556 0.128 19700 2912 1 16 . 1 1 164 164 ASN H H 164 9.396 9.396 8.296 1.100 19700 2913 1 17 . 1 1 101 101 LEU N N 101 128.488 128.488 121.575 6.913 19700 2914 1 17 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.916 -0.194 19700 2915 1 17 . 1 1 101 101 LEU H H 101 8.706 8.706 8.420 0.286 19700 2916 1 17 . 1 1 102 102 THR N N 102 117.086 117.086 119.862 -2.776 19700 2917 1 17 . 1 1 102 102 THR HA H 102 5.198 5.198 4.940 0.258 19700 2918 1 17 . 1 1 102 102 THR H H 102 7.729 7.729 8.278 -0.549 19700 2919 1 17 . 1 1 103 103 CYS N N 103 119.021 119.021 124.356 -5.335 19700 2920 1 17 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.811 0.317 19700 2921 1 17 . 1 1 103 103 CYS H H 103 8.514 8.514 9.345 -0.831 19700 2922 1 17 . 1 1 104 104 LEU N N 104 123.028 123.028 121.606 1.422 19700 2923 1 17 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.672 0.139 19700 2924 1 17 . 1 1 104 104 LEU H H 104 9.147 9.147 8.447 0.700 19700 2925 1 17 . 1 1 105 105 ASN N N 105 119.029 119.029 115.965 3.064 19700 2926 1 17 . 1 1 105 105 ASN HA H 105 4.806 4.806 5.119 -0.313 19700 2927 1 17 . 1 1 105 105 ASN H H 105 8.611 8.611 8.714 -0.103 19700 2928 1 17 . 1 1 106 106 CYS N N 106 117.427 117.427 115.982 1.445 19700 2929 1 17 . 1 1 106 106 CYS HA H 106 5.227 5.227 5.073 0.154 19700 2930 1 17 . 1 1 106 106 CYS H H 106 7.210 7.210 8.009 -0.799 19700 2931 1 17 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.777 0.287 19700 2932 1 17 . 1 1 108 108 GLU N N 108 119.996 119.996 118.453 1.543 19700 2933 1 17 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.413 0.163 19700 2934 1 17 . 1 1 108 108 GLU H H 108 7.777 7.777 8.164 -0.387 19700 2935 1 17 . 1 1 109 109 MET N N 109 121.587 121.587 121.235 0.352 19700 2936 1 17 . 1 1 109 109 MET HA H 109 3.879 3.879 4.390 -0.511 19700 2937 1 17 . 1 1 109 109 MET H H 109 8.954 8.954 8.707 0.247 19700 2938 1 17 . 1 1 110 110 PHE N N 110 114.224 114.224 117.988 -3.764 19700 2939 1 17 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.515 0.432 19700 2940 1 17 . 1 1 110 110 PHE H H 110 7.943 7.943 8.109 -0.166 19700 2941 1 17 . 1 1 111 111 CYS N N 111 117.718 117.718 117.727 -0.009 19700 2942 1 17 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.936 -0.083 19700 2943 1 17 . 1 1 111 111 CYS H H 111 8.141 8.141 7.863 0.278 19700 2944 1 17 . 1 1 112 112 GLY N N 112 106.232 106.232 106.025 0.207 19700 2945 1 17 . 1 1 112 112 GLY H H 112 8.738 8.738 8.477 0.261 19700 2946 1 17 . 1 1 113 113 LYS N N 113 123.354 123.354 123.703 -0.349 19700 2947 1 17 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.618 -0.227 19700 2948 1 17 . 1 1 113 113 LYS H H 113 7.064 7.064 7.718 -0.654 19700 2949 1 17 . 1 1 114 114 PHE N N 114 117.507 117.507 120.420 -2.913 19700 2950 1 17 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.512 -0.168 19700 2951 1 17 . 1 1 114 114 PHE H H 114 7.823 7.823 8.009 -0.186 19700 2952 1 17 . 1 1 115 115 GLN N N 115 117.426 117.426 118.112 -0.686 19700 2953 1 17 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.650 0.138 19700 2954 1 17 . 1 1 115 115 GLN H H 115 9.044 9.044 9.216 -0.172 19700 2955 1 17 . 1 1 116 116 ILE N N 116 124.941 124.941 123.683 1.258 19700 2956 1 17 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.631 -0.264 19700 2957 1 17 . 1 1 116 116 ILE H H 116 8.705 8.705 8.486 0.219 19700 2958 1 17 . 1 1 117 117 CYS N N 117 127.674 127.674 127.185 0.489 19700 2959 1 17 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.592 0.256 19700 2960 1 17 . 1 1 117 117 CYS H H 117 9.103 9.103 8.876 0.227 19700 2961 1 17 . 1 1 118 118 ARG N N 118 120.976 120.976 123.303 -2.327 19700 2962 1 17 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.497 0.015 19700 2963 1 17 . 1 1 118 118 ARG H H 118 8.396 8.396 8.600 -0.204 19700 2964 1 17 . 1 1 119 119 ASN N N 119 119.240 119.240 117.763 1.477 19700 2965 1 17 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.488 0.072 19700 2966 1 17 . 1 1 119 119 ASN H H 119 8.836 8.836 8.372 0.464 19700 2967 1 17 . 1 1 120 120 GLY N N 120 111.230 111.230 108.192 3.038 19700 2968 1 17 . 1 1 120 120 GLY H H 120 8.755 8.755 8.532 0.223 19700 2969 1 17 . 1 1 121 121 GLU N N 121 119.650 119.650 119.936 -0.286 19700 2970 1 17 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.636 -0.386 19700 2971 1 17 . 1 1 121 121 GLU H H 121 8.158 8.158 7.708 0.450 19700 2972 1 17 . 1 1 122 122 LYS N N 122 120.471 120.471 121.266 -0.795 19700 2973 1 17 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.411 0.148 19700 2974 1 17 . 1 1 122 122 LYS H H 122 7.622 7.622 8.516 -0.894 19700 2975 1 17 . 1 1 123 123 ILE N N 123 118.223 118.223 119.063 -0.840 19700 2976 1 17 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.443 0.313 19700 2977 1 17 . 1 1 123 123 ILE H H 123 8.142 8.142 7.694 0.448 19700 2978 1 17 . 1 1 124 124 CYS N N 124 118.872 118.872 122.692 -3.820 19700 2979 1 17 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.495 0.490 19700 2980 1 17 . 1 1 124 124 CYS H H 124 9.196 9.196 9.188 0.008 19700 2981 1 17 . 1 1 125 125 PHE N N 125 116.458 116.458 115.176 1.282 19700 2982 1 17 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.667 0.650 19700 2983 1 17 . 1 1 125 125 PHE H H 125 8.958 8.958 8.729 0.229 19700 2984 1 17 . 1 1 126 126 LYS N N 126 125.559 125.559 122.581 2.978 19700 2985 1 17 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.884 0.267 19700 2986 1 17 . 1 1 126 126 LYS H H 126 9.109 9.109 8.590 0.519 19700 2987 1 17 . 1 1 127 127 LYS N N 127 124.796 124.796 126.450 -1.654 19700 2988 1 17 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.461 -0.244 19700 2989 1 17 . 1 1 127 127 LYS H H 127 9.498 9.498 8.283 1.215 19700 2990 1 17 . 1 1 128 128 LEU N N 128 126.430 126.430 121.705 4.725 19700 2991 1 17 . 1 1 128 128 LEU HA H 128 4.441 4.441 2.858 1.583 19700 2992 1 17 . 1 1 128 128 LEU H H 128 9.105 9.105 8.541 0.564 19700 2993 1 17 . 1 1 129 129 HIS N N 129 124.315 124.315 126.051 -1.736 19700 2994 1 17 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.611 0.319 19700 2995 1 17 . 1 1 129 129 HIS H H 129 9.123 9.123 7.993 1.130 19700 2996 1 17 . 1 1 130 130 GLN N N 130 120.311 120.311 115.821 4.490 19700 2997 1 17 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.651 -0.267 19700 2998 1 17 . 1 1 130 130 GLN H H 130 8.246 8.246 7.824 0.422 19700 2999 1 17 . 1 1 131 131 ARG N N 131 123.995 123.995 120.769 3.226 19700 3000 1 17 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.532 -0.242 19700 3001 1 17 . 1 1 131 131 ARG H H 131 8.510 8.510 8.656 -0.146 19700 3002 1 17 . 1 1 132 132 ARG N N 132 121.592 121.592 121.085 0.507 19700 3003 1 17 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.248 0.060 19700 3004 1 17 . 1 1 132 132 ARG H H 132 8.183 8.183 8.099 0.084 19700 3005 1 17 . 1 1 133 133 ALA N N 133 124.315 124.315 121.599 2.716 19700 3006 1 17 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.196 0.040 19700 3007 1 17 . 1 1 133 133 ALA H H 133 8.249 8.249 7.802 0.447 19700 3008 1 17 . 1 1 134 134 LEU N N 134 119.576 119.576 117.044 2.532 19700 3009 1 17 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.037 0.228 19700 3010 1 17 . 1 1 134 134 LEU H H 134 8.146 8.146 8.383 -0.237 19700 3011 1 17 . 1 1 135 135 SER N N 135 113.103 113.103 110.778 2.325 19700 3012 1 17 . 1 1 135 135 SER HA H 135 4.504 4.504 4.286 0.218 19700 3013 1 17 . 1 1 135 135 SER H H 135 7.980 7.980 7.519 0.461 19700 3014 1 17 . 1 1 136 136 TRP N N 136 123.354 123.354 119.365 3.989 19700 3015 1 17 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.648 0.205 19700 3016 1 17 . 1 1 136 136 TRP H H 136 8.027 8.027 8.404 -0.377 19700 3017 1 17 . 1 1 137 137 ARG N N 137 120.614 120.614 121.389 -0.775 19700 3018 1 17 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.811 -0.137 19700 3019 1 17 . 1 1 137 137 ARG H H 137 7.991 7.991 8.379 -0.388 19700 3020 1 17 . 1 1 138 138 TYR N N 138 119.354 119.354 122.737 -3.383 19700 3021 1 17 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.132 0.282 19700 3022 1 17 . 1 1 138 138 TYR H H 138 9.191 9.191 9.017 0.174 19700 3023 1 17 . 1 1 139 139 ILE N N 139 119.510 119.510 120.548 -1.038 19700 3024 1 17 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.447 -0.129 19700 3025 1 17 . 1 1 139 139 ILE H H 139 9.104 9.104 9.091 0.013 19700 3026 1 17 . 1 1 140 140 ARG N N 140 125.596 125.596 125.895 -0.299 19700 3027 1 17 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.033 -0.217 19700 3028 1 17 . 1 1 140 140 ARG H H 140 8.393 8.393 8.660 -0.267 19700 3029 1 17 . 1 1 141 141 GLY N N 141 103.964 103.964 109.791 -5.827 19700 3030 1 17 . 1 1 141 141 GLY H H 141 6.307 6.307 7.563 -1.256 19700 3031 1 17 . 1 1 142 142 CYS N N 142 117.908 117.908 119.374 -1.466 19700 3032 1 17 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.942 0.814 19700 3033 1 17 . 1 1 142 142 CYS H H 142 8.184 8.184 8.601 -0.417 19700 3034 1 17 . 1 1 143 143 ALA N N 143 121.268 121.268 124.203 -2.935 19700 3035 1 17 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.966 -0.171 19700 3036 1 17 . 