data_19638 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19638 _Entry.PDB_ID 2MHM 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 19638 _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 -3 -3 PHE HA H -3 4.259 4.259 4.527 -0.268 19638 2 1 1 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.892 0.716 19638 3 1 1 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.564 -0.771 19638 4 1 1 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.708 -1.131 19638 5 1 1 . 1 1 2 2 SER H H 2 9.424 9.424 8.421 1.003 19638 6 1 1 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.613 -0.633 19638 7 1 1 . 1 1 3 3 ALA H H 3 9.092 9.092 9.024 0.068 19638 8 1 1 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.997 0.276 19638 9 1 1 . 1 1 4 4 LYS H H 4 8.086 8.086 7.787 0.299 19638 10 1 1 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.093 -0.043 19638 11 1 1 . 1 1 5 5 LYS H H 5 7.755 7.755 7.891 -0.136 19638 12 1 1 . 1 1 6 6 GLY H H 6 8.694 8.694 7.697 0.997 19638 13 1 1 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.280 -0.934 19638 14 1 1 . 1 1 7 7 ALA H H 7 7.999 7.999 8.567 -0.568 19638 15 1 1 . 1 1 8 8 THR HA H 8 3.898 3.898 3.979 -0.081 19638 16 1 1 . 1 1 8 8 THR H H 8 7.203 7.203 7.527 -0.324 19638 17 1 1 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.100 -0.256 19638 18 1 1 . 1 1 9 9 LEU H H 9 7.846 7.846 7.476 0.370 19638 19 1 1 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.025 -0.522 19638 20 1 1 . 1 1 10 10 PHE H H 10 8.651 8.651 8.535 0.116 19638 21 1 1 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.974 0.249 19638 22 1 1 . 1 1 11 11 LYS H H 11 8.365 8.365 8.006 0.359 19638 23 1 1 . 1 1 12 12 THR HA H 12 4.361 4.361 4.219 0.142 19638 24 1 1 . 1 1 12 12 THR H H 12 7.959 7.959 8.173 -0.214 19638 25 1 1 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.577 0.009 19638 26 1 1 . 1 1 13 13 ARG H H 13 8.338 8.338 8.030 0.308 19638 27 1 1 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.382 -3.468 19638 28 1 1 . 1 1 14 14 CYS H H 14 8.047 8.047 8.353 -0.306 19638 29 1 1 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.343 1.775 19638 30 1 1 . 1 1 15 15 LEU H H 15 8.070 8.070 7.731 0.339 19638 31 1 1 . 1 1 16 16 GLN HA H 16 4.658 4.658 4.045 0.613 19638 32 1 1 . 1 1 16 16 GLN H H 16 10.022 10.022 8.480 1.542 19638 33 1 1 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.509 1.679 19638 34 1 1 . 1 1 17 17 CYS H H 17 9.730 9.730 7.420 2.310 19638 35 1 1 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.920 3.924 19638 36 1 1 . 1 1 18 18 HIS H H 18 11.098 11.098 8.698 2.400 19638 37 1 1 . 1 1 19 19 THR HA H 19 6.298 6.298 4.356 1.942 19638 38 1 1 . 1 1 19 19 THR H H 19 10.180 10.180 8.787 1.393 19638 39 1 1 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.915 1.089 19638 40 1 1 . 1 1 20 20 VAL H H 20 8.927 8.927 8.299 0.628 19638 41 1 1 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.200 0.419 19638 42 1 1 . 1 1 21 21 GLU H H 21 9.460 9.460 7.325 2.135 19638 43 1 1 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.000 -0.374 19638 44 1 1 . 1 1 22 22 LYS H H 22 9.064 9.064 8.524 0.540 19638 45 1 1 . 1 1 23 23 GLY H H 23 9.543 9.543 8.535 1.008 19638 46 1 1 . 1 1 24 24 GLY H H 24 8.296 8.296 7.297 0.999 19638 47 1 1 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.296 0.201 19638 48 1 1 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.792 0.483 19638 49 1 1 . 1 1 26 26 HIS H H 26 8.931 8.931 8.359 0.572 19638 50 1 1 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.485 0.185 19638 51 1 1 . 1 1 27 27 LYS H H 27 8.362 8.362 8.148 0.214 19638 52 1 1 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.588 -0.452 19638 53 1 1 . 1 1 28 28 VAL H H 28 7.720 7.720 8.806 -1.086 19638 54 1 1 . 1 1 29 29 GLY H H 29 7.705 7.705 7.953 -0.248 19638 55 1 1 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.190 -0.072 19638 56 1 1 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.864 1.053 19638 57 1 1 . 1 1 31 31 ASN H H 31 11.993 11.993 8.325 3.668 19638 58 1 1 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.520 -0.060 19638 59 1 1 . 1 1 32 32 LEU H H 32 9.445 9.445 8.387 1.058 19638 60 1 1 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.626 -0.520 19638 61 1 1 . 1 1 33 33 HIS H H 33 8.051 8.051 8.595 -0.544 19638 62 1 1 . 1 1 34 34 GLY H H 34 9.066 9.066 8.616 0.450 19638 63 1 1 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.829 -0.268 19638 64 1 1 . 1 1 35 35 ILE H H 35 7.068 7.068 7.960 -0.892 19638 65 1 1 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.365 -0.453 19638 66 1 1 . 1 1 36 36 PHE H H 36 7.901 7.901 7.783 0.118 19638 67 1 1 . 1 1 37 37 GLY H H 37 8.766 8.766 9.201 -0.435 19638 68 1 1 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.562 0.053 19638 69 1 1 . 1 1 38 38 ARG H H 38 7.962 7.962 7.661 0.301 19638 70 1 1 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.933 0.129 19638 71 1 1 . 1 1 39 39 HIS H H 39 8.064 8.064 8.719 -0.655 19638 72 1 1 . 1 1 40 40 SER HA H 40 4.601 4.601 4.212 0.389 19638 73 1 1 . 1 1 40 40 SER H H 40 8.588 8.588 8.645 -0.057 19638 74 1 1 . 1 1 41 41 GLY H H 41 8.930 8.930 8.109 0.821 19638 75 1 1 . 1 1 42 42 GLN H H 42 7.865 7.865 8.310 -0.445 19638 76 1 1 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.256 0.080 19638 77 1 1 . 1 1 43 43 ALA H H 43 8.062 8.062 7.971 0.091 19638 78 1 1 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.021 0.154 19638 79 1 1 . 1 1 44 44 GLU H H 44 8.924 8.924 8.066 0.858 19638 80 1 1 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.360 -0.515 19638 81 1 1 . 1 1 46 46 TYR H H 46 7.033 7.033 7.537 -0.504 19638 82 1 1 . 1 1 47 47 SER HA H 47 4.283 4.283 4.174 0.109 19638 83 1 1 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.877 -0.635 19638 84 1 1 . 1 1 48 48 TYR H H 48 7.905 7.905 8.113 -0.208 19638 85 1 1 . 1 1 49 49 THR HA H 49 4.124 4.124 4.224 -0.100 19638 86 1 1 . 1 1 49 49 THR H H 49 9.712 9.712 8.842 0.870 19638 87 1 1 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.332 -0.071 19638 88 1 1 . 1 1 50 50 ASP H H 50 8.682 8.682 9.095 -0.413 19638 89 1 1 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.983 0.199 19638 90 1 1 . 1 1 51 51 ALA H H 51 7.802 7.802 7.754 0.048 19638 91 1 1 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.496 0.191 19638 92 1 1 . 1 1 52 52 ASN H H 52 8.422 8.422 8.232 0.191 19638 93 1 1 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.740 -0.060 19638 94 1 1 . 1 1 53 53 ILE H H 53 7.686 7.686 8.211 -0.525 19638 95 1 1 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.086 -0.157 19638 96 1 1 . 1 1 54 54 LYS H H 54 9.101 9.101 8.234 0.867 19638 97 1 1 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.063 -0.027 19638 98 1 1 . 1 1 55 55 LYS H H 55 7.355 7.355 8.243 -0.888 19638 99 1 1 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.392 -0.067 19638 100 1 1 . 1 1 56 56 ASN H H 56 7.506 7.506 8.164 -0.658 19638 101 1 1 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.208 -0.017 19638 102 1 1 . 1 1 57 57 VAL H H 57 7.341 7.341 8.115 -0.774 19638 103 1 1 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.123 -0.325 19638 104 1 1 . 1 1 58 58 LEU H H 58 8.220 8.220 8.208 0.012 19638 105 1 1 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.617 0.498 19638 106 1 1 . 1 1 59 59 TRP H H 59 7.973 7.973 8.728 -0.755 19638 107 1 1 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.944 -0.207 19638 108 1 1 . 1 1 60 60 ASP H H 60 10.093 10.093 8.286 1.807 19638 109 1 1 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.225 -0.887 19638 110 1 1 . 1 1 61 61 GLU H H 61 10.090 10.090 9.110 0.980 19638 111 1 1 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.625 -0.169 19638 112 1 1 . 1 1 62 62 ASN H H 62 8.211 8.211 8.674 -0.463 19638 113 1 1 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.491 0.059 19638 114 1 1 . 1 1 63 63 ASN H H 63 9.331 9.331 8.200 1.131 19638 115 1 1 . 1 1 64 64 MET HA H 64 4.321 4.321 4.222 0.099 19638 116 1 1 . 1 1 64 64 MET H H 64 8.702 8.702 8.909 -0.207 19638 117 1 1 . 1 1 65 65 SER HA H 65 3.445 3.445 4.209 -0.764 19638 118 1 1 . 1 1 65 65 SER H H 65 7.442 7.442 7.969 -0.527 19638 119 1 1 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.028 -0.171 19638 120 1 1 . 1 1 66 66 GLU H H 66 7.574 7.574 7.456 0.118 19638 121 1 1 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.497 0.782 19638 122 1 1 . 1 1 67 67 HIS H H 67 8.297 8.297 7.502 0.795 19638 123 1 1 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.010 -0.654 19638 124 1 1 . 1 1 68 68 LEU H H 68 8.060 8.060 7.800 0.260 19638 125 1 1 . 1 1 69 69 THR HA H 69 3.792 3.792 4.088 -0.296 19638 126 1 1 . 1 1 69 69 THR H H 69 7.327 7.327 8.137 -0.810 19638 127 1 1 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.132 -0.105 19638 128 1 1 . 1 1 70 70 ASN H H 70 6.715 6.715 7.906 -1.191 19638 129 1 1 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.248 1.713 19638 130 1 1 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.150 0.975 19638 131 1 1 . 1 1 72 72 ALA H H 72 9.052 9.052 8.243 0.809 19638 132 1 1 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.070 0.499 19638 133 1 1 . 1 1 73 73 LYS H H 73 7.914 7.914 8.186 -0.272 19638 134 1 1 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.229 0.798 19638 135 1 1 . 1 1 74 74 TYR H H 74 8.520 8.520 7.737 0.783 19638 136 1 1 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.544 0.117 19638 137 1 1 . 1 1 75 75 ILE H H 75 9.542 9.542 7.757 1.785 19638 138 1 1 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.670 0.457 19638 139 1 1 . 1 1 77 77 GLY H H 77 9.573 9.573 8.688 0.885 19638 140 1 1 . 1 1 78 78 THR HA H 78 5.058 5.058 4.655 0.403 19638 141 1 1 . 1 1 78 78 THR H H 78 9.274 9.274 7.737 1.537 19638 142 1 1 . 1 1 79 79 LYS H H 79 8.060 8.060 8.574 -0.514 19638 143 1 1 . 1 1 80 80 MET H H 80 8.670 8.670 7.469 1.201 19638 144 1 1 . 1 1 81 81 ALA H H 81 8.060 8.060 8.611 -0.551 19638 145 1 1 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.742 -0.180 19638 146 1 1 . 1 1 82 82 PHE H H 82 8.446 8.446 8.272 0.174 19638 147 1 1 . 1 1 83 83 GLY H H 83 7.142 7.142 7.663 -0.521 19638 148 1 1 . 1 1 84 84 GLY H H 84 8.211 8.211 8.160 0.051 19638 149 1 1 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.468 -0.213 19638 150 1 1 . 1 1 85 85 LEU H H 85 8.160 8.160 8.254 -0.094 19638 151 1 1 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.048 -0.093 19638 152 1 1 . 1 1 86 86 LYS H H 86 8.440 8.440 8.654 -0.214 19638 153 1 1 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.359 0.011 19638 154 1 1 . 1 1 87 87 LYS H H 87 8.800 8.800 7.878 0.922 19638 155 1 1 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.052 -0.626 19638 156 1 1 . 1 1 88 88 GLU H H 88 8.971 8.971 9.070 -0.099 19638 157 1 1 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.957 -0.140 19638 158 1 1 . 1 1 89 89 LYS H H 89 8.679 8.679 8.255 0.424 19638 159 1 1 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.426 -0.385 19638 160 1 1 . 1 1 90 90 ASP H H 90 6.295 6.295 8.432 -2.137 19638 161 1 1 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.023 -0.742 19638 162 1 1 . 1 1 91 91 ARG H H 91 7.285 7.285 7.507 -0.222 19638 163 1 1 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.401 -0.596 19638 164 1 1 . 1 1 92 92 ASN H H 92 8.541 8.541 8.040 0.501 19638 165 1 1 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.491 -0.498 19638 166 1 1 . 1 1 93 93 ASP H H 93 8.518 8.518 7.731 0.787 19638 167 1 1 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.137 -0.359 19638 168 1 1 . 1 1 94 94 LEU H H 94 8.167 8.167 7.578 0.589 19638 169 1 1 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.803 -0.834 19638 170 1 1 . 1 1 95 95 ILE H H 95 8.718 8.718 7.827 0.891 19638 171 1 1 . 1 1 96 96 THR HA H 96 3.661 3.661 3.887 -0.226 19638 172 1 1 . 1 1 96 96 THR H H 96 7.955 7.955 7.986 -0.031 19638 173 1 1 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.056 -0.064 19638 174 1 1 . 1 1 97 97 TYR H H 97 7.619 7.619 7.916 -0.297 19638 175 1 1 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.703 -0.472 19638 176 1 1 . 1 1 98 98 LEU H H 98 8.933 8.933 7.706 1.227 19638 177 1 1 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.222 0.270 19638 178 1 1 . 1 1 99 99 LYS H H 99 8.454 8.454 8.164 0.290 19638 179 1 1 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.829 0.265 19638 180 1 1 . 1 1 100 100 LYS H H 100 6.501 6.501 7.863 -1.362 19638 181 1 1 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.983 -0.028 19638 182 1 1 . 1 1 101 101 ALA H H 101 8.296 8.296 7.322 0.974 19638 183 1 1 . 1 1 102 102 THR H H 102 7.330 7.330 7.300 0.030 19638 184 1 2 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.701 -0.442 19638 185 1 2 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.635 -0.027 19638 186 1 2 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.159 -0.366 19638 187 1 2 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.828 -1.251 19638 188 1 2 . 1 1 2 2 SER H H 2 9.424 9.424 8.258 1.166 19638 189 1 2 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.321 -0.341 19638 190 1 2 . 1 1 3 3 ALA H H 3 9.092 9.092 8.402 0.690 19638 191 1 2 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.911 0.362 19638 192 1 2 . 1 1 4 4 LYS H H 4 8.086 8.086 8.320 -0.234 19638 193 1 2 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.105 -0.055 19638 194 1 2 . 1 1 5 5 LYS H H 5 7.755 7.755 8.189 -0.434 19638 195 1 2 . 1 1 6 6 GLY H H 6 8.694 8.694 7.853 0.841 19638 196 1 2 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.440 -1.094 19638 197 1 2 . 1 1 7 7 ALA H H 7 7.999 7.999 8.273 -0.274 19638 198 1 2 . 1 1 8 8 THR HA H 8 3.898 3.898 4.012 -0.114 19638 199 1 2 . 1 1 8 8 THR H H 8 7.203 7.203 7.747 -0.544 19638 200 1 2 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.074 -0.230 19638 201 1 2 . 1 1 9 9 LEU H H 9 7.846 7.846 7.653 0.193 19638 202 1 2 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.008 -0.505 19638 203 1 2 . 1 1 10 10 PHE H H 10 8.651 8.651 8.216 0.435 19638 204 1 2 . 1 1 11 11 LYS HA H 11 4.223 4.223 4.043 0.180 19638 205 1 2 . 