1 1 143 143 ALA H H 143 9.508 9.508 8.718 0.790 19700 3037 1 17 . 1 1 144 144 ASP N N 144 118.068 118.068 118.178 -0.110 19700 3038 1 17 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.596 0.296 19700 3039 1 17 . 1 1 144 144 ASP H H 144 9.030 9.030 8.946 0.084 19700 3040 1 17 . 1 1 145 145 THR N N 145 108.476 108.476 109.042 -0.566 19700 3041 1 17 . 1 1 145 145 THR HA H 145 4.422 4.422 4.354 0.068 19700 3042 1 17 . 1 1 145 145 THR H H 145 7.401 7.401 7.373 0.028 19700 3043 1 17 . 1 1 146 146 CYS N N 146 123.516 123.516 122.410 1.106 19700 3044 1 17 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.363 0.350 19700 3045 1 17 . 1 1 146 146 CYS H H 146 8.850 8.850 8.422 0.428 19700 3046 1 17 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.427 -0.171 19700 3047 1 17 . 1 1 148 148 VAL N N 148 118.686 118.686 118.956 -0.270 19700 3048 1 17 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.116 -0.030 19700 3049 1 17 . 1 1 148 148 VAL H H 148 7.857 7.857 8.237 -0.380 19700 3050 1 17 . 1 1 149 149 GLY N N 149 113.423 113.423 112.445 0.978 19700 3051 1 17 . 1 1 149 149 GLY H H 149 8.357 8.357 8.044 0.313 19700 3052 1 17 . 1 1 150 150 LYS N N 150 121.492 121.492 120.779 0.713 19700 3053 1 17 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.741 -0.114 19700 3054 1 17 . 1 1 150 150 LYS H H 150 8.574 8.574 8.463 0.111 19700 3055 1 17 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.401 -0.059 19700 3056 1 17 . 1 1 152 152 TYR N N 152 111.257 111.257 117.997 -6.740 19700 3057 1 17 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.457 0.067 19700 3058 1 17 . 1 1 152 152 TYR H H 152 7.127 7.127 8.617 -1.490 19700 3059 1 17 . 1 1 153 153 GLU N N 153 119.670 119.670 118.331 1.339 19700 3060 1 17 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.334 0.073 19700 3061 1 17 . 1 1 153 153 GLU H H 153 7.603 7.603 7.684 -0.081 19700 3062 1 17 . 1 1 154 154 MET N N 154 117.748 117.748 116.876 0.872 19700 3063 1 17 . 1 1 154 154 MET HA H 154 4.335 4.335 4.093 0.242 19700 3064 1 17 . 1 1 154 154 MET H H 154 8.052 8.052 7.529 0.523 19700 3065 1 17 . 1 1 155 155 ILE N N 155 121.057 121.057 118.528 2.529 19700 3066 1 17 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.190 0.354 19700 3067 1 17 . 1 1 155 155 ILE H H 155 8.393 8.393 8.366 0.027 19700 3068 1 17 . 1 1 156 156 GLU N N 156 127.999 127.999 129.049 -1.050 19700 3069 1 17 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.718 0.154 19700 3070 1 17 . 1 1 156 156 GLU H H 156 8.994 8.994 8.309 0.685 19700 3071 1 17 . 1 1 157 157 CYS N N 157 123.034 123.034 121.029 2.005 19700 3072 1 17 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.674 -0.156 19700 3073 1 17 . 1 1 157 157 CYS H H 157 9.029 9.029 8.569 0.460 19700 3074 1 17 . 1 1 158 158 CYS N N 158 119.670 119.670 119.869 -0.199 19700 3075 1 17 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.933 0.238 19700 3076 1 17 . 1 1 158 158 CYS H H 158 9.344 9.344 9.131 0.213 19700 3077 1 17 . 1 1 159 159 SER N N 159 114.684 114.684 115.603 -0.919 19700 3078 1 17 . 1 1 159 159 SER HA H 159 5.112 5.112 4.789 0.323 19700 3079 1 17 . 1 1 159 159 SER H H 159 9.064 9.064 8.521 0.543 19700 3080 1 17 . 1 1 160 160 THR N N 160 111.828 111.828 112.790 -0.962 19700 3081 1 17 . 1 1 160 160 THR HA H 160 4.784 4.784 4.495 0.289 19700 3082 1 17 . 1 1 160 160 THR H H 160 7.626 7.626 7.532 0.094 19700 3083 1 17 . 1 1 161 161 ASP N N 161 118.279 118.279 123.433 -5.154 19700 3084 1 17 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.360 0.496 19700 3085 1 17 . 1 1 161 161 ASP H H 161 8.332 8.332 8.558 -0.226 19700 3086 1 17 . 1 1 162 162 LYS N N 162 116.091 116.091 119.592 -3.501 19700 3087 1 17 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.679 -0.227 19700 3088 1 17 . 1 1 162 162 LYS H H 162 9.460 9.460 8.317 1.143 19700 3089 1 17 . 1 1 163 163 CYS N N 163 111.859 111.859 115.462 -3.603 19700 3090 1 17 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.134 0.282 19700 3091 1 17 . 1 1 163 163 CYS H H 163 7.751 7.751 8.313 -0.562 19700 3092 1 17 . 1 1 164 164 ASN N N 164 122.713 122.713 118.494 4.219 19700 3093 1 17 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.567 0.117 19700 3094 1 17 . 1 1 164 164 ASN H H 164 9.396 9.396 8.132 1.264 19700 3095 1 18 . 1 1 101 101 LEU N N 101 128.488 128.488 122.813 5.675 19700 3096 1 18 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.909 -0.187 19700 3097 1 18 . 1 1 101 101 LEU H H 101 8.706 8.706 8.616 0.090 19700 3098 1 18 . 1 1 102 102 THR N N 102 117.086 117.086 120.185 -3.099 19700 3099 1 18 . 1 1 102 102 THR HA H 102 5.198 5.198 4.971 0.227 19700 3100 1 18 . 1 1 102 102 THR H H 102 7.729 7.729 8.412 -0.683 19700 3101 1 18 . 1 1 103 103 CYS N N 103 119.021 119.021 124.636 -5.615 19700 3102 1 18 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.802 0.326 19700 3103 1 18 . 1 1 103 103 CYS H H 103 8.514 8.514 9.305 -0.791 19700 3104 1 18 . 1 1 104 104 LEU N N 104 123.028 123.028 121.958 1.070 19700 3105 1 18 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.518 0.293 19700 3106 1 18 . 1 1 104 104 LEU H H 104 9.147 9.147 8.420 0.727 19700 3107 1 18 . 1 1 105 105 ASN N N 105 119.029 119.029 117.365 1.664 19700 3108 1 18 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.999 -0.193 19700 3109 1 18 . 1 1 105 105 ASN H H 105 8.611 8.611 8.756 -0.145 19700 3110 1 18 . 1 1 106 106 CYS N N 106 117.427 117.427 116.178 1.249 19700 3111 1 18 . 1 1 106 106 CYS HA H 106 5.227 5.227 5.039 0.188 19700 3112 1 18 . 1 1 106 106 CYS H H 106 7.210 7.210 8.155 -0.945 19700 3113 1 18 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.686 0.378 19700 3114 1 18 . 1 1 108 108 GLU N N 108 119.996 119.996 117.979 2.017 19700 3115 1 18 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.250 0.326 19700 3116 1 18 . 1 1 108 108 GLU H H 108 7.777 7.777 8.249 -0.472 19700 3117 1 18 . 1 1 109 109 MET N N 109 121.587 121.587 119.291 2.296 19700 3118 1 18 . 1 1 109 109 MET HA H 109 3.879 3.879 4.161 -0.282 19700 3119 1 18 . 1 1 109 109 MET H H 109 8.954 8.954 8.420 0.534 19700 3120 1 18 . 1 1 110 110 PHE N N 110 114.224 114.224 120.372 -6.148 19700 3121 1 18 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.534 0.413 19700 3122 1 18 . 1 1 110 110 PHE H H 110 7.943 7.943 8.426 -0.483 19700 3123 1 18 . 1 1 111 111 CYS N N 111 117.718 117.718 118.097 -0.379 19700 3124 1 18 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.879 -0.026 19700 3125 1 18 . 1 1 111 111 CYS H H 111 8.141 8.141 7.955 0.186 19700 3126 1 18 . 1 1 112 112 GLY N N 112 106.232 106.232 106.610 -0.378 19700 3127 1 18 . 1 1 112 112 GLY H H 112 8.738 8.738 8.479 0.259 19700 3128 1 18 . 1 1 113 113 LYS N N 113 123.354 123.354 123.603 -0.249 19700 3129 1 18 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.567 -0.176 19700 3130 1 18 . 1 1 113 113 LYS H H 113 7.064 7.064 7.741 -0.677 19700 3131 1 18 . 1 1 114 114 PHE N N 114 117.507 117.507 120.858 -3.351 19700 3132 1 18 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.134 0.210 19700 3133 1 18 . 1 1 114 114 PHE H H 114 7.823 7.823 8.005 -0.182 19700 3134 1 18 . 1 1 115 115 GLN N N 115 117.426 117.426 117.918 -0.492 19700 3135 1 18 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.625 0.163 19700 3136 1 18 . 1 1 115 115 GLN H H 115 9.044 9.044 9.142 -0.098 19700 3137 1 18 . 1 1 116 116 ILE N N 116 124.941 124.941 123.608 1.333 19700 3138 1 18 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.590 -0.223 19700 3139 1 18 . 1 1 116 116 ILE H H 116 8.705 8.705 8.500 0.205 19700 3140 1 18 . 1 1 117 117 CYS N N 117 127.674 127.674 127.649 0.025 19700 3141 1 18 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.619 0.229 19700 3142 1 18 . 1 1 117 117 CYS H H 117 9.103 9.103 8.903 0.200 19700 3143 1 18 . 1 1 118 118 ARG N N 118 120.976 120.976 123.810 -2.834 19700 3144 1 18 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.534 -0.022 19700 3145 1 18 . 1 1 118 118 ARG H H 118 8.396 8.396 8.575 -0.179 19700 3146 1 18 . 1 1 119 119 ASN N N 119 119.240 119.240 118.426 0.814 19700 3147 1 18 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.494 0.066 19700 3148 1 18 . 1 1 119 119 ASN H H 119 8.836 8.836 8.464 0.372 19700 3149 1 18 . 1 1 120 120 GLY N N 120 111.230 111.230 108.492 2.738 19700 3150 1 18 . 1 1 120 120 GLY H H 120 8.755 8.755 8.600 0.155 19700 3151 1 18 . 1 1 121 121 GLU N N 121 119.650 119.650 120.212 -0.562 19700 3152 1 18 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.652 -0.402 19700 3153 1 18 . 1 1 121 121 GLU H H 121 8.158 8.158 7.667 0.491 19700 3154 1 18 . 1 1 122 122 LYS N N 122 120.471 120.471 121.672 -1.201 19700 3155 1 18 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.437 0.122 19700 3156 1 18 . 1 1 122 122 LYS H H 122 7.622 7.622 8.528 -0.906 19700 3157 1 18 . 1 1 123 123 ILE N N 123 118.223 118.223 119.124 -0.901 19700 3158 1 18 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.410 0.346 19700 3159 1 18 . 1 1 123 123 ILE H H 123 8.142 8.142 7.594 0.548 19700 3160 1 18 . 