1 1 11 11 LYS H H 11 8.365 8.365 8.162 0.203 19638 206 1 2 . 1 1 12 12 THR HA H 12 4.361 4.361 4.457 -0.096 19638 207 1 2 . 1 1 12 12 THR H H 12 7.959 7.959 8.084 -0.125 19638 208 1 2 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.623 -0.037 19638 209 1 2 . 1 1 13 13 ARG H H 13 8.338 8.338 7.778 0.560 19638 210 1 2 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.454 -3.540 19638 211 1 2 . 1 1 14 14 CYS H H 14 8.047 8.047 7.928 0.119 19638 212 1 2 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.300 1.818 19638 213 1 2 . 1 1 15 15 LEU H H 15 8.070 8.070 7.884 0.186 19638 214 1 2 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.984 0.674 19638 215 1 2 . 1 1 16 16 GLN H H 16 10.022 10.022 8.382 1.640 19638 216 1 2 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.392 1.796 19638 217 1 2 . 1 1 17 17 CYS H H 17 9.730 9.730 7.474 2.256 19638 218 1 2 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.886 3.958 19638 219 1 2 . 1 1 18 18 HIS H H 18 11.098 11.098 8.320 2.778 19638 220 1 2 . 1 1 19 19 THR HA H 19 6.298 6.298 4.426 1.872 19638 221 1 2 . 1 1 19 19 THR H H 19 10.180 10.180 8.833 1.347 19638 222 1 2 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.894 1.110 19638 223 1 2 . 1 1 20 20 VAL H H 20 8.927 8.927 8.249 0.678 19638 224 1 2 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.488 0.131 19638 225 1 2 . 1 1 21 21 GLU H H 21 9.460 9.460 7.441 2.019 19638 226 1 2 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.947 -0.321 19638 227 1 2 . 1 1 22 22 LYS H H 22 9.064 9.064 8.344 0.720 19638 228 1 2 . 1 1 23 23 GLY H H 23 9.543 9.543 8.122 1.421 19638 229 1 2 . 1 1 24 24 GLY H H 24 8.296 8.296 7.867 0.429 19638 230 1 2 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.261 0.236 19638 231 1 2 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.640 0.635 19638 232 1 2 . 1 1 26 26 HIS H H 26 8.931 8.931 8.115 0.816 19638 233 1 2 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.528 0.142 19638 234 1 2 . 1 1 27 27 LYS H H 27 8.362 8.362 7.973 0.389 19638 235 1 2 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.883 -0.747 19638 236 1 2 . 1 1 28 28 VAL H H 28 7.720 7.720 8.190 -0.470 19638 237 1 2 . 1 1 29 29 GLY H H 29 7.705 7.705 7.203 0.502 19638 238 1 2 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.327 -0.209 19638 239 1 2 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.826 1.091 19638 240 1 2 . 1 1 31 31 ASN H H 31 11.993 11.993 8.377 3.616 19638 241 1 2 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.466 -0.006 19638 242 1 2 . 1 1 32 32 LEU H H 32 9.445 9.445 8.352 1.093 19638 243 1 2 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.573 -0.467 19638 244 1 2 . 1 1 33 33 HIS H H 33 8.051 8.051 8.616 -0.565 19638 245 1 2 . 1 1 34 34 GLY H H 34 9.066 9.066 8.703 0.363 19638 246 1 2 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.855 -0.294 19638 247 1 2 . 1 1 35 35 ILE H H 35 7.068 7.068 7.773 -0.705 19638 248 1 2 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.348 -0.436 19638 249 1 2 . 1 1 36 36 PHE H H 36 7.901 7.901 7.697 0.204 19638 250 1 2 . 1 1 37 37 GLY H H 37 8.766 8.766 9.043 -0.277 19638 251 1 2 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.541 0.074 19638 252 1 2 . 1 1 38 38 ARG H H 38 7.962 7.962 7.495 0.467 19638 253 1 2 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.967 0.095 19638 254 1 2 . 1 1 39 39 HIS H H 39 8.064 8.064 8.713 -0.649 19638 255 1 2 . 1 1 40 40 SER HA H 40 4.601 4.601 4.370 0.231 19638 256 1 2 . 1 1 40 40 SER H H 40 8.588 8.588 8.406 0.182 19638 257 1 2 . 1 1 41 41 GLY H H 41 8.930 8.930 8.261 0.669 19638 258 1 2 . 1 1 42 42 GLN H H 42 7.865 7.865 8.215 -0.350 19638 259 1 2 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.389 -0.053 19638 260 1 2 . 1 1 43 43 ALA H H 43 8.062 8.062 9.005 -0.943 19638 261 1 2 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.159 0.016 19638 262 1 2 . 1 1 44 44 GLU H H 44 8.924 8.924 8.691 0.233 19638 263 1 2 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.363 -0.518 19638 264 1 2 . 1 1 46 46 TYR H H 46 7.033 7.033 7.210 -0.177 19638 265 1 2 . 1 1 47 47 SER HA H 47 4.283 4.283 4.183 0.100 19638 266 1 2 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.680 -0.438 19638 267 1 2 . 1 1 48 48 TYR H H 48 7.905 7.905 8.443 -0.538 19638 268 1 2 . 1 1 49 49 THR HA H 49 4.124 4.124 4.416 -0.292 19638 269 1 2 . 1 1 49 49 THR H H 49 9.712 9.712 8.342 1.370 19638 270 1 2 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.377 -0.116 19638 271 1 2 . 1 1 50 50 ASP H H 50 8.682 8.682 8.816 -0.134 19638 272 1 2 . 1 1 51 51 ALA HA H 51 4.182 4.182 4.065 0.117 19638 273 1 2 . 1 1 51 51 ALA H H 51 7.802 7.802 8.301 -0.499 19638 274 1 2 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.640 0.047 19638 275 1 2 . 1 1 52 52 ASN H H 52 8.422 8.422 7.732 0.690 19638 276 1 2 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.670 0.010 19638 277 1 2 . 1 1 53 53 ILE H H 53 7.686 7.686 7.669 0.017 19638 278 1 2 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.079 -0.150 19638 279 1 2 . 1 1 54 54 LYS H H 54 9.101 9.101 8.245 0.856 19638 280 1 2 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.401 -0.365 19638 281 1 2 . 1 1 55 55 LYS H H 55 7.355 7.355 7.817 -0.462 19638 282 1 2 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.714 -0.389 19638 283 1 2 . 1 1 56 56 ASN H H 56 7.506 7.506 8.509 -1.003 19638 284 1 2 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.224 -0.033 19638 285 1 2 . 1 1 57 57 VAL H H 57 7.341 7.341 8.341 -1.000 19638 286 1 2 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.071 -0.273 19638 287 1 2 . 1 1 58 58 LEU H H 58 8.220 8.220 8.171 0.049 19638 288 1 2 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.486 0.629 19638 289 1 2 . 1 1 59 59 TRP H H 59 7.973 7.973 8.928 -0.955 19638 290 1 2 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.859 -0.122 19638 291 1 2 . 1 1 60 60 ASP H H 60 10.093 10.093 8.278 1.815 19638 292 1 2 . 1 1 61 61 GLU HA H 61 3.338 3.338 3.906 -0.568 19638 293 1 2 . 1 1 61 61 GLU H H 61 10.090 10.090 8.784 1.306 19638 294 1 2 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.577 -0.121 19638 295 1 2 . 1 1 62 62 ASN H H 62 8.211 8.211 8.548 -0.337 19638 296 1 2 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.495 0.055 19638 297 1 2 . 1 1 63 63 ASN H H 63 9.331 9.331 8.392 0.939 19638 298 1 2 . 1 1 64 64 MET HA H 64 4.321 4.321 4.236 0.085 19638 299 1 2 . 1 1 64 64 MET H H 64 8.702 8.702 8.769 -0.067 19638 300 1 2 . 1 1 65 65 SER HA H 65 3.445 3.445 4.192 -0.747 19638 301 1 2 . 1 1 65 65 SER H H 65 7.442 7.442 7.941 -0.499 19638 302 1 2 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.161 -0.304 19638 303 1 2 . 1 1 66 66 GLU H H 66 7.574 7.574 7.782 -0.208 19638 304 1 2 . 1 1 67 67 HIS HA H 67 4.279 4.279 4.284 -0.005 19638 305 1 2 . 1 1 67 67 HIS H H 67 8.297 8.297 7.904 0.393 19638 306 1 2 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.065 -0.709 19638 307 1 2 . 1 1 68 68 LEU H H 68 8.060 8.060 8.464 -0.404 19638 308 1 2 . 1 1 69 69 THR HA H 69 3.792 3.792 4.422 -0.630 19638 309 1 2 . 1 1 69 69 THR H H 69 7.327 7.327 7.389 -0.062 19638 310 1 2 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.484 0.543 19638 311 1 2 . 1 1 70 70 ASN H H 70 6.715 6.715 8.984 -2.269 19638 312 1 2 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.222 1.739 19638 313 1 2 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.087 1.038 19638 314 1 2 . 1 1 72 72 ALA H H 72 9.052 9.052 8.527 0.525 19638 315 1 2 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.053 0.516 19638 316 1 2 . 1 1 73 73 LYS H H 73 7.914 7.914 7.899 0.015 19638 317 1 2 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.277 0.750 19638 318 1 2 . 1 1 74 74 TYR H H 74 8.520 8.520 7.423 1.097 19638 319 1 2 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.822 -0.161 19638 320 1 2 . 1 1 75 75 ILE H H 75 9.542 9.542 7.750 1.792 19638 321 1 2 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.423 0.704 19638 322 1 2 . 1 1 77 77 GLY H H 77 9.573 9.573 8.620 0.953 19638 323 1 2 . 1 1 78 78 THR HA H 78 5.058 5.058 4.438 0.620 19638 324 1 2 . 1 1 78 78 THR H H 78 9.274 9.274 7.437 1.837 19638 325 1 2 . 1 1 79 79 LYS H H 79 8.060 8.060 8.340 -0.280 19638 326 1 2 . 1 1 80 80 MET H H 80 8.670 8.670 7.791 0.879 19638 327 1 2 . 1 1 81 81 ALA H H 81 8.060 8.060 8.481 -0.421 19638 328 1 2 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.653 -0.091 19638 329 1 2 . 1 1 82 82 PHE H H 82 8.446 8.446 8.297 0.149 19638 330 1 2 . 1 1 83 83 GLY H H 83 7.142 7.142 7.801 -0.659 19638 331 1 2 . 1 1 84 84 GLY H H 84 8.211 8.211 8.236 -0.025 19638 332 1 2 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.410 -0.155 19638 333 1 2 . 1 1 85 85 LEU H H 85 8.160 8.160 8.501 -0.341 19638 334 1 2 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.055 -0.100 19638 335 1 2 . 1 1 86 86 LYS H H 86 8.440 8.440 8.575 -0.135 19638 336 1 2 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.334 0.036 19638 337 1 2 . 1 1 87 87 LYS H H 87 8.800 8.800 7.953 0.847 19638 338 1 2 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.007 -0.581 19638 339 1 2 . 1 1 88 88 GLU H H 88 8.971 8.971 9.103 -0.132 19638 340 1 2 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.119 -0.302 19638 341 1 2 . 1 1 89 89 LYS H H 89 8.679 8.679 8.319 0.360 19638 342 1 2 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.419 -0.378 19638 343 1 2 . 1 1 90 90 ASP H H 90 6.295 6.295 8.437 -2.142 19638 344 1 2 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.008 -0.727 19638 345 1 2 . 1 1 91 91 ARG H H 91 7.285 7.285 7.686 -0.401 19638 346 1 2 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.658 -0.853 19638 347 1 2 . 1 1 92 92 ASN H H 92 8.541 8.541 8.147 0.394 19638 348 1 2 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.582 -0.589 19638 349 1 2 . 1 1 93 93 ASP H H 93 8.518 8.518 7.464 1.054 19638 350 1 2 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.241 -0.463 19638 351 1 2 . 1 1 94 94 LEU H H 94 8.167 8.167 7.582 0.585 19638 352 1 2 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.754 -0.785 19638 353 1 2 . 1 1 95 95 ILE H H 95 8.718 8.718 7.728 0.990 19638 354 1 2 . 1 1 96 96 THR HA H 96 3.661 3.661 3.864 -0.203 19638 355 1 2 . 1 1 96 96 THR H H 96 7.955 7.955 8.006 -0.051 19638 356 1 2 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.050 -0.058 19638 357 1 2 . 1 1 97 97 TYR H H 97 7.619 7.619 8.037 -0.418 19638 358 1 2 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.634 -0.403 19638 359 1 2 . 1 1 98 98 LEU H H 98 8.933 8.933 7.705 1.228 19638 360 1 2 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.138 0.354 19638 361 1 2 . 1 1 99 99 LYS H H 99 8.454 8.454 8.080 0.374 19638 362 1 2 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.876 0.218 19638 363 1 2 . 1 1 100 100 LYS H H 100 6.501 6.501 7.724 -1.223 19638 364 1 2 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.974 -0.019 19638 365 1 2 . 1 1 101 101 ALA H H 101 8.296 8.296 7.300 0.996 19638 366 1 2 . 1 1 102 102 THR H H 102 7.330 7.330 7.399 -0.069 19638 367 1 3 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.657 -0.398 19638 368 1 3 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.695 0.913 19638 369 1 3 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.410 -0.617 19638 370 1 3 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.395 -0.818 19638 371 1 3 . 1 1 2 2 SER H H 2 9.424 9.424 8.358 1.066 19638 372 1 3 . 1 1 3 3 ALA HA H 3 3.980 3.980 3.973 0.007 19638 373 1 3 . 1 1 3 3 ALA H H 3 9.092 9.092 7.923 1.169 19638 374 1 3 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.839 0.434 19638 375 1 3 . 1 1 4 4 LYS H H 4 8.086 8.086 8.661 -0.575 19638 376 1 3 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.048 0.002 19638 377 1 3 . 1 1 5 5 LYS H H 5 7.755 7.755 8.340 -0.585 19638 378 1 3 . 1 1 6 6 GLY H H 6 8.694 8.694 7.847 0.847 19638 379 1 3 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.207 -0.861 19638 380 1 3 . 1 1 7 7 ALA H H 7 7.999 7.999 7.264 0.735 19638 381 1 3 . 1 1 8 8 THR HA H 8 3.898 3.898 4.007 -0.109 19638 382 1 3 . 1 1 8 8 THR H H 8 7.203 7.203 7.599 -0.396 19638 383 1 3 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.082 -0.238 19638 384 1 3 . 1 1 9 9 LEU H H 9 7.846 7.846 8.038 -0.192 19638 385 1 3 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.081 -0.578 19638 386 1 3 . 1 1 10 10 PHE H H 10 8.651 8.651 8.072 0.579 19638 387 1 3 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.984 0.239 19638 388 1 3 . 1 1 11 11 LYS H H 11 8.365 8.365 7.707 0.657 19638 389 1 3 . 1 1 12 12 THR HA H 12 4.361 4.361 4.155 0.206 19638 390 1 3 . 1 1 12 12 THR H H 12 7.959 7.959 8.187 -0.228 19638 391 1 3 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.572 0.014 19638 392 1 3 . 1 1 13 13 ARG H H 13 8.338 8.338 7.910 0.428 19638 393 1 3 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.408 -3.494 19638 394 1 3 . 1 1 14 14 CYS H H 14 8.047 8.047 8.316 -0.269 19638 395 1 3 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.359 1.759 19638 396 1 3 . 1 1 15 15 LEU H H 15 8.070 8.070 7.632 0.438 19638 397 1 3 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.978 0.680 19638 398 1 3 . 1 1 16 16 GLN H H 16 10.022 10.022 8.381 1.641 19638 399 1 3 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.456 1.732 19638 400 1 3 . 1 1 17 17 CYS H H 17 9.730 9.730 7.460 2.270 19638 401 1 3 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.908 3.936 19638 402 1 3 . 1 1 18 18 HIS H H 18 11.098 11.098 8.652 2.446 19638 403 1 3 . 1 1 19 19 THR HA H 19 6.298 6.298 4.411 1.887 19638 404 1 3 . 1 1 19 19 THR H H 19 10.180 10.180 8.889 1.291 19638 405 1 3 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.976 1.028 19638 406 1 3 . 1 1 20 20 VAL H H 20 8.927 8.927 8.337 0.590 19638 407 1 3 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.430 0.189 19638 408 1 3 . 1 1 21 21 GLU H H 21 9.460 9.460 7.403 2.057 19638 409 1 3 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.027 -0.401 19638 410 1 3 . 1 1 22 22 LYS H H 22 9.064 9.064 8.273 0.791 19638 411 1 3 . 1 1 23 23 GLY H H 23 9.543 9.543 8.309 1.234 19638 412 1 3 . 1 1 24 24 GLY H H 24 8.296 8.296 7.738 0.558 19638 413 1 3 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.286 0.211 19638 414 1 3 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.762 0.513 19638 415 1 3 . 1 1 26 26 HIS H H 26 8.931 8.931 8.289 0.642 19638 416 1 3 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.491 0.179 19638 417 1 3 . 1 1 27 27 LYS H H 27 8.362 8.362 8.033 0.330 19638 418 1 3 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.877 -0.741 19638 419 1 3 . 1 1 28 28 VAL H H 28 7.720 7.720 8.333 -0.613 19638 420 1 3 . 1 1 29 29 GLY H H 29 7.705 7.705 7.317 0.388 19638 421 1 3 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.222 -0.104 19638 422 1 3 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.859 1.058 19638 423 1 3 . 1 1 31 31 ASN H H 31 11.993 11.993 8.492 3.501 19638 424 1 3 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.497 -0.037 19638 425 1 3 . 1 1 32 32 LEU H H 32 9.445 9.445 8.320 1.125 19638 426 1 3 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.611 -0.505 19638 427 1 3 . 1 1 33 33 HIS H H 33 8.051 8.051 8.732 -0.681 19638 428 1 3 . 1 1 34 34 GLY H H 34 9.066 9.066 8.589 0.477 19638 429 1 3 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.810 -0.249 19638 430 1 3 . 1 1 35 35 ILE H H 35 7.068 7.068 7.800 -0.732 19638 431 1 3 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.341 -0.429 19638 432 1 3 . 1 1 36 36 PHE H H 36 7.901 7.901 7.636 0.265 19638 433 1 3 . 1 1 37 37 GLY H H 37 8.766 8.766 9.199 -0.433 19638 434 1 3 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.658 -0.043 19638 435 1 3 . 1 1 38 38 ARG H H 38 7.962 7.962 7.560 0.402 19638 436 1 3 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.014 0.048 19638 437 1 3 . 1 1 39 39 HIS H H 39 8.064 8.064 8.801 -0.737 19638 438 1 3 . 1 1 40 40 SER HA H 40 4.601 4.601 4.335 0.266 19638 439 1 3 . 1 1 40 40 SER H H 40 8.588 8.588 8.372 0.216 19638 440 1 3 . 1 1 41 41 GLY H H 41 8.930 8.930 8.303 0.627 19638 441 1 3 . 1 1 42 42 GLN H H 42 7.865 7.865 8.097 -0.232 19638 442 1 3 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.203 0.133 19638 443 1 3 . 1 1 43 43 ALA H H 43 8.062 8.062 7.991 0.071 19638 444 1 3 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.038 0.137 19638 445 1 3 . 1 1 44 44 GLU H H 44 8.924 8.924 8.569 0.355 19638 446 1 3 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.554 -0.709 19638 447 1 3 . 1 1 46 46 TYR H H 46 7.033 7.033 7.569 -0.536 19638 448 1 3 . 1 1 47 47 SER HA H 47 4.283 4.283 4.133 0.150 19638 449 1 3 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.682 -0.440 19638 450 1 3 . 1 1 48 48 TYR H H 48 7.905 7.905 8.399 -0.494 19638 451 1 3 . 1 1 49 49 THR HA H 49 4.124 4.124 4.436 -0.312 19638 452 1 3 . 1 1 49 49 THR H H 49 9.712 9.712 8.588 1.124 19638 453 1 3 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.275 -0.014 19638 454 1 3 . 1 1 50 50 ASP H H 50 8.682 8.682 9.009 -0.327 19638 455 1 3 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.879 0.303 19638 456 1 3 . 1 1 51 51 ALA H H 51 7.802 7.802 8.593 -0.791 19638 457 1 3 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.664 0.023 19638 458 1 3 . 1 1 52 52 ASN H H 52 8.422 8.422 8.302 0.120 19638 459 1 3 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.742 -0.062 19638 460 1 3 . 1 1 53 53 ILE H H 53 7.686 7.686 7.824 -0.138 19638 461 1 3 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.072 -0.143 19638 462 1 3 . 1 1 54 54 LYS H H 54 9.101 9.101 8.321 0.780 19638 463 1 3 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.382 -0.346 19638 464 1 3 . 1 1 55 55 LYS H H 55 7.355 7.355 7.792 -0.437 19638 465 1 3 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.740 -0.415 19638 466 1 3 . 1 1 56 56 ASN H H 56 7.506 7.506 8.539 -1.033 19638 467 1 3 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.152 0.039 19638 468 1 3 . 1 1 57 57 VAL H H 57 7.341 7.341 8.341 -1.000 19638 469 1 3 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.189 -0.391 19638 470 1 3 . 1 1 58 58 LEU H H 58 8.220 8.220 8.211 0.009 19638 471 1 3 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.606 0.509 19638 472 1 3 . 1 1 59 59 TRP H H 59 7.973 7.973 8.688 -0.715 19638 473 1 3 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.890 -0.153 19638 474 1 3 . 1 1 60 60 ASP H H 60 10.093 10.093 8.316 1.777 19638 475 1 3 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.098 -0.760 19638 476 1 3 . 1 1 61 61 GLU H H 61 10.090 10.090 8.784 1.306 19638 477 1 3 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.597 -0.141 19638 478 1 3 . 1 1 62 62 ASN H H 62 8.211 8.211 8.401 -0.190 19638 479 1 3 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.530 0.020 19638 480 1 3 . 1 1 63 63 ASN H H 63 9.331 9.331 9.254 0.077 19638 481 1 3 . 1 1 64 64 MET HA H 64 4.321 4.321 4.252 0.069 19638 482 1 3 . 1 1 64 64 MET H H 64 8.702 8.702 8.385 0.317 19638 483 1 3 . 1 1 65 65 SER HA H 65 3.445 3.445 4.260 -0.815 19638 484 1 3 . 1 1 65 65 SER H H 65 7.442 7.442 7.755 -0.313 19638 485 1 3 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.219 -0.362 19638 486 1 3 . 1 1 66 66 GLU H H 66 7.574 7.574 7.768 -0.194 19638 487 1 3 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.968 0.311 19638 488 1 3 . 1 1 67 67 HIS H H 67 8.297 8.297 8.108 0.189 19638 489 1 3 . 1 1 68 68 LEU HA H 68 3.356 3.356 3.952 -0.596 19638 490 1 3 . 1 1 68 68 LEU H H 68 8.060 8.060 7.930 0.130 19638 491 1 3 . 1 1 69 69 THR HA H 69 3.792 3.792 4.118 -0.326 19638 492 1 3 . 1 1 69 69 THR H H 69 7.327 7.327 7.759 -0.432 19638 493 1 3 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.983 0.044 19638 494 1 3 . 1 1 70 70 ASN H H 70 6.715 6.715 7.615 -0.900 19638 495 1 3 . 1 1 71 71 PRO HA H 71 5.961 5.961 3.890 2.071 19638 496 1 3 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.048 1.077 19638 497 1 3 . 1 1 72 72 ALA H H 72 9.052 9.052 8.555 0.497 19638 498 1 3 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.054 0.515 19638 499 1 3 . 1 1 73 73 LYS H H 73 7.914 7.914 7.938 -0.024 19638 500 1 3 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.248 0.779 19638 501 1 3 . 1 1 74 74 TYR H H 74 8.520 8.520 7.635 0.885 19638 502 1 3 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.769 -0.108 19638 503 1 3 . 1 1 75 75 ILE H H 75 9.542 9.542 7.954 1.588 19638 504 1 3 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.407 0.720 19638 505 1 3 . 1 1 77 77 GLY H H 77 9.573 9.573 8.565 1.008 19638 506 1 3 . 1 1 78 78 THR HA H 78 5.058 5.058 4.538 0.520 19638 507 1 3 . 1 1 78 78 THR H H 78 9.274 9.274 7.621 1.653 19638 508 1 3 . 1 1 79 79 LYS H H 79 8.060 8.060 8.811 -0.751 19638 509 1 3 . 1 1 80 80 MET H H 80 8.670 8.670 7.542 1.128 19638 510 1 3 . 1 1 81 81 ALA H H 81 8.060 8.060 8.651 -0.591 19638 511 1 3 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.641 -0.079 19638 512 1 3 . 1 1 82 82 PHE H H 82 8.446 8.446 8.256 0.190 19638 513 1 3 . 1 1 83 83 GLY H H 83 7.142 7.142 7.743 -0.601 19638 514 1 3 . 1 1 84 84 GLY H H 84 8.211 8.211 8.091 0.120 19638 515 1 3 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.547 -0.292 19638 516 1 3 . 1 1 85 85 LEU H H 85 8.160 8.160 7.923 0.237 19638 517 1 3 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.305 -0.350 19638 518 1 3 . 1 1 86 86 LYS H H 86 8.440 8.440 8.670 -0.230 19638 519 1 3 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.446 -0.076 19638 520 1 3 . 1 1 87 87 LYS H H 87 8.800 8.800 7.923 0.877 19638 521 1 3 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.060 -0.634 19638 522 1 3 . 1 1 88 88 GLU H H 88 8.971 8.971 9.107 -0.136 19638 523 1 3 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.014 -0.197 19638 524 1 3 . 1 1 89 89 LYS H H 89 8.679 8.679 8.275 0.404 19638 525 1 3 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.453 -0.412 19638 526 1 3 . 1 1 90 90 ASP H H 90 6.295 6.295 8.458 -2.163 19638 527 1 3 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.018 -0.737 19638 528 1 3 . 1 1 91 91 ARG H H 91 7.285 7.285 7.655 -0.370 19638 529 1 3 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.583 -0.778 19638 530 1 3 . 1 1 92 92 ASN H H 92 8.541 8.541 8.086 0.455 19638 531 1 3 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.416 -0.423 19638 532 1 3 . 1 1 93 93 ASP H H 93 8.518 8.518 7.708 0.810 19638 533 1 3 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.204 -0.426 19638 534 1 3 . 1 1 94 94 LEU H H 94 8.167 8.167 7.794 0.373 19638 535 1 3 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.824 -0.855 19638 536 1 3 . 1 1 95 95 ILE H H 95 8.718 8.718 7.682 1.036 19638 537 1 3 . 1 1 96 96 THR HA H 96 3.661 3.661 4.025 -0.364 19638 538 1 3 . 1 1 96 96 THR H H 96 7.955 7.955 8.154 -0.199 19638 539 1 3 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.099 -0.107 19638 540 1 3 . 1 1 97 97 TYR H H 97 7.619 7.619 7.989 -0.370 19638 541 1 3 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.711 -0.480 19638 542 1 3 . 1 1 98 98 LEU H H 98 8.933 8.933 7.713 1.220 19638 543 1 3 . 1 1 99 99 LYS HA H 99 3.492 3.492 2.908 0.584 19638 544 1 3 . 1 1 99 99 LYS H H 99 8.454 8.454 8.293 0.161 19638 545 1 3 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.871 0.223 19638 546 1 3 . 1 1 100 100 LYS H H 100 6.501 6.501 7.693 -1.192 19638 547 1 3 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.963 -0.008 19638 548 1 3 . 1 1 101 101 ALA H H 101 8.296 8.296 7.353 0.943 19638 549 1 3 . 1 1 102 102 THR H H 102 7.330 7.330 7.572 -0.242 19638 550 1 4 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.629 -0.370 19638 551 1 4 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.554 0.054 19638 552 1 4 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.369 -0.576 19638 553 1 4 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.905 -1.328 19638 554 1 4 . 1 1 2 2 SER H H 2 9.424 9.424 8.729 0.695 19638 555 1 4 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.396 -0.416 19638 556 1 4 . 1 1 3 3 ALA H H 3 9.092 9.092 9.086 0.006 19638 557 1 4 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.969 0.304 19638 558 1 4 . 1 1 4 4 LYS H H 4 8.086 8.086 7.851 0.235 19638 559 1 4 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.123 -0.073 19638 560 1 4 . 1 1 5 5 LYS H H 5 7.755 7.755 7.616 0.139 19638 561 1 4 . 1 1 6 6 GLY H H 6 8.694 8.694 7.770 0.924 19638 562 1 4 . 1 1 7 7 ALA HA H 7 2.346 2.346 2.923 -0.577 19638 563 1 4 . 1 1 7 7 ALA H H 7 7.999 7.999 8.530 -0.531 19638 564 1 4 . 1 1 8 8 THR HA H 8 3.898 3.898 4.011 -0.113 19638 565 1 4 . 1 1 8 8 THR H H 8 7.203 7.203 7.535 -0.332 19638 566 1 4 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.158 -0.314 19638 567 1 4 . 1 1 9 9 LEU H H 9 7.846 7.846 7.684 0.162 19638 568 1 4 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.074 -0.571 19638 569 1 4 . 1 1 10 10 PHE H H 10 8.651 8.651 8.581 0.070 19638 570 1 4 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.980 0.243 19638 571 1 4 . 1 1 11 11 LYS H H 11 8.365 8.365 7.895 0.470 19638 572 1 4 . 1 1 12 12 THR HA H 12 4.361 4.361 4.178 0.183 19638 573 1 4 . 1 1 12 12 THR H H 12 7.959 7.959 8.375 -0.416 19638 574 1 4 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.614 -0.028 19638 575 1 4 . 1 1 13 13 ARG H H 13 8.338 8.338 7.808 0.530 19638 576 1 4 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.349 -3.435 19638 577 1 4 . 1 1 14 14 CYS H H 14 8.047 8.047 8.176 -0.129 19638 578 1 4 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.356 1.762 19638 579 1 4 . 1 1 15 15 LEU H H 15 8.070 8.070 7.809 0.261 19638 580 1 4 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.995 0.663 19638 581 1 4 . 1 1 16 16 GLN H H 16 10.022 10.022 8.420 1.602 19638 582 1 4 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.489 1.699 19638 583 1 4 . 1 1 17 17 CYS H H 17 9.730 9.730 7.419 2.311 19638 584 1 4 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.896 3.948 19638 585 1 4 . 1 1 18 18 HIS H H 18 11.098 11.098 8.696 2.402 19638 586 1 4 . 1 1 19 19 THR HA H 19 6.298 6.298 4.294 2.004 19638 587 1 4 . 1 1 19 19 THR H H 19 10.180 10.180 8.851 1.329 19638 588 1 4 . 1 1 20 20 VAL HA H 20 5.004 5.004 4.019 0.985 19638 589 1 4 . 1 1 20 20 VAL H H 20 8.927 8.927 8.145 0.782 19638 590 1 4 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.450 0.169 19638 591 1 4 . 1 1 21 21 GLU H H 21 9.460 9.460 7.324 2.136 19638 592 1 4 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.949 -0.323 19638 593 1 4 . 1 1 22 22 LYS H H 22 9.064 9.064 8.445 0.619 19638 594 1 4 . 1 1 23 23 GLY H H 23 9.543 9.543 8.039 1.504 19638 595 1 4 . 1 1 24 24 GLY H H 24 8.296 8.296 7.907 0.389 19638 596 1 4 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.384 0.113 19638 597 1 4 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.742 0.533 19638 598 1 4 . 1 1 26 26 HIS H H 26 8.931 8.931 8.386 0.545 19638 599 1 4 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.457 0.213 19638 600 1 4 . 1 1 27 27 LYS H H 27 8.362 8.362 8.032 0.330 19638 601 1 4 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.767 -0.631 19638 602 1 4 . 1 1 28 28 VAL H H 28 7.720 7.720 8.075 -0.354 19638 603 1 4 . 1 1 29 29 GLY H H 29 7.705 7.705 7.273 0.432 19638 604 1 4 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.405 -0.287 19638 605 1 4 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.747 1.170 19638 606 1 4 . 1 1 31 31 ASN H H 31 11.993 11.993 8.315 3.678 19638 607 1 4 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.511 -0.051 19638 608 1 4 . 1 1 32 32 LEU H H 32 9.445 9.445 8.228 1.217 19638 609 1 4 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.649 -0.543 19638 610 1 4 . 1 1 33 33 HIS H H 33 8.051 8.051 8.717 -0.666 19638 611 1 4 . 1 1 34 34 GLY H H 34 9.066 9.066 8.569 0.497 19638 612 1 4 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.776 -0.215 19638 613 1 4 . 1 1 35 35 ILE H H 35 7.068 7.068 8.022 -0.954 19638 614 1 4 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.365 -0.453 19638 615 1 4 . 1 1 36 36 PHE H H 36 7.901 7.901 7.705 0.196 19638 616 1 4 . 1 1 37 37 GLY H H 37 8.766 8.766 9.183 -0.417 19638 617 1 4 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.694 -0.079 19638 618 1 4 . 