1 1 124 124 CYS N N 124 118.872 118.872 125.479 -6.607 19700 3161 1 18 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.418 0.567 19700 3162 1 18 . 1 1 124 124 CYS H H 124 9.196 9.196 9.052 0.144 19700 3163 1 18 . 1 1 125 125 PHE N N 125 116.458 116.458 114.849 1.609 19700 3164 1 18 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.803 0.514 19700 3165 1 18 . 1 1 125 125 PHE H H 125 8.958 8.958 9.019 -0.061 19700 3166 1 18 . 1 1 126 126 LYS N N 126 125.559 125.559 123.528 2.031 19700 3167 1 18 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.952 0.199 19700 3168 1 18 . 1 1 126 126 LYS H H 126 9.109 9.109 8.757 0.352 19700 3169 1 18 . 1 1 127 127 LYS N N 127 124.796 124.796 124.548 0.248 19700 3170 1 18 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.429 -0.212 19700 3171 1 18 . 1 1 127 127 LYS H H 127 9.498 9.498 8.371 1.127 19700 3172 1 18 . 1 1 128 128 LEU N N 128 126.430 126.430 120.264 6.166 19700 3173 1 18 . 1 1 128 128 LEU HA H 128 4.441 4.441 2.987 1.454 19700 3174 1 18 . 1 1 128 128 LEU H H 128 9.105 9.105 8.426 0.679 19700 3175 1 18 . 1 1 129 129 HIS N N 129 124.315 124.315 124.760 -0.445 19700 3176 1 18 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.723 0.207 19700 3177 1 18 . 1 1 129 129 HIS H H 129 9.123 9.123 8.640 0.483 19700 3178 1 18 . 1 1 130 130 GLN N N 130 120.311 120.311 116.140 4.171 19700 3179 1 18 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.524 -0.140 19700 3180 1 18 . 1 1 130 130 GLN H H 130 8.246 8.246 7.861 0.385 19700 3181 1 18 . 1 1 131 131 ARG N N 131 123.995 123.995 122.798 1.197 19700 3182 1 18 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.532 -0.242 19700 3183 1 18 . 1 1 131 131 ARG H H 131 8.510 8.510 8.954 -0.444 19700 3184 1 18 . 1 1 132 132 ARG N N 132 121.592 121.592 120.715 0.877 19700 3185 1 18 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.143 0.165 19700 3186 1 18 . 1 1 132 132 ARG H H 132 8.183 8.183 7.990 0.193 19700 3187 1 18 . 1 1 133 133 ALA N N 133 124.315 124.315 118.559 5.756 19700 3188 1 18 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.492 -0.256 19700 3189 1 18 . 1 1 133 133 ALA H H 133 8.249 8.249 8.012 0.237 19700 3190 1 18 . 1 1 134 134 LEU N N 134 119.576 119.576 119.485 0.091 19700 3191 1 18 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.169 0.096 19700 3192 1 18 . 1 1 134 134 LEU H H 134 8.146 8.146 8.409 -0.263 19700 3193 1 18 . 1 1 135 135 SER N N 135 113.103 113.103 113.628 -0.525 19700 3194 1 18 . 1 1 135 135 SER HA H 135 4.504 4.504 4.091 0.413 19700 3195 1 18 . 1 1 135 135 SER H H 135 7.980 7.980 7.734 0.246 19700 3196 1 18 . 1 1 136 136 TRP N N 136 123.354 123.354 118.193 5.161 19700 3197 1 18 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.383 0.470 19700 3198 1 18 . 1 1 136 136 TRP H H 136 8.027 8.027 8.403 -0.376 19700 3199 1 18 . 1 1 137 137 ARG N N 137 120.614 120.614 119.094 1.520 19700 3200 1 18 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.736 -0.062 19700 3201 1 18 . 1 1 137 137 ARG H H 137 7.991 7.991 8.307 -0.316 19700 3202 1 18 . 1 1 138 138 TYR N N 138 119.354 119.354 113.291 6.063 19700 3203 1 18 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.012 0.402 19700 3204 1 18 . 1 1 138 138 TYR H H 138 9.191 9.191 7.878 1.313 19700 3205 1 18 . 1 1 139 139 ILE N N 139 119.510 119.510 122.735 -3.225 19700 3206 1 18 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.367 -0.049 19700 3207 1 18 . 1 1 139 139 ILE H H 139 9.104 9.104 9.039 0.065 19700 3208 1 18 . 1 1 140 140 ARG N N 140 125.596 125.596 126.225 -0.629 19700 3209 1 18 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.090 -0.274 19700 3210 1 18 . 1 1 140 140 ARG H H 140 8.393 8.393 8.374 0.019 19700 3211 1 18 . 1 1 141 141 GLY N N 141 103.964 103.964 109.718 -5.754 19700 3212 1 18 . 1 1 141 141 GLY H H 141 6.307 6.307 7.579 -1.272 19700 3213 1 18 . 1 1 142 142 CYS N N 142 117.908 117.908 119.415 -1.507 19700 3214 1 18 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.868 0.888 19700 3215 1 18 . 1 1 142 142 CYS H H 142 8.184 8.184 8.648 -0.464 19700 3216 1 18 . 1 1 143 143 ALA N N 143 121.268 121.268 123.151 -1.883 19700 3217 1 18 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.951 -0.156 19700 3218 1 18 . 1 1 143 143 ALA H H 143 9.508 9.508 8.565 0.943 19700 3219 1 18 . 1 1 144 144 ASP N N 144 118.068 118.068 118.071 -0.003 19700 3220 1 18 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.653 0.239 19700 3221 1 18 . 1 1 144 144 ASP H H 144 9.030 9.030 8.884 0.146 19700 3222 1 18 . 1 1 145 145 THR N N 145 108.476 108.476 108.332 0.144 19700 3223 1 18 . 1 1 145 145 THR HA H 145 4.422 4.422 4.380 0.042 19700 3224 1 18 . 1 1 145 145 THR H H 145 7.401 7.401 7.446 -0.045 19700 3225 1 18 . 1 1 146 146 CYS N N 146 123.516 123.516 123.095 0.421 19700 3226 1 18 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.357 0.356 19700 3227 1 18 . 1 1 146 146 CYS H H 146 8.850 8.850 8.535 0.315 19700 3228 1 18 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.426 -0.170 19700 3229 1 18 . 1 1 148 148 VAL N N 148 118.686 118.686 121.892 -3.206 19700 3230 1 18 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.150 -0.064 19700 3231 1 18 . 1 1 148 148 VAL H H 148 7.857 7.857 8.119 -0.262 19700 3232 1 18 . 1 1 149 149 GLY N N 149 113.423 113.423 112.050 1.373 19700 3233 1 18 . 1 1 149 149 GLY H H 149 8.357 8.357 7.996 0.361 19700 3234 1 18 . 1 1 150 150 LYS N N 150 121.492 121.492 121.471 0.021 19700 3235 1 18 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.865 -0.238 19700 3236 1 18 . 1 1 150 150 LYS H H 150 8.574 8.574 8.265 0.309 19700 3237 1 18 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.367 -0.025 19700 3238 1 18 . 1 1 152 152 TYR N N 152 111.257 111.257 117.493 -6.236 19700 3239 1 18 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.523 0.001 19700 3240 1 18 . 1 1 152 152 TYR H H 152 7.127 7.127 7.871 -0.744 19700 3241 1 18 . 1 1 153 153 GLU N N 153 119.670 119.670 117.012 2.658 19700 3242 1 18 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.275 0.132 19700 3243 1 18 . 1 1 153 153 GLU H H 153 7.603 7.603 7.564 0.039 19700 3244 1 18 . 1 1 154 154 MET N N 154 117.748 117.748 115.771 1.977 19700 3245 1 18 . 1 1 154 154 MET HA H 154 4.335 4.335 4.079 0.256 19700 3246 1 18 . 1 1 154 154 MET H H 154 8.052 8.052 7.443 0.609 19700 3247 1 18 . 1 1 155 155 ILE N N 155 121.057 121.057 119.137 1.920 19700 3248 1 18 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.090 0.454 19700 3249 1 18 . 1 1 155 155 ILE H H 155 8.393 8.393 8.235 0.158 19700 3250 1 18 . 1 1 156 156 GLU N N 156 127.999 127.999 129.073 -1.074 19700 3251 1 18 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.629 0.243 19700 3252 1 18 . 1 1 156 156 GLU H H 156 8.994 8.994 8.064 0.930 19700 3253 1 18 . 1 1 157 157 CYS N N 157 123.034 123.034 121.647 1.387 19700 3254 1 18 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.664 -0.146 19700 3255 1 18 . 1 1 157 157 CYS H H 157 9.029 9.029 8.608 0.421 19700 3256 1 18 . 1 1 158 158 CYS N N 158 119.670 119.670 120.297 -0.627 19700 3257 1 18 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.855 0.316 19700 3258 1 18 . 1 1 158 158 CYS H H 158 9.344 9.344 9.039 0.305 19700 3259 1 18 . 1 1 159 159 SER N N 159 114.684 114.684 115.276 -0.592 19700 3260 1 18 . 1 1 159 159 SER HA H 159 5.112 5.112 4.679 0.433 19700 3261 1 18 . 1 1 159 159 SER H H 159 9.064 9.064 8.489 0.575 19700 3262 1 18 . 1 1 160 160 THR N N 160 111.828 111.828 112.654 -0.826 19700 3263 1 18 . 1 1 160 160 THR HA H 160 4.784 4.784 4.454 0.330 19700 3264 1 18 . 1 1 160 160 THR H H 160 7.626 7.626 7.579 0.048 19700 3265 1 18 . 1 1 161 161 ASP N N 161 118.279 118.279 123.584 -5.305 19700 3266 1 18 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.379 0.477 19700 3267 1 18 . 1 1 161 161 ASP H H 161 8.332 8.332 8.556 -0.224 19700 3268 1 18 . 1 1 162 162 LYS N N 162 116.091 116.091 118.352 -2.261 19700 3269 1 18 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.694 -0.242 19700 3270 1 18 . 1 1 162 162 LYS H H 162 9.460 9.460 8.193 1.267 19700 3271 1 18 . 1 1 163 163 CYS N N 163 111.859 111.859 115.748 -3.889 19700 3272 1 18 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.145 0.271 19700 3273 1 18 . 1 1 163 163 CYS H H 163 7.751 7.751 8.408 -0.657 19700 3274 1 18 . 1 1 164 164 ASN N N 164 122.713 122.713 117.528 5.185 19700 3275 1 18 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.580 0.103 19700 3276 1 18 . 1 1 164 164 ASN H H 164 9.396 9.396 8.282 1.114 19700 3277 1 19 . 1 1 101 101 LEU N N 101 128.488 128.488 122.445 6.043 19700 3278 1 19 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.795 -0.073 19700 3279 1 19 . 1 1 101 101 LEU H H 101 8.706 8.706 8.377 0.329 19700 3280 1 19 . 1 1 102 102 THR N N 102 117.086 117.086 120.358 -3.272 19700 3281 1 19 . 1 1 102 102 THR HA H 102 5.198 5.198 4.902 0.296 19700 3282 1 19 . 1 1 102 102 THR H H 102 7.729 7.729 8.353 -0.624 19700 3283 1 19 . 1 1 103 103 CYS N N 103 119.021 119.021 125.601 -6.580 19700 3284 1 19 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.788 0.340 19700 3285 1 19 . 