1 1 38 38 ARG H H 38 7.962 7.962 7.553 0.409 19638 619 1 4 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.970 0.092 19638 620 1 4 . 1 1 39 39 HIS H H 39 8.064 8.064 8.730 -0.666 19638 621 1 4 . 1 1 40 40 SER HA H 40 4.601 4.601 4.215 0.386 19638 622 1 4 . 1 1 40 40 SER H H 40 8.588 8.588 8.401 0.187 19638 623 1 4 . 1 1 41 41 GLY H H 41 8.930 8.930 8.117 0.813 19638 624 1 4 . 1 1 42 42 GLN H H 42 7.865 7.865 7.659 0.206 19638 625 1 4 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.217 0.119 19638 626 1 4 . 1 1 43 43 ALA H H 43 8.062 8.062 8.535 -0.473 19638 627 1 4 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.085 0.090 19638 628 1 4 . 1 1 44 44 GLU H H 44 8.924 8.924 9.044 -0.120 19638 629 1 4 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.346 -0.501 19638 630 1 4 . 1 1 46 46 TYR H H 46 7.033 7.033 7.363 -0.330 19638 631 1 4 . 1 1 47 47 SER HA H 47 4.283 4.283 4.181 0.102 19638 632 1 4 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.776 -0.534 19638 633 1 4 . 1 1 48 48 TYR H H 48 7.905 7.905 8.313 -0.408 19638 634 1 4 . 1 1 49 49 THR HA H 49 4.124 4.124 4.423 -0.298 19638 635 1 4 . 1 1 49 49 THR H H 49 9.712 9.712 8.474 1.238 19638 636 1 4 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.293 -0.032 19638 637 1 4 . 1 1 50 50 ASP H H 50 8.682 8.682 9.025 -0.343 19638 638 1 4 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.938 0.244 19638 639 1 4 . 1 1 51 51 ALA H H 51 7.802 7.802 8.287 -0.485 19638 640 1 4 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.576 0.111 19638 641 1 4 . 1 1 52 52 ASN H H 52 8.422 8.422 7.863 0.559 19638 642 1 4 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.660 0.020 19638 643 1 4 . 1 1 53 53 ILE H H 53 7.686 7.686 7.898 -0.212 19638 644 1 4 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.072 -0.143 19638 645 1 4 . 1 1 54 54 LYS H H 54 9.101 9.101 8.209 0.892 19638 646 1 4 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.355 -0.319 19638 647 1 4 . 1 1 55 55 LYS H H 55 7.355 7.355 7.769 -0.414 19638 648 1 4 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.705 -0.380 19638 649 1 4 . 1 1 56 56 ASN H H 56 7.506 7.506 8.520 -1.014 19638 650 1 4 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.204 -0.013 19638 651 1 4 . 1 1 57 57 VAL H H 57 7.341 7.341 8.363 -1.022 19638 652 1 4 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.211 -0.413 19638 653 1 4 . 1 1 58 58 LEU H H 58 8.220 8.220 8.193 0.027 19638 654 1 4 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.624 0.491 19638 655 1 4 . 1 1 59 59 TRP H H 59 7.973 7.973 8.684 -0.711 19638 656 1 4 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.921 -0.184 19638 657 1 4 . 1 1 60 60 ASP H H 60 10.093 10.093 8.294 1.799 19638 658 1 4 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.177 -0.839 19638 659 1 4 . 1 1 61 61 GLU H H 61 10.090 10.090 8.807 1.283 19638 660 1 4 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.577 -0.121 19638 661 1 4 . 1 1 62 62 ASN H H 62 8.211 8.211 8.492 -0.281 19638 662 1 4 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.434 0.116 19638 663 1 4 . 1 1 63 63 ASN H H 63 9.331 9.331 8.379 0.952 19638 664 1 4 . 1 1 64 64 MET HA H 64 4.321 4.321 4.315 0.006 19638 665 1 4 . 1 1 64 64 MET H H 64 8.702 8.702 8.955 -0.253 19638 666 1 4 . 1 1 65 65 SER HA H 65 3.445 3.445 4.230 -0.785 19638 667 1 4 . 1 1 65 65 SER H H 65 7.442 7.442 7.878 -0.436 19638 668 1 4 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.026 -0.169 19638 669 1 4 . 1 1 66 66 GLU H H 66 7.574 7.574 7.537 0.037 19638 670 1 4 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.589 0.690 19638 671 1 4 . 1 1 67 67 HIS H H 67 8.297 8.297 7.684 0.613 19638 672 1 4 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.014 -0.658 19638 673 1 4 . 1 1 68 68 LEU H H 68 8.060 8.060 7.688 0.372 19638 674 1 4 . 1 1 69 69 THR HA H 69 3.792 3.792 4.088 -0.296 19638 675 1 4 . 1 1 69 69 THR H H 69 7.327 7.327 7.927 -0.600 19638 676 1 4 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.203 -0.176 19638 677 1 4 . 1 1 70 70 ASN H H 70 6.715 6.715 7.699 -0.984 19638 678 1 4 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.255 1.706 19638 679 1 4 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.154 0.971 19638 680 1 4 . 1 1 72 72 ALA H H 72 9.052 9.052 8.204 0.848 19638 681 1 4 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.067 0.502 19638 682 1 4 . 1 1 73 73 LYS H H 73 7.914 7.914 7.968 -0.054 19638 683 1 4 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.248 0.779 19638 684 1 4 . 1 1 74 74 TYR H H 74 8.520 8.520 7.690 0.830 19638 685 1 4 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.486 0.175 19638 686 1 4 . 1 1 75 75 ILE H H 75 9.542 9.542 7.628 1.914 19638 687 1 4 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.779 0.348 19638 688 1 4 . 1 1 77 77 GLY H H 77 9.573 9.573 8.636 0.937 19638 689 1 4 . 1 1 78 78 THR HA H 78 5.058 5.058 4.687 0.371 19638 690 1 4 . 1 1 78 78 THR H H 78 9.274 9.274 7.896 1.378 19638 691 1 4 . 1 1 79 79 LYS H H 79 8.060 8.060 8.486 -0.426 19638 692 1 4 . 1 1 80 80 MET H H 80 8.670 8.670 7.915 0.755 19638 693 1 4 . 1 1 81 81 ALA H H 81 8.060 8.060 8.571 -0.511 19638 694 1 4 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.654 -0.092 19638 695 1 4 . 1 1 82 82 PHE H H 82 8.446 8.446 7.816 0.630 19638 696 1 4 . 1 1 83 83 GLY H H 83 7.142 7.142 7.962 -0.820 19638 697 1 4 . 1 1 84 84 GLY H H 84 8.211 8.211 8.060 0.151 19638 698 1 4 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.496 -0.241 19638 699 1 4 . 1 1 85 85 LEU H H 85 8.160 8.160 7.940 0.220 19638 700 1 4 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.043 -0.088 19638 701 1 4 . 1 1 86 86 LYS H H 86 8.440 8.440 8.631 -0.191 19638 702 1 4 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.400 -0.030 19638 703 1 4 . 1 1 87 87 LYS H H 87 8.800 8.800 7.961 0.839 19638 704 1 4 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.029 -0.603 19638 705 1 4 . 1 1 88 88 GLU H H 88 8.971 8.971 9.059 -0.088 19638 706 1 4 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.010 -0.193 19638 707 1 4 . 1 1 89 89 LYS H H 89 8.679 8.679 8.307 0.372 19638 708 1 4 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.456 -0.415 19638 709 1 4 . 1 1 90 90 ASP H H 90 6.295 6.295 8.403 -2.108 19638 710 1 4 . 1 1 91 91 ARG HA H 91 3.281 3.281 3.999 -0.718 19638 711 1 4 . 1 1 91 91 ARG H H 91 7.285 7.285 7.560 -0.275 19638 712 1 4 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.386 -0.581 19638 713 1 4 . 1 1 92 92 ASN H H 92 8.541 8.541 8.395 0.146 19638 714 1 4 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.493 -0.500 19638 715 1 4 . 1 1 93 93 ASP H H 93 8.518 8.518 7.587 0.931 19638 716 1 4 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.149 -0.371 19638 717 1 4 . 1 1 94 94 LEU H H 94 8.167 8.167 7.645 0.522 19638 718 1 4 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.793 -0.824 19638 719 1 4 . 1 1 95 95 ILE H H 95 8.718 8.718 7.685 1.033 19638 720 1 4 . 1 1 96 96 THR HA H 96 3.661 3.661 3.843 -0.182 19638 721 1 4 . 1 1 96 96 THR H H 96 7.955 7.955 8.073 -0.118 19638 722 1 4 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.260 -0.268 19638 723 1 4 . 1 1 97 97 TYR H H 97 7.619 7.619 8.092 -0.473 19638 724 1 4 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.864 -0.633 19638 725 1 4 . 1 1 98 98 LEU H H 98 8.933 8.933 7.656 1.277 19638 726 1 4 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.193 0.299 19638 727 1 4 . 1 1 99 99 LYS H H 99 8.454 8.454 8.367 0.087 19638 728 1 4 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.947 0.147 19638 729 1 4 . 1 1 100 100 LYS H H 100 6.501 6.501 7.810 -1.309 19638 730 1 4 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.302 -0.347 19638 731 1 4 . 1 1 101 101 ALA H H 101 8.296 8.296 7.291 1.005 19638 732 1 4 . 1 1 102 102 THR H H 102 7.330 7.330 8.240 -0.910 19638 733 1 5 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.633 -0.374 19638 734 1 5 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.918 0.690 19638 735 1 5 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.437 -0.644 19638 736 1 5 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.765 -1.188 19638 737 1 5 . 1 1 2 2 SER H H 2 9.424 9.424 8.903 0.521 19638 738 1 5 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.379 -0.399 19638 739 1 5 . 1 1 3 3 ALA H H 3 9.092 9.092 7.310 1.782 19638 740 1 5 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.267 0.006 19638 741 1 5 . 1 1 4 4 LYS H H 4 8.086 8.086 8.576 -0.490 19638 742 1 5 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.006 0.044 19638 743 1 5 . 1 1 5 5 LYS H H 5 7.755 7.755 8.165 -0.410 19638 744 1 5 . 1 1 6 6 GLY H H 6 8.694 8.694 8.088 0.606 19638 745 1 5 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.220 -0.874 19638 746 1 5 . 1 1 7 7 ALA H H 7 7.999 7.999 7.752 0.247 19638 747 1 5 . 1 1 8 8 THR HA H 8 3.898 3.898 3.962 -0.064 19638 748 1 5 . 1 1 8 8 THR H H 8 7.203 7.203 7.424 -0.221 19638 749 1 5 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.065 -0.221 19638 750 1 5 . 1 1 9 9 LEU H H 9 7.846 7.846 7.427 0.419 19638 751 1 5 . 1 1 10 10 PHE HA H 10 3.503 3.503 3.988 -0.485 19638 752 1 5 . 1 1 10 10 PHE H H 10 8.651 8.651 8.117 0.534 19638 753 1 5 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.923 0.300 19638 754 1 5 . 1 1 11 11 LYS H H 11 8.365 8.365 8.278 0.087 19638 755 1 5 . 1 1 12 12 THR HA H 12 4.361 4.361 4.089 0.272 19638 756 1 5 . 1 1 12 12 THR H H 12 7.959 7.959 8.181 -0.222 19638 757 1 5 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.330 0.256 19638 758 1 5 . 1 1 13 13 ARG H H 13 8.338 8.338 7.832 0.506 19638 759 1 5 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.188 -3.274 19638 760 1 5 . 1 1 14 14 CYS H H 14 8.047 8.047 8.208 -0.161 19638 761 1 5 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.247 1.871 19638 762 1 5 . 1 1 15 15 LEU H H 15 8.070 8.070 7.695 0.375 19638 763 1 5 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.938 0.720 19638 764 1 5 . 1 1 16 16 GLN H H 16 10.022 10.022 8.288 1.734 19638 765 1 5 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.412 1.776 19638 766 1 5 . 1 1 17 17 CYS H H 17 9.730 9.730 7.344 2.386 19638 767 1 5 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.857 3.987 19638 768 1 5 . 1 1 18 18 HIS H H 18 11.098 11.098 8.667 2.431 19638 769 1 5 . 1 1 19 19 THR HA H 19 6.298 6.298 4.341 1.957 19638 770 1 5 . 1 1 19 19 THR H H 19 10.180 10.180 8.710 1.470 19638 771 1 5 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.820 1.184 19638 772 1 5 . 1 1 20 20 VAL H H 20 8.927 8.927 7.862 1.065 19638 773 1 5 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.500 0.119 19638 774 1 5 . 1 1 21 21 GLU H H 21 9.460 9.460 7.721 1.739 19638 775 1 5 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.603 0.023 19638 776 1 5 . 1 1 22 22 LYS H H 22 9.064 9.064 8.664 0.400 19638 777 1 5 . 1 1 23 23 GLY H H 23 9.543 9.543 7.955 1.588 19638 778 1 5 . 1 1 24 24 GLY H H 24 8.296 8.296 7.424 0.872 19638 779 1 5 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.182 0.315 19638 780 1 5 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.269 1.006 19638 781 1 5 . 1 1 26 26 HIS H H 26 8.931 8.931 8.151 0.780 19638 782 1 5 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.057 0.613 19638 783 1 5 . 1 1 27 27 LYS H H 27 8.362 8.362 8.363 -0.001 19638 784 1 5 . 1 1 28 28 VAL HA H 28 3.136 3.136 4.211 -1.075 19638 785 1 5 . 1 1 28 28 VAL H H 28 7.720 7.720 7.474 0.246 19638 786 1 5 . 1 1 29 29 GLY H H 29 7.705 7.705 7.666 0.039 19638 787 1 5 . 1 1 30 30 PRO HA H 30 4.118 4.118 3.929 0.189 19638 788 1 5 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.370 1.547 19638 789 1 5 . 1 1 31 31 ASN H H 31 11.993 11.993 7.971 4.022 19638 790 1 5 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.504 -0.044 19638 791 1 5 . 1 1 32 32 LEU H H 32 9.445 9.445 8.482 0.963 19638 792 1 5 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.714 -0.608 19638 793 1 5 . 1 1 33 33 HIS H H 33 8.051 8.051 8.623 -0.572 19638 794 1 5 . 1 1 34 34 GLY H H 34 9.066 9.066 8.558 0.508 19638 795 1 5 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.884 -0.323 19638 796 1 5 . 1 1 35 35 ILE H H 35 7.068 7.068 8.095 -1.027 19638 797 1 5 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.348 -0.436 19638 798 1 5 . 1 1 36 36 PHE H H 36 7.901 7.901 7.762 0.139 19638 799 1 5 . 1 1 37 37 GLY H H 37 8.766 8.766 9.226 -0.460 19638 800 1 5 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.531 0.084 19638 801 1 5 . 1 1 38 38 ARG H H 38 7.962 7.962 7.584 0.378 19638 802 1 5 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.024 0.038 19638 803 1 5 . 1 1 39 39 HIS H H 39 8.064 8.064 8.740 -0.676 19638 804 1 5 . 1 1 40 40 SER HA H 40 4.601 4.601 4.430 0.171 19638 805 1 5 . 1 1 40 40 SER H H 40 8.588 8.588 8.358 0.230 19638 806 1 5 . 1 1 41 41 GLY H H 41 8.930 8.930 8.470 0.460 19638 807 1 5 . 1 1 42 42 GLN H H 42 7.865 7.865 8.151 -0.286 19638 808 1 5 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.391 -0.055 19638 809 1 5 . 1 1 43 43 ALA H H 43 8.062 8.062 7.649 0.413 19638 810 1 5 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.536 -0.361 19638 811 1 5 . 1 1 44 44 GLU H H 44 8.924 8.924 8.483 0.441 19638 812 1 5 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.543 -0.698 19638 813 1 5 . 1 1 46 46 TYR H H 46 7.033 7.033 7.642 -0.609 19638 814 1 5 . 1 1 47 47 SER HA H 47 4.283 4.283 4.318 -0.035 19638 815 1 5 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.709 -0.467 19638 816 1 5 . 1 1 48 48 TYR H H 48 7.905 7.905 8.430 -0.525 19638 817 1 5 . 1 1 49 49 THR HA H 49 4.124 4.124 4.386 -0.262 19638 818 1 5 . 1 1 49 49 THR H H 49 9.712 9.712 8.570 1.142 19638 819 1 5 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.292 -0.031 19638 820 1 5 . 1 1 50 50 ASP H H 50 8.682 8.682 8.981 -0.299 19638 821 1 5 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.858 0.324 19638 822 1 5 . 1 1 51 51 ALA H H 51 7.802 7.802 8.518 -0.716 19638 823 1 5 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.592 0.095 19638 824 1 5 . 1 1 52 52 ASN H H 52 8.422 8.422 8.350 0.072 19638 825 1 5 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.666 0.014 19638 826 1 5 . 1 1 53 53 ILE H H 53 7.686 7.686 7.691 -0.005 19638 827 1 5 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.063 -0.134 19638 828 1 5 . 1 1 54 54 LYS H H 54 9.101 9.101 8.263 0.838 19638 829 1 5 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.375 -0.339 19638 830 1 5 . 1 1 55 55 LYS H H 55 7.355 7.355 7.697 -0.342 19638 831 1 5 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.685 -0.360 19638 832 1 5 . 1 1 56 56 ASN H H 56 7.506 7.506 8.489 -0.983 19638 833 1 5 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.230 -0.039 19638 834 1 5 . 1 1 57 57 VAL H H 57 7.341 7.341 8.346 -1.005 19638 835 1 5 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.172 -0.374 19638 836 1 5 . 1 1 58 58 LEU H H 58 8.220 8.220 8.228 -0.008 19638 837 1 5 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.577 0.538 19638 838 1 5 . 1 1 59 59 TRP H H 59 7.973 7.973 9.060 -1.087 19638 839 1 5 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.892 -0.155 19638 840 1 5 . 1 1 60 60 ASP H H 60 10.093 10.093 8.288 1.805 19638 841 1 5 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.151 -0.813 19638 842 1 5 . 1 1 61 61 GLU H H 61 10.090 10.090 8.753 1.337 19638 843 1 5 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.602 -0.146 19638 844 1 5 . 1 1 62 62 ASN H H 62 8.211 8.211 8.553 -0.342 19638 845 1 5 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.451 0.099 19638 846 1 5 . 1 1 63 63 ASN H H 63 9.331 9.331 8.362 0.969 19638 847 1 5 . 1 1 64 64 MET HA H 64 4.321 4.321 4.329 -0.008 19638 848 1 5 . 1 1 64 64 MET H H 64 8.702 8.702 8.249 0.453 19638 849 1 5 . 1 1 65 65 SER HA H 65 3.445 3.445 4.185 -0.740 19638 850 1 5 . 1 1 65 65 SER H H 65 7.442 7.442 7.824 -0.382 19638 851 1 5 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.046 -0.189 19638 852 1 5 . 1 1 66 66 GLU H H 66 7.574 7.574 7.562 0.012 19638 853 1 5 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.759 0.520 19638 854 1 5 . 1 1 67 67 HIS H H 67 8.297 8.297 7.709 0.588 19638 855 1 5 . 1 1 68 68 LEU HA H 68 3.356 3.356 3.931 -0.575 19638 856 1 5 . 1 1 68 68 LEU H H 68 8.060 8.060 7.756 0.304 19638 857 1 5 . 1 1 69 69 THR HA H 69 3.792 3.792 3.999 -0.207 19638 858 1 5 . 1 1 69 69 THR H H 69 7.327 7.327 7.528 -0.201 19638 859 1 5 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.046 -0.019 19638 860 1 5 . 1 1 70 70 ASN H H 70 6.715 6.715 7.599 -0.884 19638 861 1 5 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.253 1.708 19638 862 1 5 . 1 1 72 72 ALA HA H 72 5.125 5.125 3.982 1.143 19638 863 1 5 . 1 1 72 72 ALA H H 72 9.052 9.052 8.126 0.926 19638 864 1 5 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.039 0.530 19638 865 1 5 . 1 1 73 73 LYS H H 73 7.914 7.914 7.978 -0.064 19638 866 1 5 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.347 0.680 19638 867 1 5 . 1 1 74 74 TYR H H 74 8.520 8.520 7.568 0.952 19638 868 1 5 . 1 1 75 75 ILE HA H 75 4.661 4.661 3.784 0.877 19638 869 1 5 . 1 1 75 75 ILE H H 75 9.542 9.542 8.310 1.232 19638 870 1 5 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.709 0.418 19638 871 1 5 . 1 1 77 77 GLY H H 77 9.573 9.573 8.651 0.922 19638 872 1 5 . 1 1 78 78 THR HA H 78 5.058 5.058 4.648 0.410 19638 873 1 5 . 1 1 78 78 THR H H 78 9.274 9.274 7.803 1.471 19638 874 1 5 . 1 1 79 79 LYS H H 79 8.060 8.060 8.853 -0.793 19638 875 1 5 . 1 1 80 80 MET H H 80 8.670 8.670 7.556 1.114 19638 876 1 5 . 1 1 81 81 ALA H H 81 8.060 8.060 8.447 -0.387 19638 877 1 5 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.516 0.046 19638 878 1 5 . 1 1 82 82 PHE H H 82 8.446 8.446 8.145 0.301 19638 879 1 5 . 1 1 83 83 GLY H H 83 7.142 7.142 8.101 -0.959 19638 880 1 5 . 1 1 84 84 GLY H H 84 8.211 8.211 7.485 0.726 19638 881 1 5 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.368 -0.113 19638 882 1 5 . 1 1 85 85 LEU H H 85 8.160 8.160 7.403 0.757 19638 883 1 5 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.252 -0.297 19638 884 1 5 . 1 1 86 86 LYS H H 86 8.440 8.440 8.503 -0.063 19638 885 1 5 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.407 -0.037 19638 886 1 5 . 1 1 87 87 LYS H H 87 8.800 8.800 7.869 0.931 19638 887 1 5 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.023 -0.597 19638 888 1 5 . 1 1 88 88 GLU H H 88 8.971 8.971 8.899 0.072 19638 889 1 5 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.120 -0.303 19638 890 1 5 . 1 1 89 89 LYS H H 89 8.679 8.679 8.367 0.312 19638 891 1 5 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.423 -0.382 19638 892 1 5 . 1 1 90 90 ASP H H 90 6.295 6.295 8.444 -2.149 19638 893 1 5 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.001 -0.720 19638 894 1 5 . 1 1 91 91 ARG H H 91 7.285 7.285 7.674 -0.389 19638 895 1 5 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.313 -0.508 19638 896 1 5 . 1 1 92 92 ASN H H 92 8.541 8.541 8.493 0.048 19638 897 1 5 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.433 -0.440 19638 898 1 5 . 1 1 93 93 ASP H H 93 8.518 8.518 7.677 0.841 19638 899 1 5 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.172 -0.394 19638 900 1 5 . 1 1 94 94 LEU H H 94 8.167 8.167 7.475 0.692 19638 901 1 5 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.880 -0.911 19638 902 1 5 . 1 1 95 95 ILE H H 95 8.718 8.718 7.751 0.967 19638 903 1 5 . 1 1 96 96 THR HA H 96 3.661 3.661 4.013 -0.352 19638 904 1 5 . 1 1 96 96 THR H H 96 7.955 7.955 7.976 -0.021 19638 905 1 5 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.087 -0.095 19638 906 1 5 . 1 1 97 97 TYR H H 97 7.619 7.619 8.459 -0.840 19638 907 1 5 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.651 -0.420 19638 908 1 5 . 1 1 98 98 LEU H H 98 8.933 8.933 7.784 1.149 19638 909 1 5 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.553 -0.061 19638 910 1 5 . 1 1 99 99 LYS H H 99 8.454 8.454 7.410 1.044 19638 911 1 5 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.891 0.203 19638 912 1 5 . 1 1 100 100 LYS H H 100 6.501 6.501 7.249 -0.748 19638 913 1 5 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.974 -0.019 19638 914 1 5 . 1 1 101 101 ALA H H 101 8.296 8.296 7.414 0.882 19638 915 1 5 . 1 1 102 102 THR H H 102 7.330 7.330 7.593 -0.263 19638 916 1 6 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.650 -0.391 19638 917 1 6 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.577 0.031 19638 918 1 6 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.277 -0.484 19638 919 1 6 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.938 -1.361 19638 920 1 6 . 1 1 2 2 SER H H 2 9.424 9.424 8.774 0.650 19638 921 1 6 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.258 -0.278 19638 922 1 6 . 1 1 3 3 ALA H H 3 9.092 9.092 7.785 1.307 19638 923 1 6 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.988 0.285 19638 924 1 6 . 1 1 4 4 LYS H H 4 8.086 8.086 8.104 -0.018 19638 925 1 6 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.094 -0.044 19638 926 1 6 . 1 1 5 5 LYS H H 5 7.755 7.755 8.167 -0.412 19638 927 1 6 . 1 1 6 6 GLY H H 6 8.694 8.694 8.230 0.464 19638 928 1 6 . 1 1 7 7 ALA HA H 7 2.346 2.346 2.954 -0.608 19638 929 1 6 . 1 1 7 7 ALA H H 7 7.999 7.999 8.335 -0.336 19638 930 1 6 . 1 1 8 8 THR HA H 8 3.898 3.898 4.032 -0.134 19638 931 1 6 . 1 1 8 8 THR H H 8 7.203 7.203 7.498 -0.295 19638 932 1 6 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.175 -0.331 19638 933 1 6 . 1 1 9 9 LEU H H 9 7.846 7.846 8.460 -0.614 19638 934 1 6 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.049 -0.546 19638 935 1 6 . 1 1 10 10 PHE H H 10 8.651 8.651 8.871 -0.220 19638 936 1 6 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.932 0.291 19638 937 1 6 . 1 1 11 11 LYS H H 11 8.365 8.365 8.168 0.197 19638 938 1 6 . 1 1 12 12 THR HA H 12 4.361 4.361 4.150 0.211 19638 939 1 6 . 1 1 12 12 THR H H 12 7.959 7.959 8.337 -0.378 19638 940 1 6 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.628 -0.042 19638 941 1 6 . 1 1 13 13 ARG H H 13 8.338 8.338 7.769 0.569 19638 942 1 6 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.337 -3.423 19638 943 1 6 . 1 1 14 14 CYS H H 14 8.047 8.047 8.117 -0.070 19638 944 1 6 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.345 1.773 19638 945 1 6 . 1 1 15 15 LEU H H 15 8.070 8.070 7.677 0.393 19638 946 1 6 . 1 1 16 16 GLN HA H 16 4.658 4.658 4.020 0.638 19638 947 1 6 . 1 1 16 16 GLN H H 16 10.022 10.022 8.460 1.562 19638 948 1 6 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.509 1.679 19638 949 1 6 . 1 1 17 17 CYS H H 17 9.730 9.730 7.421 2.309 19638 950 1 6 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.970 3.874 19638 951 1 6 . 1 1 18 18 HIS H H 18 11.098 11.098 8.551 2.547 19638 952 1 6 . 1 1 19 19 THR HA H 19 6.298 6.298 4.296 2.002 19638 953 1 6 . 1 1 19 19 THR H H 19 10.180 10.180 8.908 1.272 19638 954 1 6 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.819 1.185 19638 955 1 6 . 1 1 20 20 VAL H H 20 8.927 8.927 7.957 0.970 19638 956 1 6 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.495 0.124 19638 957 1 6 . 1 1 21 21 GLU H H 21 9.460 9.460 7.484 1.976 19638 958 1 6 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.603 0.023 19638 959 1 6 . 1 1 22 22 LYS H H 22 9.064 9.064 8.565 0.499 19638 960 1 6 . 1 1 23 23 GLY H H 23 9.543 9.543 8.595 0.948 19638 961 1 6 . 1 1 24 24 GLY H H 24 8.296 8.296 7.517 0.779 19638 962 1 6 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.169 0.328 19638 963 1 6 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.191 1.084 19638 964 1 6 . 1 1 26 26 HIS H H 26 8.931 8.931 8.289 0.642 19638 965 1 6 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.018 0.652 19638 966 1 6 . 1 1 27 27 LYS H H 27 8.362 8.362 8.533 -0.171 19638 967 1 6 . 1 1 28 28 VAL HA H 28 3.136 3.136 4.123 -0.987 19638 968 1 6 . 1 1 28 28 VAL H H 28 7.720 7.720 7.382 0.338 19638 969 1 6 . 1 1 29 29 GLY H H 29 7.705 7.705 7.658 0.047 19638 970 1 6 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.233 -0.115 19638 971 1 6 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.964 0.953 19638 972 1 6 . 1 1 31 31 ASN H H 31 11.993 11.993 8.348 3.645 19638 973 1 6 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.460 -0.000 19638 974 1 6 . 1 1 32 32 LEU H H 32 9.445 9.445 8.420 1.025 19638 975 1 6 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.708 -0.602 19638 976 1 6 . 1 1 33 33 HIS H H 33 8.051 8.051 8.632 -0.581 19638 977 1 6 . 1 1 34 34 GLY H H 34 9.066 9.066 8.524 0.542 19638 978 1 6 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.809 -0.248 19638 979 1 6 . 1 1 35 35 ILE H H 35 7.068 7.068 7.929 -0.861 19638 980 1 6 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.319 -0.407 19638 981 1 6 . 1 1 36 36 PHE H H 36 7.901 7.901 7.748 0.153 19638 982 1 6 . 1 1 37 37 GLY H H 37 8.766 8.766 9.237 -0.471 19638 983 1 6 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.754 -0.139 19638 984 1 6 . 1 1 38 38 ARG H H 38 7.962 7.962 7.609 0.353 19638 985 1 6 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.249 -0.187 19638 986 1 6 . 1 1 39 39 HIS H H 39 8.064 8.064 8.740 -0.676 19638 987 1 6 . 1 1 40 40 SER HA H 40 4.601 4.601 4.299 0.302 19638 988 1 6 . 1 1 40 40 SER H H 40 8.588 8.588 8.371 0.217 19638 989 1 6 . 1 1 41 41 GLY H H 41 8.930 8.930 8.078 0.852 19638 990 1 6 . 1 1 42 42 GLN H H 42 7.865 7.865 7.638 0.227 19638 991 1 6 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.147 0.189 19638 992 1 6 . 1 1 43 43 ALA H H 43 8.062 8.062 8.372 -0.310 19638 993 1 6 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.061 0.114 19638 994 1 6 . 1 1 44 44 GLU H H 44 8.924 8.924 8.930 -0.006 19638 995 1 6 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.389 -0.544 19638 996 1 6 . 1 1 46 46 TYR H H 46 7.033 7.033 7.514 -0.481 19638 997 1 6 . 1 1 47 47 SER HA H 47 4.283 4.283 4.248 0.035 19638 998 1 6 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.712 -0.470 19638 999 1 6 . 1 1 48 48 TYR H H 48 7.905 7.905 8.413 -0.508 19638 1000 1 6 . 1 1 49 49 THR HA H 49 4.124 4.124 4.370 -0.246 19638 1001 1 6 . 1 1 49 49 THR H H 49 9.712 9.712 8.383 1.329 19638 1002 1 6 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.293 -0.032 19638 1003 1 6 . 1 1 50 50 ASP H H 50 8.682 8.682 9.016 -0.334 19638 1004 1 6 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.927 0.255 19638 1005 1 6 . 1 1 51 51 ALA H H 51 7.802 7.802 8.271 -0.469 19638 1006 1 6 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.591 0.096 19638 1007 1 6 . 1 1 52 52 ASN H H 52 8.422 8.422 7.763 0.659 19638 1008 1 6 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.695 -0.015 19638 1009 1 6 . 1 1 53 53 ILE H H 53 7.686 7.686 8.007 -0.321 19638 1010 1 6 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.083 -0.154 19638 1011 1 6 . 1 1 54 54 LYS H H 54 9.101 9.101 8.164 0.937 19638 1012 1 6 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.346 -0.310 19638 1013 1 6 . 1 1 55 55 LYS H H 55 7.355 7.355 7.902 -0.547 19638 1014 1 6 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.688 -0.363 19638 1015 1 6 . 1 1 56 56 ASN H H 56 7.506 7.506 8.518 -1.012 19638 1016 1 6 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.217 -0.026 19638 1017 1 6 . 1 1 57 57 VAL H H 57 7.341 7.341 8.351 -1.010 19638 1018 1 6 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.107 -0.309 19638 1019 1 6 . 1 1 58 58 LEU H H 58 8.220 8.220 8.239 -0.019 19638 1020 1 6 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.593 0.522 19638 1021 1 6 . 1 1 59 59 TRP H H 59 7.973 7.973 8.982 -1.009 19638 1022 1 6 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.893 -0.156 19638 1023 1 6 . 1 1 60 60 ASP H H 60 10.093 10.093 8.280 1.813 19638 1024 1 6 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.163 -0.825 19638 1025 1 6 . 1 1 61 61 GLU H H 61 10.090 10.090 8.839 1.251 19638 1026 1 6 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.570 -0.114 19638 1027 1 6 . 1 1 62 62 ASN H H 62 8.211 8.211 8.540 -0.329 19638 1028 1 6 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.502 0.048 19638 1029 1 6 . 1 1 63 63 ASN H H 63 9.331 9.331 8.316 1.015 19638 1030 1 6 . 