1 1 103 103 CYS H H 103 8.514 8.514 9.363 -0.849 19700 3286 1 19 . 1 1 104 104 LEU N N 104 123.028 123.028 121.558 1.470 19700 3287 1 19 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.611 0.200 19700 3288 1 19 . 1 1 104 104 LEU H H 104 9.147 9.147 8.391 0.756 19700 3289 1 19 . 1 1 105 105 ASN N N 105 119.029 119.029 115.900 3.129 19700 3290 1 19 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.862 -0.056 19700 3291 1 19 . 1 1 105 105 ASN H H 105 8.611 8.611 8.613 -0.002 19700 3292 1 19 . 1 1 106 106 CYS N N 106 117.427 117.427 116.001 1.426 19700 3293 1 19 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.915 0.312 19700 3294 1 19 . 1 1 106 106 CYS H H 106 7.210 7.210 7.814 -0.604 19700 3295 1 19 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.601 0.463 19700 3296 1 19 . 1 1 108 108 GLU N N 108 119.996 119.996 119.176 0.820 19700 3297 1 19 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.251 0.325 19700 3298 1 19 . 1 1 108 108 GLU H H 108 7.777 7.777 7.972 -0.195 19700 3299 1 19 . 1 1 109 109 MET N N 109 121.587 121.587 122.094 -0.507 19700 3300 1 19 . 1 1 109 109 MET HA H 109 3.879 3.879 4.183 -0.304 19700 3301 1 19 . 1 1 109 109 MET H H 109 8.954 8.954 8.790 0.164 19700 3302 1 19 . 1 1 110 110 PHE N N 110 114.224 114.224 120.430 -6.206 19700 3303 1 19 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.521 0.426 19700 3304 1 19 . 1 1 110 110 PHE H H 110 7.943 7.943 8.633 -0.690 19700 3305 1 19 . 1 1 111 111 CYS N N 111 117.718 117.718 118.028 -0.310 19700 3306 1 19 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.886 -0.033 19700 3307 1 19 . 1 1 111 111 CYS H H 111 8.141 8.141 7.788 0.353 19700 3308 1 19 . 1 1 112 112 GLY N N 112 106.232 106.232 105.597 0.635 19700 3309 1 19 . 1 1 112 112 GLY H H 112 8.738 8.738 8.514 0.224 19700 3310 1 19 . 1 1 113 113 LYS N N 113 123.354 123.354 123.676 -0.322 19700 3311 1 19 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.662 -0.271 19700 3312 1 19 . 1 1 113 113 LYS H H 113 7.064 7.064 7.737 -0.673 19700 3313 1 19 . 1 1 114 114 PHE N N 114 117.507 117.507 120.237 -2.730 19700 3314 1 19 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.564 -0.220 19700 3315 1 19 . 1 1 114 114 PHE H H 114 7.823 7.823 8.043 -0.220 19700 3316 1 19 . 1 1 115 115 GLN N N 115 117.426 117.426 118.016 -0.590 19700 3317 1 19 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.632 0.156 19700 3318 1 19 . 1 1 115 115 GLN H H 115 9.044 9.044 9.297 -0.253 19700 3319 1 19 . 1 1 116 116 ILE N N 116 124.941 124.941 122.988 1.953 19700 3320 1 19 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.521 -0.154 19700 3321 1 19 . 1 1 116 116 ILE H H 116 8.705 8.705 8.494 0.211 19700 3322 1 19 . 1 1 117 117 CYS N N 117 127.674 127.674 127.331 0.343 19700 3323 1 19 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.603 0.245 19700 3324 1 19 . 1 1 117 117 CYS H H 117 9.103 9.103 8.922 0.181 19700 3325 1 19 . 1 1 118 118 ARG N N 118 120.976 120.976 123.730 -2.754 19700 3326 1 19 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.530 -0.018 19700 3327 1 19 . 1 1 118 118 ARG H H 118 8.396 8.396 8.543 -0.147 19700 3328 1 19 . 1 1 119 119 ASN N N 119 119.240 119.240 118.363 0.877 19700 3329 1 19 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.497 0.063 19700 3330 1 19 . 1 1 119 119 ASN H H 119 8.836 8.836 8.441 0.395 19700 3331 1 19 . 1 1 120 120 GLY N N 120 111.230 111.230 108.415 2.815 19700 3332 1 19 . 1 1 120 120 GLY H H 120 8.755 8.755 8.568 0.187 19700 3333 1 19 . 1 1 121 121 GLU N N 121 119.650 119.650 120.104 -0.454 19700 3334 1 19 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.677 -0.427 19700 3335 1 19 . 1 1 121 121 GLU H H 121 8.158 8.158 7.638 0.520 19700 3336 1 19 . 1 1 122 122 LYS N N 122 120.471 120.471 121.670 -1.199 19700 3337 1 19 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.481 0.078 19700 3338 1 19 . 1 1 122 122 LYS H H 122 7.622 7.622 8.650 -1.028 19700 3339 1 19 . 1 1 123 123 ILE N N 123 118.223 118.223 113.711 4.512 19700 3340 1 19 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.666 0.090 19700 3341 1 19 . 1 1 123 123 ILE H H 123 8.142 8.142 7.695 0.447 19700 3342 1 19 . 1 1 124 124 CYS N N 124 118.872 118.872 120.209 -1.337 19700 3343 1 19 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.512 0.473 19700 3344 1 19 . 1 1 124 124 CYS H H 124 9.196 9.196 8.801 0.395 19700 3345 1 19 . 1 1 125 125 PHE N N 125 116.458 116.458 114.760 1.698 19700 3346 1 19 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.595 0.722 19700 3347 1 19 . 1 1 125 125 PHE H H 125 8.958 8.958 8.740 0.218 19700 3348 1 19 . 1 1 126 126 LYS N N 126 125.559 125.559 122.002 3.557 19700 3349 1 19 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.977 0.174 19700 3350 1 19 . 1 1 126 126 LYS H H 126 9.109 9.109 8.615 0.494 19700 3351 1 19 . 1 1 127 127 LYS N N 127 124.796 124.796 127.169 -2.373 19700 3352 1 19 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.310 -0.093 19700 3353 1 19 . 1 1 127 127 LYS H H 127 9.498 9.498 8.407 1.091 19700 3354 1 19 . 1 1 128 128 LEU N N 128 126.430 126.430 123.009 3.421 19700 3355 1 19 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.824 0.617 19700 3356 1 19 . 1 1 128 128 LEU H H 128 9.105 9.105 8.575 0.530 19700 3357 1 19 . 1 1 129 129 HIS N N 129 124.315 124.315 125.930 -1.615 19700 3358 1 19 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.643 0.287 19700 3359 1 19 . 1 1 129 129 HIS H H 129 9.123 9.123 8.063 1.060 19700 3360 1 19 . 1 1 130 130 GLN N N 130 120.311 120.311 116.074 4.237 19700 3361 1 19 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.620 -0.236 19700 3362 1 19 . 1 1 130 130 GLN H H 130 8.246 8.246 7.813 0.433 19700 3363 1 19 . 1 1 131 131 ARG N N 131 123.995 123.995 124.217 -0.222 19700 3364 1 19 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.202 0.088 19700 3365 1 19 . 1 1 131 131 ARG H H 131 8.510 8.510 8.810 -0.300 19700 3366 1 19 . 1 1 132 132 ARG N N 132 121.592 121.592 121.102 0.490 19700 3367 1 19 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.040 0.268 19700 3368 1 19 . 1 1 132 132 ARG H H 132 8.183 8.183 8.082 0.101 19700 3369 1 19 . 1 1 133 133 ALA N N 133 124.315 124.315 119.058 5.257 19700 3370 1 19 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.283 -0.047 19700 3371 1 19 . 1 1 133 133 ALA H H 133 8.249 8.249 7.973 0.276 19700 3372 1 19 . 1 1 134 134 LEU N N 134 119.576 119.576 120.142 -0.566 19700 3373 1 19 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.063 0.202 19700 3374 1 19 . 1 1 134 134 LEU H H 134 8.146 8.146 8.304 -0.158 19700 3375 1 19 . 1 1 135 135 SER N N 135 113.103 113.103 115.815 -2.712 19700 3376 1 19 . 1 1 135 135 SER HA H 135 4.504 4.504 4.393 0.111 19700 3377 1 19 . 1 1 135 135 SER H H 135 7.980 7.980 7.866 0.114 19700 3378 1 19 . 1 1 136 136 TRP N N 136 123.354 123.354 129.292 -5.938 19700 3379 1 19 . 1 1 136 136 TRP HA H 136 4.853 4.853 5.004 -0.151 19700 3380 1 19 . 1 1 136 136 TRP H H 136 8.027 8.027 8.178 -0.151 19700 3381 1 19 . 1 1 137 137 ARG N N 137 120.614 120.614 125.270 -4.656 19700 3382 1 19 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.952 -0.278 19700 3383 1 19 . 1 1 137 137 ARG H H 137 7.991 7.991 8.384 -0.393 19700 3384 1 19 . 1 1 138 138 TYR N N 138 119.354 119.354 116.948 2.406 19700 3385 1 19 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.043 0.371 19700 3386 1 19 . 1 1 138 138 TYR H H 138 9.191 9.191 8.437 0.754 19700 3387 1 19 . 1 1 139 139 ILE N N 139 119.510 119.510 122.402 -2.892 19700 3388 1 19 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.409 -0.091 19700 3389 1 19 . 1 1 139 139 ILE H H 139 9.104 9.104 9.061 0.043 19700 3390 1 19 . 1 1 140 140 ARG N N 140 125.596 125.596 125.516 0.080 19700 3391 1 19 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.046 -0.230 19700 3392 1 19 . 1 1 140 140 ARG H H 140 8.393 8.393 8.502 -0.109 19700 3393 1 19 . 1 1 141 141 GLY N N 141 103.964 103.964 109.812 -5.848 19700 3394 1 19 . 1 1 141 141 GLY H H 141 6.307 6.307 7.494 -1.187 19700 3395 1 19 . 1 1 142 142 CYS N N 142 117.908 117.908 119.530 -1.622 19700 3396 1 19 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.999 0.757 19700 3397 1 19 . 1 1 142 142 CYS H H 142 8.184 8.184 8.614 -0.430 19700 3398 1 19 . 1 1 143 143 ALA N N 143 121.268 121.268 124.134 -2.866 19700 3399 1 19 . 1 1 143 143 ALA HA H 143 4.795 4.795 5.009 -0.214 19700 3400 1 19 . 1 1 143 143 ALA H H 143 9.508 9.508 8.897 0.611 19700 3401 1 19 . 1 1 144 144 ASP N N 144 118.068 118.068 118.579 -0.511 19700 3402 1 19 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.629 0.263 19700 3403 1 19 . 1 1 144 144 ASP H H 144 9.030 9.030 8.692 0.338 19700 3404 1 19 . 1 1 145 145 THR N N 145 108.476 108.476 109.734 -1.258 19700 3405 1 19 . 1 1 145 145 THR HA H 145 4.422 4.422 4.392 0.030 19700 3406 1 19 . 1 1 145 145 THR H H 145 7.401 7.401 7.516 -0.115 19700 3407 1 19 . 1 1 146 146 CYS N N 146 123.516 123.516 123.325 0.191 19700 3408 1 19 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.443 0.270 19700 3409 1 19 . 1 1 146 146 CYS H H 146 8.850 8.850 8.344 0.506 19700 3410 1 19 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.381 -0.125 19700 3411 1 19 . 1 1 148 148 VAL N N 148 118.686 118.686 122.402 -3.716 19700 3412 1 19 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.087 -0.001 19700 3413 1 19 . 1 1 148 148 VAL H H 148 7.857 7.857 8.082 -0.225 19700 3414 1 19 . 1 1 149 149 GLY N N 149 113.423 113.423 110.384 3.039 19700 3415 1 19 . 1 1 149 149 GLY H H 149 8.357 8.357 7.951 0.406 19700 3416 1 19 . 1 1 150 150 LYS N N 150 121.492 121.492 121.408 0.084 19700 3417 1 19 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.760 -0.133 19700 3418 1 19 . 1 1 150 150 LYS H H 150 8.574 8.574 8.465 0.109 19700 3419 1 19 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.502 -0.160 19700 3420 1 19 . 1 1 152 152 TYR N N 152 111.257 111.257 118.443 -7.186 19700 3421 1 19 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.524 0.000 19700 3422 1 19 . 1 1 152 152 TYR H H 152 7.127 7.127 8.168 -1.042 19700 3423 1 19 . 1 1 153 153 GLU N N 153 119.670 119.670 117.937 1.733 19700 3424 1 19 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.059 0.348 19700 3425 1 19 . 1 1 153 153 GLU H H 153 7.603 7.603 7.615 -0.012 19700 3426 1 19 . 1 1 154 154 MET N N 154 117.748 117.748 116.956 0.792 19700 3427 1 19 . 1 1 154 154 MET HA H 154 4.335 4.335 4.049 0.286 19700 3428 1 19 . 1 1 154 154 MET H H 154 8.052 8.052 7.456 0.596 19700 3429 1 19 . 1 1 155 155 ILE N N 155 121.057 121.057 119.335 1.722 19700 3430 1 19 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.257 0.287 19700 3431 1 19 . 1 1 155 155 ILE H H 155 8.393 8.393 8.408 -0.015 19700 3432 1 19 . 1 1 156 156 GLU N N 156 127.999 127.999 129.300 -1.301 19700 3433 1 19 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.635 0.237 19700 3434 1 19 . 1 1 156 156 GLU H H 156 8.994 8.994 8.487 0.507 19700 3435 1 19 . 1 1 157 157 CYS N N 157 123.034 123.034 121.179 1.855 19700 3436 1 19 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.651 -0.133 19700 3437 1 19 . 1 1 157 157 CYS H H 157 9.029 9.029 8.563 0.466 19700 3438 1 19 . 1 1 158 158 CYS N N 158 119.670 119.670 119.734 -0.064 19700 3439 1 19 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.959 0.212 19700 3440 1 19 . 1 1 158 158 CYS H H 158 9.344 9.344 9.092 0.252 19700 3441 1 19 . 1 1 159 159 SER N N 159 114.684 114.684 115.129 -0.445 19700 3442 1 19 . 1 1 159 159 SER HA H 159 5.112 5.112 4.741 0.371 19700 3443 1 19 . 1 1 159 159 SER H H 159 9.064 9.064 8.466 0.598 19700 3444 1 19 . 1 1 160 160 THR N N 160 111.828 111.828 113.255 -1.427 19700 3445 1 19 . 1 1 160 160 THR HA H 160 4.784 4.784 4.429 0.355 19700 3446 1 19 . 1 1 160 160 THR H H 160 7.626 7.626 7.441 0.185 19700 3447 1 19 . 1 1 161 161 ASP N N 161 118.279 118.279 123.328 -5.049 19700 3448 1 19 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.424 0.432 19700 3449 1 19 . 1 1 161 161 ASP H H 161 8.332 8.332 8.504 -0.172 19700 3450 1 19 . 1 1 162 162 LYS N N 162 116.091 116.091 118.175 -2.084 19700 3451 1 19 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.703 -0.251 19700 3452 1 19 . 1 1 162 162 LYS H H 162 9.460 9.460 8.708 0.752 19700 3453 1 19 . 1 1 163 163 CYS N N 163 111.859 111.859 115.578 -3.719 19700 3454 1 19 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.246 0.170 19700 3455 1 19 . 1 1 163 163 CYS H H 163 7.751 7.751 8.435 -0.684 19700 3456 1 19 . 1 1 164 164 ASN N N 164 122.713 122.713 116.668 6.045 19700 3457 1 19 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.510 0.174 19700 3458 1 19 . 1 1 164 164 ASN H H 164 9.396 9.396 8.257 1.139 19700 3459 1 20 . 1 1 101 101 LEU N N 101 128.488 128.488 122.220 6.268 19700 3460 1 20 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.860 -0.138 19700 3461 1 20 . 1 1 101 101 LEU H H 101 8.706 8.706 8.545 0.161 19700 3462 1 20 . 1 1 102 102 THR N N 102 117.086 117.086 119.047 -1.961 19700 3463 1 20 . 1 1 102 102 THR HA H 102 5.198 5.198 4.943 0.255 19700 3464 1 20 . 1 1 102 102 THR H H 102 7.729 7.729 8.246 -0.517 19700 3465 1 20 . 1 1 103 103 CYS N N 103 119.021 119.021 125.333 -6.312 19700 3466 1 20 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.797 0.331 19700 3467 1 20 . 1 1 103 103 CYS H H 103 8.514 8.514 9.392 -0.878 19700 3468 1 20 . 1 1 104 104 LEU N N 104 123.028 123.028 121.894 1.134 19700 3469 1 20 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.521 0.290 19700 3470 1 20 . 1 1 104 104 LEU H H 104 9.147 9.147 8.300 0.847 19700 3471 1 20 . 1 1 105 105 ASN N N 105 119.029 119.029 118.073 0.956 19700 3472 1 20 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.963 -0.157 19700 3473 1 20 . 1 1 105 105 ASN H H 105 8.611 8.611 8.735 -0.124 19700 3474 1 20 . 1 1 106 106 CYS N N 106 117.427 117.427 115.987 1.440 19700 3475 1 20 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.805 0.422 19700 3476 1 20 . 1 1 106 106 CYS H H 106 7.210 7.210 7.813 -0.603 19700 3477 1 20 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.375 0.689 19700 3478 1 20 . 1 1 108 108 GLU N N 108 119.996 119.996 118.515 1.481 19700 3479 1 20 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.209 0.367 19700 3480 1 20 . 1 1 108 108 GLU H H 108 7.777 7.777 7.768 0.009 19700 3481 1 20 . 1 1 109 109 MET N N 109 121.587 121.587 122.944 -1.357 19700 3482 1 20 . 1 1 109 109 MET HA H 109 3.879 3.879 4.043 -0.164 19700 3483 1 20 . 1 1 109 109 MET H H 109 8.954 8.954 8.509 0.445 19700 3484 1 20 . 1 1 110 110 PHE N N 110 114.224 114.224 120.259 -6.035 19700 3485 1 20 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.607 0.340 19700 3486 1 20 . 1 1 110 110 PHE H H 110 7.943 7.943 8.095 -0.152 19700 3487 1 20 . 1 1 111 111 CYS N N 111 117.718 117.718 118.762 -1.044 19700 3488 1 20 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.911 -0.058 19700 3489 1 20 . 1 1 111 111 CYS H H 111 8.141 8.141 8.050 0.091 19700 3490 1 20 . 1 1 112 112 GLY N N 112 106.232 106.232 109.270 -3.038 19700 3491 1 20 . 1 1 112 112 GLY H H 112 8.738 8.738 8.594 0.144 19700 3492 1 20 . 1 1 113 113 LYS N N 113 123.354 123.354 123.489 -0.135 19700 3493 1 20 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.578 -0.187 19700 3494 1 20 . 1 1 113 113 LYS H H 113 7.064 7.064 7.695 -0.631 19700 3495 1 20 . 1 1 114 114 PHE N N 114 117.507 117.507 120.145 -2.638 19700 3496 1 20 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.186 0.158 19700 3497 1 20 . 1 1 114 114 PHE H H 114 7.823 7.823 8.035 -0.212 19700 3498 1 20 . 1 1 115 115 GLN N N 115 117.426 117.426 118.416 -0.990 19700 3499 1 20 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.732 0.056 19700 3500 1 20 . 1 1 115 115 GLN H H 115 9.044 9.044 9.255 -0.211 19700 3501 1 20 . 1 1 116 116 ILE N N 116 124.941 124.941 123.190 1.751 19700 3502 1 20 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.573 -0.206 19700 3503 1 20 . 1 1 116 116 ILE H H 116 8.705 8.705 8.444 0.261 19700 3504 1 20 . 1 1 117 117 CYS N N 117 127.674 127.674 127.624 0.050 19700 3505 1 20 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.596 0.252 19700 3506 1 20 . 1 1 117 117 CYS H H 117 9.103 9.103 8.981 0.122 19700 3507 1 20 . 1 1 118 118 ARG N N 118 120.976 120.976 122.814 -1.838 19700 3508 1 20 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.562 -0.050 19700 3509 1 20 . 1 1 118 118 ARG H H 118 8.396 8.396 8.575 -0.179 19700 3510 1 20 . 1 1 119 119 ASN N N 119 119.240 119.240 117.718 1.522 19700 3511 1 20 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.485 0.075 19700 3512 1 20 . 1 1 119 119 ASN H H 119 8.836 8.836 8.384 0.452 19700 3513 1 20 . 1 1 120 120 GLY N N 120 111.230 111.230 106.656 4.574 19700 3514 1 20 . 1 1 120 120 GLY H H 120 8.755 8.755 8.583 0.172 19700 3515 1 20 . 1 1 121 121 GLU N N 121 119.650 119.650 119.926 -0.276 19700 3516 1 20 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.661 -0.411 19700 3517 1 20 . 1 1 121 121 GLU H H 121 8.158 8.158 7.656 0.502 19700 3518 1 20 . 1 1 122 122 LYS N N 122 120.471 120.471 121.067 -0.596 19700 3519 1 20 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.409 0.150 19700 3520 1 20 . 1 1 122 122 LYS H H 122 7.622 7.622 8.537 -0.915 19700 3521 1 20 . 1 1 123 123 ILE N N 123 118.223 118.223 119.163 -0.940 19700 3522 1 20 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.456 0.300 19700 3523 1 20 . 1 1 123 123 ILE H H 123 8.142 8.142 7.606 0.536 19700 3524 1 20 . 1 1 124 124 CYS N N 124 118.872 118.872 123.505 -4.633 19700 3525 1 20 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.327 0.658 19700 3526 1 20 . 1 1 124 124 CYS H H 124 9.196 9.196 9.072 0.124 19700 3527 1 20 . 1 1 125 125 PHE N N 125 116.458 116.458 114.833 1.625 19700 3528 1 20 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.633 0.684 19700 3529 1 20 . 1 1 125 125 PHE H H 125 8.958 8.958 8.939 0.019 19700 3530 1 20 . 1 1 126 126 LYS N N 126 125.559 125.559 122.978 2.581 19700 3531 1 20 . 1 1 126 126 LYS HA H 126 5.151 5.151 5.094 0.057 19700 3532 1 20 . 1 1 126 126 LYS H H 126 9.109 9.109 8.729 0.380 19700 3533 1 20 . 