1 1 64 64 MET HA H 64 4.321 4.321 4.250 0.071 19638 1031 1 6 . 1 1 64 64 MET H H 64 8.702 8.702 8.837 -0.135 19638 1032 1 6 . 1 1 65 65 SER HA H 65 3.445 3.445 4.227 -0.782 19638 1033 1 6 . 1 1 65 65 SER H H 65 7.442 7.442 7.773 -0.331 19638 1034 1 6 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.046 -0.189 19638 1035 1 6 . 1 1 66 66 GLU H H 66 7.574 7.574 7.510 0.064 19638 1036 1 6 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.412 0.867 19638 1037 1 6 . 1 1 67 67 HIS H H 67 8.297 8.297 7.606 0.691 19638 1038 1 6 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.055 -0.699 19638 1039 1 6 . 1 1 68 68 LEU H H 68 8.060 8.060 7.690 0.370 19638 1040 1 6 . 1 1 69 69 THR HA H 69 3.792 3.792 4.279 -0.487 19638 1041 1 6 . 1 1 69 69 THR H H 69 7.327 7.327 7.673 -0.346 19638 1042 1 6 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.088 -0.061 19638 1043 1 6 . 1 1 70 70 ASN H H 70 6.715 6.715 7.525 -0.810 19638 1044 1 6 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.145 1.816 19638 1045 1 6 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.152 0.973 19638 1046 1 6 . 1 1 72 72 ALA H H 72 9.052 9.052 7.969 1.083 19638 1047 1 6 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.126 0.443 19638 1048 1 6 . 1 1 73 73 LYS H H 73 7.914 7.914 7.965 -0.051 19638 1049 1 6 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.232 0.795 19638 1050 1 6 . 1 1 74 74 TYR H H 74 8.520 8.520 8.075 0.445 19638 1051 1 6 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.517 0.144 19638 1052 1 6 . 1 1 75 75 ILE H H 75 9.542 9.542 7.695 1.847 19638 1053 1 6 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.737 0.390 19638 1054 1 6 . 1 1 77 77 GLY H H 77 9.573 9.573 8.668 0.905 19638 1055 1 6 . 1 1 78 78 THR HA H 78 5.058 5.058 4.710 0.348 19638 1056 1 6 . 1 1 78 78 THR H H 78 9.274 9.274 7.824 1.450 19638 1057 1 6 . 1 1 79 79 LYS H H 79 8.060 8.060 8.445 -0.385 19638 1058 1 6 . 1 1 80 80 MET H H 80 8.670 8.670 7.925 0.745 19638 1059 1 6 . 1 1 81 81 ALA H H 81 8.060 8.060 8.591 -0.531 19638 1060 1 6 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.548 0.014 19638 1061 1 6 . 1 1 82 82 PHE H H 82 8.446 8.446 7.746 0.700 19638 1062 1 6 . 1 1 83 83 GLY H H 83 7.142 7.142 7.726 -0.584 19638 1063 1 6 . 1 1 84 84 GLY H H 84 8.211 8.211 8.168 0.043 19638 1064 1 6 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.571 -0.316 19638 1065 1 6 . 1 1 85 85 LEU H H 85 8.160 8.160 8.090 0.070 19638 1066 1 6 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.242 -0.287 19638 1067 1 6 . 1 1 86 86 LYS H H 86 8.440 8.440 8.660 -0.220 19638 1068 1 6 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.461 -0.091 19638 1069 1 6 . 1 1 87 87 LYS H H 87 8.800 8.800 7.913 0.887 19638 1070 1 6 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.406 -0.980 19638 1071 1 6 . 1 1 88 88 GLU H H 88 8.971 8.971 8.432 0.539 19638 1072 1 6 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.983 -0.166 19638 1073 1 6 . 1 1 89 89 LYS H H 89 8.679 8.679 8.713 -0.034 19638 1074 1 6 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.424 -0.383 19638 1075 1 6 . 1 1 90 90 ASP H H 90 6.295 6.295 8.716 -2.421 19638 1076 1 6 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.039 -0.758 19638 1077 1 6 . 1 1 91 91 ARG H H 91 7.285 7.285 8.014 -0.729 19638 1078 1 6 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.591 -0.786 19638 1079 1 6 . 1 1 92 92 ASN H H 92 8.541 8.541 7.799 0.742 19638 1080 1 6 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.515 -0.522 19638 1081 1 6 . 1 1 93 93 ASP H H 93 8.518 8.518 8.353 0.165 19638 1082 1 6 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.116 -0.338 19638 1083 1 6 . 1 1 94 94 LEU H H 94 8.167 8.167 8.692 -0.525 19638 1084 1 6 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.793 -0.824 19638 1085 1 6 . 1 1 95 95 ILE H H 95 8.718 8.718 7.864 0.854 19638 1086 1 6 . 1 1 96 96 THR HA H 96 3.661 3.661 3.968 -0.307 19638 1087 1 6 . 1 1 96 96 THR H H 96 7.955 7.955 8.068 -0.113 19638 1088 1 6 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.029 -0.037 19638 1089 1 6 . 1 1 97 97 TYR H H 97 7.619 7.619 8.464 -0.845 19638 1090 1 6 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.727 -0.496 19638 1091 1 6 . 1 1 98 98 LEU H H 98 8.933 8.933 7.824 1.109 19638 1092 1 6 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.176 0.316 19638 1093 1 6 . 1 1 99 99 LYS H H 99 8.454 8.454 8.232 0.222 19638 1094 1 6 . 1 1 100 100 LYS HA H 100 4.094 4.094 4.073 0.021 19638 1095 1 6 . 1 1 100 100 LYS H H 100 6.501 6.501 7.805 -1.304 19638 1096 1 6 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.085 -0.130 19638 1097 1 6 . 1 1 101 101 ALA H H 101 8.296 8.296 7.408 0.888 19638 1098 1 6 . 1 1 102 102 THR H H 102 7.330 7.330 7.796 -0.466 19638 1099 1 7 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.587 -0.328 19638 1100 1 7 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.494 0.114 19638 1101 1 7 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.325 -0.532 19638 1102 1 7 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.934 -1.357 19638 1103 1 7 . 1 1 2 2 SER H H 2 9.424 9.424 8.495 0.929 19638 1104 1 7 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.576 -0.596 19638 1105 1 7 . 1 1 3 3 ALA H H 3 9.092 9.092 8.572 0.520 19638 1106 1 7 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.049 0.224 19638 1107 1 7 . 1 1 4 4 LYS H H 4 8.086 8.086 8.361 -0.275 19638 1108 1 7 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.113 -0.063 19638 1109 1 7 . 1 1 5 5 LYS H H 5 7.755 7.755 7.943 -0.188 19638 1110 1 7 . 1 1 6 6 GLY H H 6 8.694 8.694 7.705 0.989 19638 1111 1 7 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.520 -1.174 19638 1112 1 7 . 1 1 7 7 ALA H H 7 7.999 7.999 8.589 -0.590 19638 1113 1 7 . 1 1 8 8 THR HA H 8 3.898 3.898 4.014 -0.116 19638 1114 1 7 . 1 1 8 8 THR H H 8 7.203 7.203 7.590 -0.387 19638 1115 1 7 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.138 -0.294 19638 1116 1 7 . 1 1 9 9 LEU H H 9 7.846 7.846 7.610 0.236 19638 1117 1 7 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.072 -0.569 19638 1118 1 7 . 1 1 10 10 PHE H H 10 8.651 8.651 8.689 -0.038 19638 1119 1 7 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.949 0.274 19638 1120 1 7 . 1 1 11 11 LYS H H 11 8.365 8.365 7.949 0.416 19638 1121 1 7 . 1 1 12 12 THR HA H 12 4.361 4.361 4.187 0.174 19638 1122 1 7 . 1 1 12 12 THR H H 12 7.959 7.959 8.193 -0.234 19638 1123 1 7 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.574 0.012 19638 1124 1 7 . 1 1 13 13 ARG H H 13 8.338 8.338 7.994 0.344 19638 1125 1 7 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.380 -3.466 19638 1126 1 7 . 1 1 14 14 CYS H H 14 8.047 8.047 8.185 -0.138 19638 1127 1 7 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.354 1.764 19638 1128 1 7 . 1 1 15 15 LEU H H 15 8.070 8.070 7.687 0.383 19638 1129 1 7 . 1 1 16 16 GLN HA H 16 4.658 4.658 4.042 0.616 19638 1130 1 7 . 1 1 16 16 GLN H H 16 10.022 10.022 8.466 1.556 19638 1131 1 7 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.517 1.671 19638 1132 1 7 . 1 1 17 17 CYS H H 17 9.730 9.730 7.449 2.281 19638 1133 1 7 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.919 3.925 19638 1134 1 7 . 1 1 18 18 HIS H H 18 11.098 11.098 8.726 2.372 19638 1135 1 7 . 1 1 19 19 THR HA H 19 6.298 6.298 4.346 1.952 19638 1136 1 7 . 1 1 19 19 THR H H 19 10.180 10.180 8.704 1.476 19638 1137 1 7 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.937 1.067 19638 1138 1 7 . 1 1 20 20 VAL H H 20 8.927 8.927 8.223 0.704 19638 1139 1 7 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.650 -0.031 19638 1140 1 7 . 1 1 21 21 GLU H H 21 9.460 9.460 8.238 1.222 19638 1141 1 7 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.846 -0.221 19638 1142 1 7 . 1 1 22 22 LYS H H 22 9.064 9.064 8.684 0.380 19638 1143 1 7 . 1 1 23 23 GLY H H 23 9.543 9.543 8.052 1.491 19638 1144 1 7 . 1 1 24 24 GLY H H 24 8.296 8.296 7.491 0.805 19638 1145 1 7 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.416 0.081 19638 1146 1 7 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.839 0.436 19638 1147 1 7 . 1 1 26 26 HIS H H 26 8.931 8.931 8.364 0.567 19638 1148 1 7 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.476 0.194 19638 1149 1 7 . 1 1 27 27 LYS H H 27 8.362 8.362 8.156 0.206 19638 1150 1 7 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.546 -0.410 19638 1151 1 7 . 1 1 28 28 VAL H H 28 7.720 7.720 8.779 -1.059 19638 1152 1 7 . 1 1 29 29 GLY H H 29 7.705 7.705 7.848 -0.143 19638 1153 1 7 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.366 -0.248 19638 1154 1 7 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.858 1.059 19638 1155 1 7 . 1 1 31 31 ASN H H 31 11.993 11.993 8.373 3.620 19638 1156 1 7 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.515 -0.055 19638 1157 1 7 . 1 1 32 32 LEU H H 32 9.445 9.445 8.432 1.013 19638 1158 1 7 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.638 -0.532 19638 1159 1 7 . 1 1 33 33 HIS H H 33 8.051 8.051 8.638 -0.587 19638 1160 1 7 . 1 1 34 34 GLY H H 34 9.066 9.066 8.787 0.279 19638 1161 1 7 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.868 -0.307 19638 1162 1 7 . 1 1 35 35 ILE H H 35 7.068 7.068 7.759 -0.691 19638 1163 1 7 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.532 -0.620 19638 1164 1 7 . 1 1 36 36 PHE H H 36 7.901 7.901 7.781 0.120 19638 1165 1 7 . 1 1 37 37 GLY H H 37 8.766 8.766 9.210 -0.444 19638 1166 1 7 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.591 0.024 19638 1167 1 7 . 1 1 38 38 ARG H H 38 7.962 7.962 7.561 0.401 19638 1168 1 7 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.955 0.107 19638 1169 1 7 . 1 1 39 39 HIS H H 39 8.064 8.064 8.815 -0.751 19638 1170 1 7 . 1 1 40 40 SER HA H 40 4.601 4.601 4.374 0.227 19638 1171 1 7 . 1 1 40 40 SER H H 40 8.588 8.588 8.381 0.207 19638 1172 1 7 . 1 1 41 41 GLY H H 41 8.930 8.930 8.344 0.586 19638 1173 1 7 . 1 1 42 42 GLN H H 42 7.865 7.865 7.757 0.108 19638 1174 1 7 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.232 0.104 19638 1175 1 7 . 1 1 43 43 ALA H H 43 8.062 8.062 8.540 -0.478 19638 1176 1 7 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.143 0.032 19638 1177 1 7 . 1 1 44 44 GLU H H 44 8.924 8.924 8.957 -0.033 19638 1178 1 7 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.388 -0.543 19638 1179 1 7 . 1 1 46 46 TYR H H 46 7.033 7.033 7.598 -0.565 19638 1180 1 7 . 1 1 47 47 SER HA H 47 4.283 4.283 4.177 0.106 19638 1181 1 7 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.738 -0.496 19638 1182 1 7 . 1 1 48 48 TYR H H 48 7.905 7.905 8.413 -0.508 19638 1183 1 7 . 1 1 49 49 THR HA H 49 4.124 4.124 4.397 -0.273 19638 1184 1 7 . 1 1 49 49 THR H H 49 9.712 9.712 8.515 1.197 19638 1185 1 7 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.285 -0.024 19638 1186 1 7 . 1 1 50 50 ASP H H 50 8.682 8.682 8.976 -0.294 19638 1187 1 7 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.890 0.292 19638 1188 1 7 . 1 1 51 51 ALA H H 51 7.802 7.802 8.269 -0.467 19638 1189 1 7 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.597 0.090 19638 1190 1 7 . 1 1 52 52 ASN H H 52 8.422 8.422 7.854 0.568 19638 1191 1 7 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.669 0.011 19638 1192 1 7 . 1 1 53 53 ILE H H 53 7.686 7.686 8.001 -0.315 19638 1193 1 7 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.084 -0.155 19638 1194 1 7 . 1 1 54 54 LYS H H 54 9.101 9.101 8.152 0.950 19638 1195 1 7 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.340 -0.304 19638 1196 1 7 . 1 1 55 55 LYS H H 55 7.355 7.355 8.155 -0.800 19638 1197 1 7 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.755 -0.430 19638 1198 1 7 . 1 1 56 56 ASN H H 56 7.506 7.506 8.564 -1.058 19638 1199 1 7 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.169 0.022 19638 1200 1 7 . 1 1 57 57 VAL H H 57 7.341 7.341 8.146 -0.805 19638 1201 1 7 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.221 -0.423 19638 1202 1 7 . 1 1 58 58 LEU H H 58 8.220 8.220 8.345 -0.125 19638 1203 1 7 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.556 0.559 19638 1204 1 7 . 1 1 59 59 TRP H H 59 7.973 7.973 9.086 -1.113 19638 1205 1 7 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.966 -0.229 19638 1206 1 7 . 1 1 60 60 ASP H H 60 10.093 10.093 8.097 1.996 19638 1207 1 7 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.311 -0.973 19638 1208 1 7 . 1 1 61 61 GLU H H 61 10.090 10.090 9.027 1.063 19638 1209 1 7 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.491 -0.035 19638 1210 1 7 . 1 1 62 62 ASN H H 62 8.211 8.211 8.417 -0.206 19638 1211 1 7 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.470 0.080 19638 1212 1 7 . 1 1 63 63 ASN H H 63 9.331 9.331 9.365 -0.034 19638 1213 1 7 . 1 1 64 64 MET HA H 64 4.321 4.321 4.203 0.118 19638 1214 1 7 . 1 1 64 64 MET H H 64 8.702 8.702 8.579 0.123 19638 1215 1 7 . 1 1 65 65 SER HA H 65 3.445 3.445 4.108 -0.663 19638 1216 1 7 . 1 1 65 65 SER H H 65 7.442 7.442 7.857 -0.415 19638 1217 1 7 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.022 -0.165 19638 1218 1 7 . 1 1 66 66 GLU H H 66 7.574 7.574 7.390 0.184 19638 1219 1 7 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.670 0.609 19638 1220 1 7 . 1 1 67 67 HIS H H 67 8.297 8.297 8.170 0.127 19638 1221 1 7 . 1 1 68 68 LEU HA H 68 3.356 3.356 3.993 -0.637 19638 1222 1 7 . 1 1 68 68 LEU H H 68 8.060 8.060 7.668 0.392 19638 1223 1 7 . 1 1 69 69 THR HA H 69 3.792 3.792 4.353 -0.561 19638 1224 1 7 . 1 1 69 69 THR H H 69 7.327 7.327 7.250 0.077 19638 1225 1 7 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.487 0.540 19638 1226 1 7 . 1 1 70 70 ASN H H 70 6.715 6.715 8.943 -2.228 19638 1227 1 7 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.225 1.736 19638 1228 1 7 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.122 1.003 19638 1229 1 7 . 1 1 72 72 ALA H H 72 9.052 9.052 8.477 0.575 19638 1230 1 7 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.117 0.452 19638 1231 1 7 . 1 1 73 73 LYS H H 73 7.914 7.914 8.111 -0.197 19638 1232 1 7 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.258 0.769 19638 1233 1 7 . 