1 1 127 127 LYS N N 127 124.796 124.796 124.896 -0.100 19700 3534 1 20 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.447 -0.230 19700 3535 1 20 . 1 1 127 127 LYS H H 127 9.498 9.498 8.350 1.148 19700 3536 1 20 . 1 1 128 128 LEU N N 128 126.430 126.430 120.907 5.523 19700 3537 1 20 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.944 0.497 19700 3538 1 20 . 1 1 128 128 LEU H H 128 9.105 9.105 8.614 0.491 19700 3539 1 20 . 1 1 129 129 HIS N N 129 124.315 124.315 123.738 0.577 19700 3540 1 20 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.830 0.100 19700 3541 1 20 . 1 1 129 129 HIS H H 129 9.123 9.123 8.715 0.408 19700 3542 1 20 . 1 1 130 130 GLN N N 130 120.311 120.311 116.694 3.617 19700 3543 1 20 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.375 0.009 19700 3544 1 20 . 1 1 130 130 GLN H H 130 8.246 8.246 7.325 0.921 19700 3545 1 20 . 1 1 131 131 ARG N N 131 123.995 123.995 120.859 3.136 19700 3546 1 20 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.565 -0.275 19700 3547 1 20 . 1 1 131 131 ARG H H 131 8.510 8.510 8.737 -0.227 19700 3548 1 20 . 1 1 132 132 ARG N N 132 121.592 121.592 119.403 2.189 19700 3549 1 20 . 1 1 132 132 ARG HA H 132 4.308 4.308 3.954 0.354 19700 3550 1 20 . 1 1 132 132 ARG H H 132 8.183 8.183 8.529 -0.346 19700 3551 1 20 . 1 1 133 133 ALA N N 133 124.315 124.315 120.545 3.770 19700 3552 1 20 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.280 -0.044 19700 3553 1 20 . 1 1 133 133 ALA H H 133 8.249 8.249 7.623 0.626 19700 3554 1 20 . 1 1 134 134 LEU N N 134 119.576 119.576 115.443 4.133 19700 3555 1 20 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.251 0.014 19700 3556 1 20 . 1 1 134 134 LEU H H 134 8.146 8.146 8.455 -0.309 19700 3557 1 20 . 1 1 135 135 SER N N 135 113.103 113.103 112.405 0.698 19700 3558 1 20 . 1 1 135 135 SER HA H 135 4.504 4.504 4.469 0.035 19700 3559 1 20 . 1 1 135 135 SER H H 135 7.980 7.980 7.442 0.538 19700 3560 1 20 . 1 1 136 136 TRP N N 136 123.354 123.354 119.244 4.110 19700 3561 1 20 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.478 0.375 19700 3562 1 20 . 1 1 136 136 TRP H H 136 8.027 8.027 8.353 -0.326 19700 3563 1 20 . 1 1 137 137 ARG N N 137 120.614 120.614 117.074 3.540 19700 3564 1 20 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.495 0.179 19700 3565 1 20 . 1 1 137 137 ARG H H 137 7.991 7.991 8.340 -0.349 19700 3566 1 20 . 1 1 138 138 TYR N N 138 119.354 119.354 116.060 3.294 19700 3567 1 20 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.382 0.032 19700 3568 1 20 . 1 1 138 138 TYR H H 138 9.191 9.191 7.702 1.489 19700 3569 1 20 . 1 1 139 139 ILE N N 139 119.510 119.510 122.661 -3.151 19700 3570 1 20 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.478 -0.160 19700 3571 1 20 . 1 1 139 139 ILE H H 139 9.104 9.104 9.269 -0.165 19700 3572 1 20 . 1 1 140 140 ARG N N 140 125.596 125.596 126.635 -1.039 19700 3573 1 20 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.069 -0.253 19700 3574 1 20 . 1 1 140 140 ARG H H 140 8.393 8.393 8.641 -0.248 19700 3575 1 20 . 1 1 141 141 GLY N N 141 103.964 103.964 110.292 -6.328 19700 3576 1 20 . 1 1 141 141 GLY H H 141 6.307 6.307 7.506 -1.199 19700 3577 1 20 . 1 1 142 142 CYS N N 142 117.908 117.908 119.167 -1.259 19700 3578 1 20 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.755 1.001 19700 3579 1 20 . 1 1 142 142 CYS H H 142 8.184 8.184 8.621 -0.437 19700 3580 1 20 . 1 1 143 143 ALA N N 143 121.268 121.268 122.947 -1.679 19700 3581 1 20 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.894 -0.099 19700 3582 1 20 . 1 1 143 143 ALA H H 143 9.508 9.508 8.491 1.017 19700 3583 1 20 . 1 1 144 144 ASP N N 144 118.068 118.068 118.322 -0.254 19700 3584 1 20 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.636 0.256 19700 3585 1 20 . 1 1 144 144 ASP H H 144 9.030 9.030 8.930 0.100 19700 3586 1 20 . 1 1 145 145 THR N N 145 108.476 108.476 109.213 -0.737 19700 3587 1 20 . 1 1 145 145 THR HA H 145 4.422 4.422 4.374 0.048 19700 3588 1 20 . 1 1 145 145 THR H H 145 7.401 7.401 7.389 0.012 19700 3589 1 20 . 1 1 146 146 CYS N N 146 123.516 123.516 122.922 0.594 19700 3590 1 20 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.366 0.347 19700 3591 1 20 . 1 1 146 146 CYS H H 146 8.850 8.850 8.485 0.365 19700 3592 1 20 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.401 -0.145 19700 3593 1 20 . 1 1 148 148 VAL N N 148 118.686 118.686 121.585 -2.899 19700 3594 1 20 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.088 -0.002 19700 3595 1 20 . 1 1 148 148 VAL H H 148 7.857 7.857 8.169 -0.312 19700 3596 1 20 . 1 1 149 149 GLY N N 149 113.423 113.423 112.579 0.844 19700 3597 1 20 . 1 1 149 149 GLY H H 149 8.357 8.357 7.836 0.521 19700 3598 1 20 . 1 1 150 150 LYS N N 150 121.492 121.492 120.576 0.916 19700 3599 1 20 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.698 -0.071 19700 3600 1 20 . 1 1 150 150 LYS H H 150 8.574 8.574 8.050 0.524 19700 3601 1 20 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.386 -0.044 19700 3602 1 20 . 1 1 152 152 TYR N N 152 111.257 111.257 117.941 -6.684 19700 3603 1 20 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.542 -0.018 19700 3604 1 20 . 1 1 152 152 TYR H H 152 7.127 7.127 8.563 -1.436 19700 3605 1 20 . 1 1 153 153 GLU N N 153 119.670 119.670 119.088 0.582 19700 3606 1 20 . 1 1 153 153 GLU HA H 153 4.407 4.407 3.838 0.569 19700 3607 1 20 . 1 1 153 153 GLU H H 153 7.603 7.603 7.225 0.378 19700 3608 1 20 . 1 1 154 154 MET N N 154 117.748 117.748 115.446 2.302 19700 3609 1 20 . 1 1 154 154 MET HA H 154 4.335 4.335 4.016 0.319 19700 3610 1 20 . 1 1 154 154 MET H H 154 8.052 8.052 7.400 0.652 19700 3611 1 20 . 1 1 155 155 ILE N N 155 121.057 121.057 118.908 2.149 19700 3612 1 20 . 1 1 155 155 ILE HA H 155 4.544 4.544 3.981 0.563 19700 3613 1 20 . 1 1 155 155 ILE H H 155 8.393 8.393 8.141 0.252 19700 3614 1 20 . 1 1 156 156 GLU N N 156 127.999 127.999 129.205 -1.206 19700 3615 1 20 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.677 0.195 19700 3616 1 20 . 1 1 156 156 GLU H H 156 8.994 8.994 8.456 0.538 19700 3617 1 20 . 1 1 157 157 CYS N N 157 123.034 123.034 120.235 2.799 19700 3618 1 20 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.655 -0.137 19700 3619 1 20 . 1 1 157 157 CYS H H 157 9.029 9.029 8.519 0.510 19700 3620 1 20 . 1 1 158 158 CYS N N 158 119.670 119.670 119.595 0.075 19700 3621 1 20 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.768 0.403 19700 3622 1 20 . 1 1 158 158 CYS H H 158 9.344 9.344 8.959 0.385 19700 3623 1 20 . 1 1 159 159 SER N N 159 114.684 114.684 114.779 -0.095 19700 3624 1 20 . 1 1 159 159 SER HA H 159 5.112 5.112 4.789 0.323 19700 3625 1 20 . 1 1 159 159 SER H H 159 9.064 9.064 8.478 0.586 19700 3626 1 20 . 1 1 160 160 THR N N 160 111.828 111.828 112.392 -0.564 19700 3627 1 20 . 1 1 160 160 THR HA H 160 4.784 4.784 4.468 0.316 19700 3628 1 20 . 1 1 160 160 THR H H 160 7.626 7.626 7.478 0.148 19700 3629 1 20 . 1 1 161 161 ASP N N 161 118.279 118.279 123.435 -5.156 19700 3630 1 20 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.349 0.507 19700 3631 1 20 . 1 1 161 161 ASP H H 161 8.332 8.332 8.588 -0.256 19700 3632 1 20 . 1 1 162 162 LYS N N 162 116.091 116.091 119.163 -3.072 19700 3633 1 20 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.685 -0.233 19700 3634 1 20 . 1 1 162 162 LYS H H 162 9.460 9.460 8.288 1.172 19700 3635 1 20 . 1 1 163 163 CYS N N 163 111.859 111.859 114.851 -2.992 19700 3636 1 20 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.127 0.289 19700 3637 1 20 . 1 1 163 163 CYS H H 163 7.751 7.751 8.331 -0.580 19700 3638 1 20 . 1 1 164 164 ASN N N 164 122.713 122.713 118.135 4.578 19700 3639 1 20 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.556 0.128 19700 3640 1 20 . 1 1 164 164 ASN H H 164 9.396 9.396 8.132 1.264 19700 stop_ loop_ _SPARTA_output.Data_ID _SPARTA_output.Entity_delta_chem_shifts_ID _SPARTA_output.Conformer_ID _SPARTA_output.Data_type _SPARTA_output.Data_atom _SPARTA_output.Data_num_shifts _SPARTA_output.Data_value _SPARTA_output.Data_low_range _SPARTA_output.Data_high_range _SPARTA_output.Entry_ID 1 1 1 "Average Difference" N 61 2.936 0.301 2.944 19700 2 1 1 "Average Difference" HA 68 0.300 -0.117 0.279 19700 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19700 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19700 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19700 6 1 1 "Average Difference" HN 61 0.533 -0.111 0.525 19700 7 1 2 "Average Difference" N 61 2.869 0.004 2.893 19700 8 1 2 "Average Difference" HA 68 0.343 -0.154 0.309 19700 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19700 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19700 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19700 12 1 2 "Average Difference" HN 61 0.539 -0.112 0.532 19700 13 1 3 "Average Difference" N 61 2.922 0.156 2.942 19700 14 1 3 "Average Difference" HA 68 0.312 -0.110 0.294 19700 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19700 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19700 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19700 18 1 3 "Average Difference" HN 61 0.522 -0.096 0.518 19700 19 1 4 "Average Difference" N 61 2.751 0.236 2.763 19700 20 1 4 "Average Difference" HA 68 0.302 -0.103 0.286 19700 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19700 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19700 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19700 24 1 4 "Average Difference" HN 61 0.569 -0.077 0.569 19700 25 1 5 "Average Difference" N 61 3.087 0.328 3.095 19700 26 1 5 "Average Difference" HA 68 0.328 -0.128 0.305 19700 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19700 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19700 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19700 30 1 5 "Average Difference" HN 61 0.565 -0.114 0.558 19700 31 1 6 "Average Difference" N 61 2.865 0.084 2.888 19700 32 1 6 "Average Difference" HA 68 0.312 -0.126 0.288 19700 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19700 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19700 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19700 36 1 6 "Average Difference" HN 61 0.545 -0.084 0.543 19700 37 1 7 "Average Difference" N 61 2.947 0.170 2.967 19700 38 1 7 "Average Difference" HA 68 0.313 -0.117 0.293 19700 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19700 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19700 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19700 42 1 7 "Average Difference" HN 61 0.531 -0.074 0.531 19700 43 1 8 "Average Difference" N 61 2.826 0.180 2.844 19700 44 1 8 "Average Difference" HA 68 0.308 -0.114 0.288 19700 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19700 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19700 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19700 48 1 8 "Average Difference" HN 61 0.536 -0.102 0.531 19700 49 1 9 "Average Difference" N 61 2.740 0.542 2.708 19700 50 1 9 "Average Difference" HA 68 0.330 -0.113 0.312 19700 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19700 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19700 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19700 54 1 9 "Average Difference" HN 61 0.552 -0.080 0.551 19700 55 1 10 "Average Difference" N 61 2.760 -0.060 2.782 19700 56 1 10 "Average Difference" HA 68 0.330 -0.140 0.301 19700 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19700 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19700 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19700 60 1 10 "Average Difference" HN 61 0.551 -0.127 0.540 19700 61 1 11 "Average Difference" N 61 2.965 0.045 2.989 19700 62 1 11 "Average Difference" HA 68 0.320 -0.105 0.305 19700 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19700 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19700 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19700 66 1 11 "Average Difference" HN 61 0.572 -0.140 0.559 19700 67 1 12 "Average Difference" N 61 2.741 0.145 2.759 19700 68 1 12 "Average Difference" HA 68 0.326 -0.123 0.304 19700 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19700 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19700 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19700 72 1 12 "Average Difference" HN 61 0.529 -0.099 0.524 19700 73 1 13 "Average Difference" N 61 2.794 0.079 2.816 19700 74 1 13 "Average Difference" HA 68 0.289 -0.108 0.271 19700 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19700 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19700 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19700 78 1 13 "Average Difference" HN 61 0.588 -0.087 0.587 19700 79 1 14 "Average Difference" N 61 2.917 -0.036 2.941 19700 80 1 14 "Average Difference" HA 68 0.329 -0.150 0.295 19700 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19700 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19700 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19700 84 1 14 "Average Difference" HN 61 0.654 -0.165 0.638 19700 85 1 15 "Average Difference" N 61 2.816 0.129 2.836 19700 86 1 15 "Average Difference" HA 68 0.291 -0.096 0.277 19700 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19700 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19700 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19700 90 1 15 "Average Difference" HN 61 0.495 -0.085 0.492 19700 91 1 16 "Average Difference" N 61 2.824 0.375 2.822 19700 92 1 16 "Average Difference" HA 68 0.317 -0.128 0.292 19700 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19700 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19700 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19700 96 1 16 "Average Difference" HN 61 0.531 -0.081 0.529 19700 97 1 17 "Average Difference" N 61 2.729 0.038 2.752 19700 98 1 17 "Average Difference" HA 68 0.343 -0.109 0.327 19700 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19700 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19700 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19700 102 1 17 "Average Difference" HN 61 0.555 -0.082 0.553 19700 103 1 18 "Average Difference" N 61 3.033 0.016 3.058 19700 104 1 18 "Average Difference" HA 68 0.346 -0.129 0.324 19700 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19700 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19700 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19700 108 1 18 "Average Difference" HN 61 0.559 -0.096 0.555 19700 109 1 19 "Average Difference" N 61 3.063 0.389 3.063 19700 110 1 19 "Average Difference" HA 68 0.293 -0.110 0.273 19700 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19700 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19700 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19700 114 1 19 "Average Difference" HN 61 0.524 -0.090 0.521 19700 115 1 20 "Average Difference" N 61 2.962 -0.062 2.986 19700 116 1 20 "Average Difference" HA 68 0.323 -0.140 0.293 19700 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19700 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19700 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19700 120 1 20 "Average Difference" HN 61 0.593 -0.126 0.584 19700 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 19700 _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 1 101 101 LEU N N 101 128.488 128.488 122.465 6.023 19700 2 1 . 1 1 101 101 LEU HA H 101 4.722 4.722 4.871 -0.149 19700 3 1 . 1 1 101 101 LEU H H 101 8.706 8.706 8.501 0.205 19700 4 1 . 1 1 102 102 THR N N 102 117.086 117.086 119.651 -2.565 19700 5 1 . 1 1 102 102 THR HA H 102 5.198 5.198 4.984 0.214 19700 6 1 . 1 1 102 102 THR H H 102 7.729 7.729 8.339 -0.610 19700 7 1 . 1 1 103 103 CYS N N 103 119.021 119.021 124.795 -5.774 19700 8 1 . 1 1 103 103 CYS HA H 103 5.128 5.128 4.798 0.330 19700 9 1 . 1 1 103 103 CYS H H 103 8.514 8.514 9.259 -0.745 19700 10 1 . 1 1 104 104 LEU N N 104 123.028 123.028 121.712 1.316 19700 11 1 . 1 1 104 104 LEU HA H 104 4.811 4.811 4.563 0.248 19700 12 1 . 1 1 104 104 LEU H H 104 9.147 9.147 8.355 0.792 19700 13 1 . 1 1 105 105 ASN N N 105 119.029 119.029 117.117 1.912 19700 14 1 . 1 1 105 105 ASN HA H 105 4.806 4.806 4.982 -0.176 19700 15 1 . 1 1 105 105 ASN H H 105 8.611 8.611 8.696 -0.085 19700 16 1 . 1 1 106 106 CYS N N 106 117.427 117.427 116.090 1.337 19700 17 1 . 1 1 106 106 CYS HA H 106 5.227 5.227 4.929 0.298 19700 18 1 . 1 1 106 106 CYS H H 106 7.210 7.210 7.937 -0.727 19700 19 1 . 1 1 107 107 PRO HA H 107 5.064 5.064 4.643 0.421 19700 20 1 . 1 1 108 108 GLU N N 108 119.996 119.996 118.185 1.811 19700 21 1 . 1 1 108 108 GLU HA H 108 4.576 4.576 4.314 0.262 19700 22 1 . 1 1 108 108 GLU H H 108 7.777 7.777 8.123 -0.346 19700 23 1 . 1 1 109 109 MET N N 109 121.587 121.587 121.033 0.554 19700 24 1 . 1 1 109 109 MET HA H 109 3.879 3.879 4.193 -0.314 19700 25 1 . 1 1 109 109 MET H H 109 8.954 8.954 8.544 0.410 19700 26 1 . 1 1 110 110 PHE N N 110 114.224 114.224 119.734 -5.510 19700 27 1 . 1 1 110 110 PHE HA H 110 4.947 4.947 4.572 0.375 19700 28 1 . 1 1 110 110 PHE H H 110 7.943 7.943 8.337 -0.394 19700 29 1 . 1 1 111 111 CYS N N 111 117.718 117.718 117.877 -0.159 19700 30 1 . 1 1 111 111 CYS HA H 111 4.853 4.853 4.904 -0.051 19700 31 1 . 1 1 111 111 CYS H H 111 8.141 8.141 7.843 0.298 19700 32 1 . 1 1 112 112 GLY N N 112 106.232 106.232 106.939 -0.707 19700 33 1 . 1 1 112 112 GLY H H 112 8.738 8.738 8.561 0.177 19700 34 1 . 1 1 113 113 LYS N N 113 123.354 123.354 123.652 -0.298 19700 35 1 . 1 1 113 113 LYS HA H 113 4.391 4.391 4.633 -0.242 19700 36 1 . 1 1 113 113 LYS H H 113 7.064 7.064 7.723 -0.659 19700 37 1 . 1 1 114 114 PHE N N 114 117.507 117.507 120.446 -2.939 19700 38 1 . 1 1 114 114 PHE HA H 114 5.344 5.344 5.242 0.102 19700 39 1 . 1 1 114 114 PHE H H 114 7.823 7.823 8.052 -0.228 19700 40 1 . 1 1 115 115 GLN N N 115 117.426 117.426 118.028 -0.602 19700 41 1 . 1 1 115 115 GLN HA H 115 4.788 4.788 4.657 0.131 19700 42 1 . 1 1 115 115 GLN H H 115 9.044 9.044 9.169 -0.125 19700 43 1 . 