1 1 74 74 TYR H H 74 8.520 8.520 7.523 0.997 19638 1234 1 7 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.589 0.072 19638 1235 1 7 . 1 1 75 75 ILE H H 75 9.542 9.542 8.199 1.343 19638 1236 1 7 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.714 0.413 19638 1237 1 7 . 1 1 77 77 GLY H H 77 9.573 9.573 8.684 0.889 19638 1238 1 7 . 1 1 78 78 THR HA H 78 5.058 5.058 4.774 0.284 19638 1239 1 7 . 1 1 78 78 THR H H 78 9.274 9.274 7.661 1.613 19638 1240 1 7 . 1 1 79 79 LYS H H 79 8.060 8.060 8.611 -0.551 19638 1241 1 7 . 1 1 80 80 MET H H 80 8.670 8.670 7.514 1.156 19638 1242 1 7 . 1 1 81 81 ALA H H 81 8.060 8.060 8.583 -0.523 19638 1243 1 7 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.635 -0.073 19638 1244 1 7 . 1 1 82 82 PHE H H 82 8.446 8.446 8.329 0.117 19638 1245 1 7 . 1 1 83 83 GLY H H 83 7.142 7.142 7.739 -0.597 19638 1246 1 7 . 1 1 84 84 GLY H H 84 8.211 8.211 8.075 0.136 19638 1247 1 7 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.597 -0.342 19638 1248 1 7 . 1 1 85 85 LEU H H 85 8.160 8.160 8.338 -0.178 19638 1249 1 7 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.065 -0.110 19638 1250 1 7 . 1 1 86 86 LYS H H 86 8.440 8.440 8.706 -0.266 19638 1251 1 7 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.420 -0.050 19638 1252 1 7 . 1 1 87 87 LYS H H 87 8.800 8.800 8.021 0.779 19638 1253 1 7 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.030 -0.604 19638 1254 1 7 . 1 1 88 88 GLU H H 88 8.971 8.971 9.056 -0.085 19638 1255 1 7 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.230 -0.413 19638 1256 1 7 . 1 1 89 89 LYS H H 89 8.679 8.679 8.304 0.375 19638 1257 1 7 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.436 -0.395 19638 1258 1 7 . 1 1 90 90 ASP H H 90 6.295 6.295 8.614 -2.319 19638 1259 1 7 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.058 -0.777 19638 1260 1 7 . 1 1 91 91 ARG H H 91 7.285 7.285 7.544 -0.259 19638 1261 1 7 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.350 -0.545 19638 1262 1 7 . 1 1 92 92 ASN H H 92 8.541 8.541 7.782 0.759 19638 1263 1 7 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.543 -0.550 19638 1264 1 7 . 1 1 93 93 ASP H H 93 8.518 8.518 7.678 0.840 19638 1265 1 7 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.160 -0.382 19638 1266 1 7 . 1 1 94 94 LEU H H 94 8.167 8.167 7.599 0.568 19638 1267 1 7 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.810 -0.841 19638 1268 1 7 . 1 1 95 95 ILE H H 95 8.718 8.718 8.208 0.510 19638 1269 1 7 . 1 1 96 96 THR HA H 96 3.661 3.661 3.934 -0.273 19638 1270 1 7 . 1 1 96 96 THR H H 96 7.955 7.955 8.166 -0.211 19638 1271 1 7 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.117 -0.125 19638 1272 1 7 . 1 1 97 97 TYR H H 97 7.619 7.619 7.739 -0.120 19638 1273 1 7 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.714 -0.483 19638 1274 1 7 . 1 1 98 98 LEU H H 98 8.933 8.933 7.718 1.215 19638 1275 1 7 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.104 0.388 19638 1276 1 7 . 1 1 99 99 LYS H H 99 8.454 8.454 8.520 -0.066 19638 1277 1 7 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.822 0.272 19638 1278 1 7 . 1 1 100 100 LYS H H 100 6.501 6.501 7.680 -1.179 19638 1279 1 7 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.964 -0.009 19638 1280 1 7 . 1 1 101 101 ALA H H 101 8.296 8.296 7.363 0.933 19638 1281 1 7 . 1 1 102 102 THR H H 102 7.330 7.330 7.304 0.026 19638 1282 1 8 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.636 -0.377 19638 1283 1 8 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.769 0.839 19638 1284 1 8 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.255 -0.462 19638 1285 1 8 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.871 -1.294 19638 1286 1 8 . 1 1 2 2 SER H H 2 9.424 9.424 8.693 0.731 19638 1287 1 8 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.383 -0.404 19638 1288 1 8 . 1 1 3 3 ALA H H 3 9.092 9.092 7.296 1.796 19638 1289 1 8 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.308 -0.035 19638 1290 1 8 . 1 1 4 4 LYS H H 4 8.086 8.086 8.538 -0.452 19638 1291 1 8 . 1 1 5 5 LYS HA H 5 4.050 4.050 3.985 0.065 19638 1292 1 8 . 1 1 5 5 LYS H H 5 7.755 7.755 7.930 -0.175 19638 1293 1 8 . 1 1 6 6 GLY H H 6 8.694 8.694 9.233 -0.539 19638 1294 1 8 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.329 -0.983 19638 1295 1 8 . 1 1 7 7 ALA H H 7 7.999 7.999 7.773 0.226 19638 1296 1 8 . 1 1 8 8 THR HA H 8 3.898 3.898 3.988 -0.090 19638 1297 1 8 . 1 1 8 8 THR H H 8 7.203 7.203 7.469 -0.266 19638 1298 1 8 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.162 -0.318 19638 1299 1 8 . 1 1 9 9 LEU H H 9 7.846 7.846 7.490 0.356 19638 1300 1 8 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.107 -0.604 19638 1301 1 8 . 1 1 10 10 PHE H H 10 8.651 8.651 8.363 0.288 19638 1302 1 8 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.948 0.275 19638 1303 1 8 . 1 1 11 11 LYS H H 11 8.365 8.365 8.411 -0.046 19638 1304 1 8 . 1 1 12 12 THR HA H 12 4.361 4.361 4.141 0.220 19638 1305 1 8 . 1 1 12 12 THR H H 12 7.959 7.959 8.362 -0.403 19638 1306 1 8 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.600 -0.014 19638 1307 1 8 . 1 1 13 13 ARG H H 13 8.338 8.338 7.709 0.629 19638 1308 1 8 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.330 -3.416 19638 1309 1 8 . 1 1 14 14 CYS H H 14 8.047 8.047 8.367 -0.320 19638 1310 1 8 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.295 1.823 19638 1311 1 8 . 1 1 15 15 LEU H H 15 8.070 8.070 7.558 0.512 19638 1312 1 8 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.989 0.669 19638 1313 1 8 . 1 1 16 16 GLN H H 16 10.022 10.022 8.373 1.649 19638 1314 1 8 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.464 1.724 19638 1315 1 8 . 1 1 17 17 CYS H H 17 9.730 9.730 7.507 2.223 19638 1316 1 8 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.916 3.928 19638 1317 1 8 . 1 1 18 18 HIS H H 18 11.098 11.098 8.588 2.510 19638 1318 1 8 . 1 1 19 19 THR HA H 19 6.298 6.298 4.376 1.922 19638 1319 1 8 . 1 1 19 19 THR H H 19 10.180 10.180 8.726 1.454 19638 1320 1 8 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.830 1.174 19638 1321 1 8 . 1 1 20 20 VAL H H 20 8.927 8.927 8.162 0.765 19638 1322 1 8 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.173 0.446 19638 1323 1 8 . 1 1 21 21 GLU H H 21 9.460 9.460 7.388 2.072 19638 1324 1 8 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.085 -0.459 19638 1325 1 8 . 1 1 22 22 LYS H H 22 9.064 9.064 8.415 0.649 19638 1326 1 8 . 1 1 23 23 GLY H H 23 9.543 9.543 7.762 1.781 19638 1327 1 8 . 1 1 24 24 GLY H H 24 8.296 8.296 7.363 0.933 19638 1328 1 8 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.313 0.184 19638 1329 1 8 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.134 1.141 19638 1330 1 8 . 1 1 26 26 HIS H H 26 8.931 8.931 7.935 0.996 19638 1331 1 8 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.066 0.604 19638 1332 1 8 . 1 1 27 27 LYS H H 27 8.362 8.362 8.027 0.335 19638 1333 1 8 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.903 -0.767 19638 1334 1 8 . 1 1 28 28 VAL H H 28 7.720 7.720 8.263 -0.543 19638 1335 1 8 . 1 1 29 29 GLY H H 29 7.705 7.705 7.278 0.427 19638 1336 1 8 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.235 -0.117 19638 1337 1 8 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.684 1.233 19638 1338 1 8 . 1 1 31 31 ASN H H 31 11.993 11.993 8.021 3.972 19638 1339 1 8 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.300 0.160 19638 1340 1 8 . 1 1 32 32 LEU H H 32 9.445 9.445 8.249 1.196 19638 1341 1 8 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.334 -0.228 19638 1342 1 8 . 1 1 33 33 HIS H H 33 8.051 8.051 8.367 -0.316 19638 1343 1 8 . 1 1 34 34 GLY H H 34 9.066 9.066 8.522 0.544 19638 1344 1 8 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.812 -0.251 19638 1345 1 8 . 1 1 35 35 ILE H H 35 7.068 7.068 7.944 -0.876 19638 1346 1 8 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.386 -0.474 19638 1347 1 8 . 1 1 36 36 PHE H H 36 7.901 7.901 7.680 0.221 19638 1348 1 8 . 1 1 37 37 GLY H H 37 8.766 8.766 9.210 -0.444 19638 1349 1 8 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.551 0.064 19638 1350 1 8 . 1 1 38 38 ARG H H 38 7.962 7.962 7.557 0.405 19638 1351 1 8 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.841 0.221 19638 1352 1 8 . 1 1 39 39 HIS H H 39 8.064 8.064 8.782 -0.718 19638 1353 1 8 . 1 1 40 40 SER HA H 40 4.601 4.601 4.459 0.142 19638 1354 1 8 . 1 1 40 40 SER H H 40 8.588 8.588 8.369 0.219 19638 1355 1 8 . 1 1 41 41 GLY H H 41 8.930 8.930 8.529 0.401 19638 1356 1 8 . 1 1 42 42 GLN H H 42 7.865 7.865 7.819 0.046 19638 1357 1 8 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.324 0.012 19638 1358 1 8 . 1 1 43 43 ALA H H 43 8.062 8.062 7.591 0.471 19638 1359 1 8 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.525 -0.350 19638 1360 1 8 . 1 1 44 44 GLU H H 44 8.924 8.924 8.567 0.357 19638 1361 1 8 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.704 -0.859 19638 1362 1 8 . 1 1 46 46 TYR H H 46 7.033 7.033 7.499 -0.466 19638 1363 1 8 . 1 1 47 47 SER HA H 47 4.283 4.283 4.733 -0.450 19638 1364 1 8 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.783 -0.541 19638 1365 1 8 . 1 1 48 48 TYR H H 48 7.905 7.905 8.542 -0.637 19638 1366 1 8 . 1 1 49 49 THR HA H 49 4.124 4.124 4.388 -0.265 19638 1367 1 8 . 1 1 49 49 THR H H 49 9.712 9.712 8.465 1.247 19638 1368 1 8 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.336 -0.075 19638 1369 1 8 . 1 1 50 50 ASP H H 50 8.682 8.682 8.992 -0.310 19638 1370 1 8 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.908 0.274 19638 1371 1 8 . 1 1 51 51 ALA H H 51 7.802 7.802 8.384 -0.582 19638 1372 1 8 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.556 0.131 19638 1373 1 8 . 1 1 52 52 ASN H H 52 8.422 8.422 7.662 0.760 19638 1374 1 8 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.906 -0.226 19638 1375 1 8 . 1 1 53 53 ILE H H 53 7.686 7.686 7.889 -0.203 19638 1376 1 8 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.053 -0.124 19638 1377 1 8 . 1 1 54 54 LYS H H 54 9.101 9.101 8.415 0.686 19638 1378 1 8 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.292 -0.256 19638 1379 1 8 . 1 1 55 55 LYS H H 55 7.355 7.355 7.979 -0.624 19638 1380 1 8 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.451 -0.126 19638 1381 1 8 . 1 1 56 56 ASN H H 56 7.506 7.506 8.596 -1.090 19638 1382 1 8 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.301 -0.110 19638 1383 1 8 . 1 1 57 57 VAL H H 57 7.341 7.341 8.124 -0.783 19638 1384 1 8 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.216 -0.418 19638 1385 1 8 . 1 1 58 58 LEU H H 58 8.220 8.220 8.278 -0.058 19638 1386 1 8 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.606 0.509 19638 1387 1 8 . 1 1 59 59 TRP H H 59 7.973 7.973 8.948 -0.975 19638 1388 1 8 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.910 -0.173 19638 1389 1 8 . 1 1 60 60 ASP H H 60 10.093 10.093 8.308 1.785 19638 1390 1 8 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.031 -0.693 19638 1391 1 8 . 1 1 61 61 GLU H H 61 10.090 10.090 8.755 1.335 19638 1392 1 8 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.583 -0.127 19638 1393 1 8 . 1 1 62 62 ASN H H 62 8.211 8.211 8.333 -0.122 19638 1394 1 8 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.503 0.047 19638 1395 1 8 . 1 1 63 63 ASN H H 63 9.331 9.331 9.234 0.097 19638 1396 1 8 . 1 1 64 64 MET HA H 64 4.321 4.321 4.238 0.083 19638 1397 1 8 . 1 1 64 64 MET H H 64 8.702 8.702 8.477 0.225 19638 1398 1 8 . 1 1 65 65 SER HA H 65 3.445 3.445 4.183 -0.738 19638 1399 1 8 . 1 1 65 65 SER H H 65 7.442 7.442 7.865 -0.423 19638 1400 1 8 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.076 -0.219 19638 1401 1 8 . 1 1 66 66 GLU H H 66 7.574 7.574 7.555 0.019 19638 1402 1 8 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.625 0.654 19638 1403 1 8 . 1 1 67 67 HIS H H 67 8.297 8.297 7.777 0.520 19638 1404 1 8 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.005 -0.648 19638 1405 1 8 . 1 1 68 68 LEU H H 68 8.060 8.060 7.964 0.096 19638 1406 1 8 . 1 1 69 69 THR HA H 69 3.792 3.792 4.357 -0.565 19638 1407 1 8 . 1 1 69 69 THR H H 69 7.327 7.327 7.288 0.039 19638 1408 1 8 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.473 0.554 19638 1409 1 8 . 1 1 70 70 ASN H H 70 6.715 6.715 8.974 -2.259 19638 1410 1 8 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.262 1.699 19638 1411 1 8 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.125 1.000 19638 1412 1 8 . 1 1 72 72 ALA H H 72 9.052 9.052 8.310 0.742 19638 1413 1 8 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.078 0.491 19638 1414 1 8 . 1 1 73 73 LYS H H 73 7.914 7.914 8.125 -0.211 19638 1415 1 8 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.322 0.705 19638 1416 1 8 . 1 1 74 74 TYR H H 74 8.520 8.520 7.479 1.041 19638 1417 1 8 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.568 0.093 19638 1418 1 8 . 1 1 75 75 ILE H H 75 9.542 9.542 8.025 1.517 19638 1419 1 8 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.782 0.345 19638 1420 1 8 . 1 1 77 77 GLY H H 77 9.573 9.573 8.649 0.924 19638 1421 1 8 . 1 1 78 78 THR HA H 78 5.058 5.058 4.687 0.371 19638 1422 1 8 . 1 1 78 78 THR H H 78 9.274 9.274 7.551 1.723 19638 1423 1 8 . 1 1 79 79 LYS H H 79 8.060 8.060 8.638 -0.578 19638 1424 1 8 . 1 1 80 80 MET H H 80 8.670 8.670 7.573 1.097 19638 1425 1 8 . 1 1 81 81 ALA H H 81 8.060 8.060 8.405 -0.345 19638 1426 1 8 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.506 0.056 19638 1427 1 8 . 1 1 82 82 PHE H H 82 8.446 8.446 7.865 0.581 19638 1428 1 8 . 1 1 83 83 GLY H H 83 7.142 7.142 7.862 -0.720 19638 1429 1 8 . 1 1 84 84 GLY H H 84 8.211 8.211 8.132 0.079 19638 1430 1 8 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.573 -0.318 19638 1431 1 8 . 1 1 85 85 LEU H H 85 8.160 8.160 8.366 -0.206 19638 1432 1 8 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.048 -0.093 19638 1433 1 8 . 1 1 86 86 LYS H H 86 8.440 8.440 8.584 -0.144 19638 1434 1 8 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.379 -0.009 19638 1435 1 8 . 