1 1 116 116 ILE N N 116 124.941 124.941 123.139 1.802 19700 44 1 . 1 1 116 116 ILE HA H 116 4.367 4.367 4.549 -0.182 19700 45 1 . 1 1 116 116 ILE H H 116 8.705 8.705 8.456 0.249 19700 46 1 . 1 1 117 117 CYS N N 117 127.674 127.674 127.631 0.043 19700 47 1 . 1 1 117 117 CYS HA H 117 4.848 4.848 4.598 0.250 19700 48 1 . 1 1 117 117 CYS H H 117 9.103 9.103 8.940 0.163 19700 49 1 . 1 1 118 118 ARG N N 118 120.976 120.976 123.601 -2.625 19700 50 1 . 1 1 118 118 ARG HA H 118 4.512 4.512 4.551 -0.039 19700 51 1 . 1 1 118 118 ARG H H 118 8.396 8.396 8.578 -0.182 19700 52 1 . 1 1 119 119 ASN N N 119 119.240 119.240 118.256 0.984 19700 53 1 . 1 1 119 119 ASN HA H 119 4.560 4.560 4.479 0.081 19700 54 1 . 1 1 119 119 ASN H H 119 8.836 8.836 8.450 0.386 19700 55 1 . 1 1 120 120 GLY N N 120 111.230 111.230 108.818 2.412 19700 56 1 . 1 1 120 120 GLY H H 120 8.755 8.755 8.584 0.171 19700 57 1 . 1 1 121 121 GLU N N 121 119.650 119.650 120.087 -0.437 19700 58 1 . 1 1 121 121 GLU HA H 121 4.250 4.250 4.674 -0.424 19700 59 1 . 1 1 121 121 GLU H H 121 8.158 8.158 7.656 0.502 19700 60 1 . 1 1 122 122 LYS N N 122 120.471 120.471 121.435 -0.964 19700 61 1 . 1 1 122 122 LYS HA H 122 4.559 4.559 4.451 0.108 19700 62 1 . 1 1 122 122 LYS H H 122 7.622 7.622 8.542 -0.920 19700 63 1 . 1 1 123 123 ILE N N 123 118.223 118.223 116.884 1.339 19700 64 1 . 1 1 123 123 ILE HA H 123 4.756 4.756 4.534 0.222 19700 65 1 . 1 1 123 123 ILE H H 123 8.142 8.142 7.625 0.517 19700 66 1 . 1 1 124 124 CYS N N 124 118.872 118.872 122.560 -3.688 19700 67 1 . 1 1 124 124 CYS HA H 124 5.985 5.985 5.463 0.522 19700 68 1 . 1 1 124 124 CYS H H 124 9.196 9.196 8.934 0.262 19700 69 1 . 1 1 125 125 PHE N N 125 116.458 116.458 114.827 1.631 19700 70 1 . 1 1 125 125 PHE HA H 125 6.317 6.317 5.692 0.625 19700 71 1 . 1 1 125 125 PHE H H 125 8.958 8.958 8.867 0.091 19700 72 1 . 1 1 126 126 LYS N N 126 125.559 125.559 122.984 2.575 19700 73 1 . 1 1 126 126 LYS HA H 126 5.151 5.151 4.962 0.189 19700 74 1 . 1 1 126 126 LYS H H 126 9.109 9.109 8.756 0.353 19700 75 1 . 1 1 127 127 LYS N N 127 124.796 124.796 125.569 -0.774 19700 76 1 . 1 1 127 127 LYS HA H 127 5.217 5.217 5.431 -0.214 19700 77 1 . 1 1 127 127 LYS H H 127 9.498 9.498 8.360 1.138 19700 78 1 . 1 1 128 128 LEU N N 128 126.430 126.430 121.420 5.010 19700 79 1 . 1 1 128 128 LEU HA H 128 4.441 4.441 3.528 0.913 19700 80 1 . 1 1 128 128 LEU H H 128 9.105 9.105 8.612 0.493 19700 81 1 . 1 1 129 129 HIS N N 129 124.315 124.315 123.411 0.904 19700 82 1 . 1 1 129 129 HIS HA H 129 4.930 4.930 4.641 0.289 19700 83 1 . 1 1 129 129 HIS H H 129 9.123 9.123 8.431 0.692 19700 84 1 . 1 1 130 130 GLN N N 130 120.311 120.311 116.361 3.950 19700 85 1 . 1 1 130 130 GLN HA H 130 4.384 4.384 4.433 -0.049 19700 86 1 . 1 1 130 130 GLN H H 130 8.246 8.246 7.616 0.630 19700 87 1 . 1 1 131 131 ARG N N 131 123.995 123.995 122.269 1.726 19700 88 1 . 1 1 131 131 ARG HA H 131 4.290 4.290 4.335 -0.045 19700 89 1 . 1 1 131 131 ARG H H 131 8.510 8.510 8.680 -0.170 19700 90 1 . 1 1 132 132 ARG N N 132 121.592 121.592 120.019 1.573 19700 91 1 . 1 1 132 132 ARG HA H 132 4.308 4.308 4.226 0.082 19700 92 1 . 1 1 132 132 ARG H H 132 8.183 8.183 8.089 0.094 19700 93 1 . 1 1 133 133 ALA N N 133 124.315 124.315 122.345 1.970 19700 94 1 . 1 1 133 133 ALA HA H 133 4.236 4.236 4.318 -0.082 19700 95 1 . 1 1 133 133 ALA H H 133 8.249 8.249 7.943 0.306 19700 96 1 . 1 1 134 134 LEU N N 134 119.576 119.576 118.435 1.141 19700 97 1 . 1 1 134 134 LEU HA H 134 4.265 4.265 4.165 0.100 19700 98 1 . 1 1 134 134 LEU H H 134 8.146 8.146 8.204 -0.058 19700 99 1 . 1 1 135 135 SER N N 135 113.103 113.103 113.789 -0.686 19700 100 1 . 1 1 135 135 SER HA H 135 4.504 4.504 4.282 0.222 19700 101 1 . 1 1 135 135 SER H H 135 7.980 7.980 7.740 0.240 19700 102 1 . 1 1 136 136 TRP N N 136 123.354 123.354 122.191 1.163 19700 103 1 . 1 1 136 136 TRP HA H 136 4.853 4.853 4.662 0.191 19700 104 1 . 1 1 136 136 TRP H H 136 8.027 8.027 8.235 -0.208 19700 105 1 . 1 1 137 137 ARG N N 137 120.614 120.614 120.494 0.120 19700 106 1 . 1 1 137 137 ARG HA H 137 4.674 4.674 4.712 -0.038 19700 107 1 . 1 1 137 137 ARG H H 137 7.991 7.991 8.351 -0.360 19700 108 1 . 1 1 138 138 TYR N N 138 119.354 119.354 118.864 0.490 19700 109 1 . 1 1 138 138 TYR HA H 138 5.414 5.414 5.045 0.369 19700 110 1 . 1 1 138 138 TYR H H 138 9.191 9.191 8.370 0.821 19700 111 1 . 1 1 139 139 ILE N N 139 119.510 119.510 122.620 -3.110 19700 112 1 . 1 1 139 139 ILE HA H 139 4.318 4.318 4.364 -0.046 19700 113 1 . 1 1 139 139 ILE H H 139 9.104 9.104 9.065 0.039 19700 114 1 . 1 1 140 140 ARG N N 140 125.596 125.596 126.302 -0.706 19700 115 1 . 1 1 140 140 ARG HA H 140 4.816 4.816 5.076 -0.260 19700 116 1 . 1 1 140 140 ARG H H 140 8.393 8.393 8.392 0.001 19700 117 1 . 1 1 141 141 GLY N N 141 103.964 103.964 109.763 -5.799 19700 118 1 . 1 1 141 141 GLY H H 141 6.307 6.307 7.527 -1.220 19700 119 1 . 1 1 142 142 CYS N N 142 117.908 117.908 119.409 -1.501 19700 120 1 . 1 1 142 142 CYS HA H 142 5.756 5.756 4.955 0.801 19700 121 1 . 1 1 142 142 CYS H H 142 8.184 8.184 8.618 -0.434 19700 122 1 . 1 1 143 143 ALA N N 143 121.268 121.268 123.442 -2.174 19700 123 1 . 1 1 143 143 ALA HA H 143 4.795 4.795 4.918 -0.123 19700 124 1 . 1 1 143 143 ALA H H 143 9.508 9.508 8.738 0.770 19700 125 1 . 1 1 144 144 ASP N N 144 118.068 118.068 118.306 -0.238 19700 126 1 . 1 1 144 144 ASP HA H 144 4.892 4.892 4.649 0.243 19700 127 1 . 1 1 144 144 ASP H H 144 9.030 9.030 8.744 0.286 19700 128 1 . 1 1 145 145 THR N N 145 108.476 108.476 109.334 -0.858 19700 129 1 . 1 1 145 145 THR HA H 145 4.422 4.422 4.345 0.077 19700 130 1 . 1 1 145 145 THR H H 145 7.401 7.401 7.496 -0.095 19700 131 1 . 1 1 146 146 CYS N N 146 123.516 123.516 123.198 0.318 19700 132 1 . 1 1 146 146 CYS HA H 146 4.713 4.713 4.389 0.324 19700 133 1 . 1 1 146 146 CYS H H 146 8.850 8.850 8.500 0.350 19700 134 1 . 1 1 147 147 PRO HA H 147 4.256 4.256 4.417 -0.161 19700 135 1 . 1 1 148 148 VAL N N 148 118.686 118.686 121.400 -2.714 19700 136 1 . 1 1 148 148 VAL HA H 148 4.086 4.086 4.057 0.029 19700 137 1 . 1 1 148 148 VAL H H 148 7.857 7.857 8.164 -0.307 19700 138 1 . 1 1 149 149 GLY N N 149 113.423 113.423 111.939 1.484 19700 139 1 . 1 1 149 149 GLY H H 149 8.357 8.357 8.080 0.277 19700 140 1 . 1 1 150 150 LYS N N 150 121.492 121.492 121.069 0.423 19700 141 1 . 1 1 150 150 LYS HA H 150 4.627 4.627 4.626 0.001 19700 142 1 . 1 1 150 150 LYS H H 150 8.574 8.574 8.337 0.237 19700 143 1 . 1 1 151 151 PRO HA H 151 4.342 4.342 4.426 -0.084 19700 144 1 . 1 1 152 152 TYR N N 152 111.257 111.257 118.198 -6.941 19700 145 1 . 1 1 152 152 TYR HA H 152 4.524 4.524 4.532 -0.008 19700 146 1 . 1 1 152 152 TYR H H 152 7.127 7.127 8.076 -0.949 19700 147 1 . 1 1 153 153 GLU N N 153 119.670 119.670 117.810 1.860 19700 148 1 . 1 1 153 153 GLU HA H 153 4.407 4.407 4.261 0.146 19700 149 1 . 1 1 153 153 GLU H H 153 7.603 7.603 7.705 -0.102 19700 150 1 . 1 1 154 154 MET N N 154 117.748 117.748 116.048 1.700 19700 151 1 . 1 1 154 154 MET HA H 154 4.335 4.335 4.058 0.277 19700 152 1 . 1 1 154 154 MET H H 154 8.052 8.052 7.431 0.621 19700 153 1 . 1 1 155 155 ILE N N 155 121.057 121.057 119.081 1.976 19700 154 1 . 1 1 155 155 ILE HA H 155 4.544 4.544 4.118 0.426 19700 155 1 . 1 1 155 155 ILE H H 155 8.393 8.393 8.272 0.121 19700 156 1 . 1 1 156 156 GLU N N 156 127.999 127.999 129.143 -1.144 19700 157 1 . 1 1 156 156 GLU HA H 156 4.872 4.872 4.627 0.245 19700 158 1 . 1 1 156 156 GLU H H 156 8.994 8.994 8.341 0.653 19700 159 1 . 1 1 157 157 CYS N N 157 123.034 123.034 121.173 1.861 19700 160 1 . 1 1 157 157 CYS HA H 157 5.518 5.518 5.646 -0.128 19700 161 1 . 1 1 157 157 CYS H H 157 9.029 9.029 8.578 0.451 19700 162 1 . 1 1 158 158 CYS N N 158 119.670 119.670 119.833 -0.163 19700 163 1 . 1 1 158 158 CYS HA H 158 5.171 5.171 4.860 0.311 19700 164 1 . 1 1 158 158 CYS H H 158 9.344 9.344 9.052 0.292 19700 165 1 . 1 1 159 159 SER N N 159 114.684 114.684 116.063 -1.379 19700 166 1 . 1 1 159 159 SER HA H 159 5.112 5.112 4.755 0.357 19700 167 1 . 1 1 159 159 SER H H 159 9.064 9.064 8.540 0.524 19700 168 1 . 1 1 160 160 THR N N 160 111.828 111.828 112.967 -1.139 19700 169 1 . 1 1 160 160 THR HA H 160 4.784 4.784 4.530 0.254 19700 170 1 . 1 1 160 160 THR H H 160 7.626 7.626 7.490 0.136 19700 171 1 . 1 1 161 161 ASP N N 161 118.279 118.279 123.260 -4.981 19700 172 1 . 1 1 161 161 ASP HA H 161 4.856 4.856 4.343 0.513 19700 173 1 . 1 1 161 161 ASP H H 161 8.332 8.332 8.531 -0.200 19700 174 1 . 1 1 162 162 LYS N N 162 116.091 116.091 117.924 -1.833 19700 175 1 . 1 1 162 162 LYS HA H 162 3.452 3.452 3.703 -0.251 19700 176 1 . 1 1 162 162 LYS H H 162 9.460 9.460 8.385 1.075 19700 177 1 . 1 1 163 163 CYS N N 163 111.859 111.859 115.480 -3.621 19700 178 1 . 1 1 163 163 CYS HA H 163 4.416 4.416 4.186 0.230 19700 179 1 . 1 1 163 163 CYS H H 163 7.751 7.751 8.451 -0.701 19700 180 1 . 1 1 164 164 ASN N N 164 122.713 122.713 117.417 5.296 19700 181 1 . 1 1 164 164 ASN HA H 164 4.684 4.684 4.607 0.077 19700 182 1 . 1 1 164 164 ASN H H 164 9.396 9.396 8.209 1.187 19700 stop_ save_