1 1 87 87 LYS H H 87 8.800 8.800 8.088 0.712 19638 1436 1 8 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.059 -0.633 19638 1437 1 8 . 1 1 88 88 GLU H H 88 8.971 8.971 9.059 -0.088 19638 1438 1 8 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.960 -0.143 19638 1439 1 8 . 1 1 89 89 LYS H H 89 8.679 8.679 8.423 0.256 19638 1440 1 8 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.427 -0.386 19638 1441 1 8 . 1 1 90 90 ASP H H 90 6.295 6.295 8.615 -2.320 19638 1442 1 8 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.067 -0.786 19638 1443 1 8 . 1 1 91 91 ARG H H 91 7.285 7.285 7.534 -0.249 19638 1444 1 8 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.463 -0.658 19638 1445 1 8 . 1 1 92 92 ASN H H 92 8.541 8.541 8.413 0.128 19638 1446 1 8 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.499 -0.506 19638 1447 1 8 . 1 1 93 93 ASP H H 93 8.518 8.518 8.123 0.395 19638 1448 1 8 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.287 -0.509 19638 1449 1 8 . 1 1 94 94 LEU H H 94 8.167 8.167 8.289 -0.122 19638 1450 1 8 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.876 -0.907 19638 1451 1 8 . 1 1 95 95 ILE H H 95 8.718 8.718 7.767 0.951 19638 1452 1 8 . 1 1 96 96 THR HA H 96 3.661 3.661 3.987 -0.326 19638 1453 1 8 . 1 1 96 96 THR H H 96 7.955 7.955 8.103 -0.148 19638 1454 1 8 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.107 -0.115 19638 1455 1 8 . 1 1 97 97 TYR H H 97 7.619 7.619 8.511 -0.892 19638 1456 1 8 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.693 -0.462 19638 1457 1 8 . 1 1 98 98 LEU H H 98 8.933 8.933 7.753 1.180 19638 1458 1 8 . 1 1 99 99 LYS HA H 99 3.492 3.492 2.885 0.607 19638 1459 1 8 . 1 1 99 99 LYS H H 99 8.454 8.454 8.306 0.148 19638 1460 1 8 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.828 0.266 19638 1461 1 8 . 1 1 100 100 LYS H H 100 6.501 6.501 7.592 -1.091 19638 1462 1 8 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.998 -0.043 19638 1463 1 8 . 1 1 101 101 ALA H H 101 8.296 8.296 7.220 1.076 19638 1464 1 8 . 1 1 102 102 THR H H 102 7.330 7.330 7.489 -0.159 19638 1465 1 9 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.603 -0.344 19638 1466 1 9 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.949 0.659 19638 1467 1 9 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.485 -0.692 19638 1468 1 9 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.584 -1.007 19638 1469 1 9 . 1 1 2 2 SER H H 2 9.424 9.424 8.837 0.587 19638 1470 1 9 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.190 -0.210 19638 1471 1 9 . 1 1 3 3 ALA H H 3 9.092 9.092 7.854 1.238 19638 1472 1 9 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.934 0.339 19638 1473 1 9 . 1 1 4 4 LYS H H 4 8.086 8.086 8.327 -0.241 19638 1474 1 9 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.149 -0.099 19638 1475 1 9 . 1 1 5 5 LYS H H 5 7.755 7.755 7.440 0.315 19638 1476 1 9 . 1 1 6 6 GLY H H 6 8.694 8.694 8.498 0.196 19638 1477 1 9 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.318 -0.972 19638 1478 1 9 . 1 1 7 7 ALA H H 7 7.999 7.999 8.379 -0.380 19638 1479 1 9 . 1 1 8 8 THR HA H 8 3.898 3.898 4.011 -0.113 19638 1480 1 9 . 1 1 8 8 THR H H 8 7.203 7.203 7.510 -0.307 19638 1481 1 9 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.084 -0.240 19638 1482 1 9 . 1 1 9 9 LEU H H 9 7.846 7.846 8.482 -0.636 19638 1483 1 9 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.075 -0.572 19638 1484 1 9 . 1 1 10 10 PHE H H 10 8.651 8.651 8.611 0.040 19638 1485 1 9 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.933 0.290 19638 1486 1 9 . 1 1 11 11 LYS H H 11 8.365 8.365 7.926 0.439 19638 1487 1 9 . 1 1 12 12 THR HA H 12 4.361 4.361 4.157 0.204 19638 1488 1 9 . 1 1 12 12 THR H H 12 7.959 7.959 8.145 -0.186 19638 1489 1 9 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.603 -0.017 19638 1490 1 9 . 1 1 13 13 ARG H H 13 8.338 8.338 7.679 0.659 19638 1491 1 9 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.378 -3.464 19638 1492 1 9 . 1 1 14 14 CYS H H 14 8.047 8.047 8.187 -0.140 19638 1493 1 9 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.391 1.727 19638 1494 1 9 . 1 1 15 15 LEU H H 15 8.070 8.070 7.663 0.407 19638 1495 1 9 . 1 1 16 16 GLN HA H 16 4.658 4.658 4.005 0.653 19638 1496 1 9 . 1 1 16 16 GLN H H 16 10.022 10.022 8.437 1.585 19638 1497 1 9 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.478 1.710 19638 1498 1 9 . 1 1 17 17 CYS H H 17 9.730 9.730 7.552 2.178 19638 1499 1 9 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.926 3.918 19638 1500 1 9 . 1 1 18 18 HIS H H 18 11.098 11.098 8.707 2.391 19638 1501 1 9 . 1 1 19 19 THR HA H 19 6.298 6.298 4.452 1.846 19638 1502 1 9 . 1 1 19 19 THR H H 19 10.180 10.180 8.760 1.420 19638 1503 1 9 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.915 1.089 19638 1504 1 9 . 1 1 20 20 VAL H H 20 8.927 8.927 8.170 0.757 19638 1505 1 9 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.403 0.216 19638 1506 1 9 . 1 1 21 21 GLU H H 21 9.460 9.460 7.324 2.136 19638 1507 1 9 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.620 0.006 19638 1508 1 9 . 1 1 22 22 LYS H H 22 9.064 9.064 8.446 0.618 19638 1509 1 9 . 1 1 23 23 GLY H H 23 9.543 9.543 8.203 1.340 19638 1510 1 9 . 1 1 24 24 GLY H H 24 8.296 8.296 7.715 0.581 19638 1511 1 9 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.339 0.158 19638 1512 1 9 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.901 0.374 19638 1513 1 9 . 1 1 26 26 HIS H H 26 8.931 8.931 8.479 0.452 19638 1514 1 9 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.524 0.146 19638 1515 1 9 . 1 1 27 27 LYS H H 27 8.362 8.362 8.287 0.075 19638 1516 1 9 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.555 -0.419 19638 1517 1 9 . 1 1 28 28 VAL H H 28 7.720 7.720 8.817 -1.097 19638 1518 1 9 . 1 1 29 29 GLY H H 29 7.705 7.705 7.762 -0.057 19638 1519 1 9 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.326 -0.208 19638 1520 1 9 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.771 1.146 19638 1521 1 9 . 1 1 31 31 ASN H H 31 11.993 11.993 8.459 3.534 19638 1522 1 9 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.257 0.203 19638 1523 1 9 . 1 1 32 32 LEU H H 32 9.445 9.445 8.645 0.800 19638 1524 1 9 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.272 -0.166 19638 1525 1 9 . 1 1 33 33 HIS H H 33 8.051 8.051 8.365 -0.314 19638 1526 1 9 . 1 1 34 34 GLY H H 34 9.066 9.066 7.095 1.971 19638 1527 1 9 . 1 1 35 35 ILE HA H 35 3.561 3.561 4.270 -0.709 19638 1528 1 9 . 1 1 35 35 ILE H H 35 7.068 7.068 7.251 -0.183 19638 1529 1 9 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.405 -0.493 19638 1530 1 9 . 1 1 36 36 PHE H H 36 7.901 7.901 7.746 0.155 19638 1531 1 9 . 1 1 37 37 GLY H H 37 8.766 8.766 9.071 -0.305 19638 1532 1 9 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.654 -0.039 19638 1533 1 9 . 1 1 38 38 ARG H H 38 7.962 7.962 7.314 0.648 19638 1534 1 9 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.055 0.007 19638 1535 1 9 . 1 1 39 39 HIS H H 39 8.064 8.064 8.257 -0.193 19638 1536 1 9 . 1 1 40 40 SER HA H 40 4.601 4.601 4.261 0.340 19638 1537 1 9 . 1 1 40 40 SER H H 40 8.588 8.588 8.825 -0.237 19638 1538 1 9 . 1 1 41 41 GLY H H 41 8.930 8.930 8.389 0.541 19638 1539 1 9 . 1 1 42 42 GLN H H 42 7.865 7.865 8.291 -0.426 19638 1540 1 9 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.152 0.184 19638 1541 1 9 . 1 1 43 43 ALA H H 43 8.062 8.062 7.810 0.252 19638 1542 1 9 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.028 0.147 19638 1543 1 9 . 1 1 44 44 GLU H H 44 8.924 8.924 7.783 1.141 19638 1544 1 9 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.427 -0.582 19638 1545 1 9 . 1 1 46 46 TYR H H 46 7.033 7.033 7.482 -0.449 19638 1546 1 9 . 1 1 47 47 SER HA H 47 4.283 4.283 4.104 0.179 19638 1547 1 9 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.739 -0.497 19638 1548 1 9 . 1 1 48 48 TYR H H 48 7.905 7.905 8.300 -0.395 19638 1549 1 9 . 1 1 49 49 THR HA H 49 4.124 4.124 4.363 -0.239 19638 1550 1 9 . 1 1 49 49 THR H H 49 9.712 9.712 8.517 1.195 19638 1551 1 9 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.260 0.001 19638 1552 1 9 . 1 1 50 50 ASP H H 50 8.682 8.682 8.988 -0.306 19638 1553 1 9 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.965 0.217 19638 1554 1 9 . 1 1 51 51 ALA H H 51 7.802 7.802 8.325 -0.523 19638 1555 1 9 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.630 0.057 19638 1556 1 9 . 1 1 52 52 ASN H H 52 8.422 8.422 8.004 0.418 19638 1557 1 9 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.671 0.009 19638 1558 1 9 . 1 1 53 53 ILE H H 53 7.686 7.686 7.747 -0.061 19638 1559 1 9 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.072 -0.143 19638 1560 1 9 . 1 1 54 54 LYS H H 54 9.101 9.101 8.240 0.861 19638 1561 1 9 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.387 -0.351 19638 1562 1 9 . 1 1 55 55 LYS H H 55 7.355 7.355 7.650 -0.295 19638 1563 1 9 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.683 -0.358 19638 1564 1 9 . 1 1 56 56 ASN H H 56 7.506 7.506 8.493 -0.987 19638 1565 1 9 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.088 0.103 19638 1566 1 9 . 1 1 57 57 VAL H H 57 7.341 7.341 8.307 -0.966 19638 1567 1 9 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.134 -0.336 19638 1568 1 9 . 1 1 58 58 LEU H H 58 8.220 8.220 8.182 0.038 19638 1569 1 9 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.592 0.523 19638 1570 1 9 . 1 1 59 59 TRP H H 59 7.973 7.973 8.497 -0.524 19638 1571 1 9 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.930 -0.193 19638 1572 1 9 . 1 1 60 60 ASP H H 60 10.093 10.093 8.367 1.726 19638 1573 1 9 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.173 -0.835 19638 1574 1 9 . 1 1 61 61 GLU H H 61 10.090 10.090 8.841 1.249 19638 1575 1 9 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.589 -0.133 19638 1576 1 9 . 1 1 62 62 ASN H H 62 8.211 8.211 8.476 -0.265 19638 1577 1 9 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.527 0.023 19638 1578 1 9 . 1 1 63 63 ASN H H 63 9.331 9.331 8.428 0.903 19638 1579 1 9 . 1 1 64 64 MET HA H 64 4.321 4.321 4.231 0.090 19638 1580 1 9 . 1 1 64 64 MET H H 64 8.702 8.702 8.896 -0.194 19638 1581 1 9 . 1 1 65 65 SER HA H 65 3.445 3.445 4.188 -0.743 19638 1582 1 9 . 1 1 65 65 SER H H 65 7.442 7.442 7.980 -0.538 19638 1583 1 9 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.140 -0.283 19638 1584 1 9 . 1 1 66 66 GLU H H 66 7.574 7.574 7.886 -0.312 19638 1585 1 9 . 1 1 67 67 HIS HA H 67 4.279 4.279 4.215 0.064 19638 1586 1 9 . 1 1 67 67 HIS H H 67 8.297 8.297 7.859 0.438 19638 1587 1 9 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.235 -0.879 19638 1588 1 9 . 1 1 68 68 LEU H H 68 8.060 8.060 7.837 0.223 19638 1589 1 9 . 1 1 69 69 THR HA H 69 3.792 3.792 4.363 -0.571 19638 1590 1 9 . 1 1 69 69 THR H H 69 7.327 7.327 7.201 0.126 19638 1591 1 9 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.472 0.555 19638 1592 1 9 . 1 1 70 70 ASN H H 70 6.715 6.715 8.926 -2.211 19638 1593 1 9 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.246 1.715 19638 1594 1 9 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.109 1.016 19638 1595 1 9 . 1 1 72 72 ALA H H 72 9.052 9.052 8.419 0.633 19638 1596 1 9 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.023 0.546 19638 1597 1 9 . 1 1 73 73 LYS H H 73 7.914 7.914 7.878 0.036 19638 1598 1 9 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.197 0.830 19638 1599 1 9 . 1 1 74 74 TYR H H 74 8.520 8.520 7.471 1.049 19638 1600 1 9 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.661 0.000 19638 1601 1 9 . 1 1 75 75 ILE H H 75 9.542 9.542 7.483 2.059 19638 1602 1 9 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.371 0.756 19638 1603 1 9 . 1 1 77 77 GLY H H 77 9.573 9.573 8.016 1.557 19638 1604 1 9 . 1 1 78 78 THR HA H 78 5.058 5.058 4.223 0.835 19638 1605 1 9 . 1 1 78 78 THR H H 78 9.274 9.274 8.125 1.149 19638 1606 1 9 . 1 1 79 79 LYS H H 79 8.060 8.060 8.636 -0.576 19638 1607 1 9 . 1 1 80 80 MET H H 80 8.670 8.670 7.894 0.776 19638 1608 1 9 . 1 1 81 81 ALA H H 81 8.060 8.060 8.803 -0.743 19638 1609 1 9 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.546 0.016 19638 1610 1 9 . 1 1 82 82 PHE H H 82 8.446 8.446 7.938 0.508 19638 1611 1 9 . 1 1 83 83 GLY H H 83 7.142 7.142 7.633 -0.491 19638 1612 1 9 . 1 1 84 84 GLY H H 84 8.211 8.211 8.057 0.154 19638 1613 1 9 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.622 -0.367 19638 1614 1 9 . 1 1 85 85 LEU H H 85 8.160 8.160 7.950 0.210 19638 1615 1 9 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.087 -0.132 19638 1616 1 9 . 1 1 86 86 LYS H H 86 8.440 8.440 8.704 -0.264 19638 1617 1 9 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.405 -0.035 19638 1618 1 9 . 1 1 87 87 LYS H H 87 8.800 8.800 8.152 0.648 19638 1619 1 9 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.039 -0.613 19638 1620 1 9 . 1 1 88 88 GLU H H 88 8.971 8.971 9.030 -0.059 19638 1621 1 9 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.969 -0.152 19638 1622 1 9 . 1 1 89 89 LYS H H 89 8.679 8.679 8.352 0.327 19638 1623 1 9 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.433 -0.392 19638 1624 1 9 . 1 1 90 90 ASP H H 90 6.295 6.295 8.482 -2.187 19638 1625 1 9 . 1 1 91 91 ARG HA H 91 3.281 3.281 3.969 -0.688 19638 1626 1 9 . 1 1 91 91 ARG H H 91 7.285 7.285 7.536 -0.251 19638 1627 1 9 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.464 -0.659 19638 1628 1 9 . 1 1 92 92 ASN H H 92 8.541 8.541 8.038 0.503 19638 1629 1 9 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.449 -0.456 19638 1630 1 9 . 1 1 93 93 ASP H H 93 8.518 8.518 7.653 0.865 19638 1631 1 9 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.185 -0.407 19638 1632 1 9 . 1 1 94 94 LEU H H 94 8.167 8.167 8.116 0.051 19638 1633 1 9 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.787 -0.818 19638 1634 1 9 . 1 1 95 95 ILE H H 95 8.718 8.718 7.827 0.891 19638 1635 1 9 . 1 1 96 96 THR HA H 96 3.661 3.661 3.921 -0.260 19638 1636 1 9 . 1 1 96 96 THR H H 96 7.955 7.955 8.110 -0.155 19638 1637 1 9 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.071 -0.079 19638 1638 1 9 . 1 1 97 97 TYR H H 97 7.619 7.619 8.110 -0.491 19638 1639 1 9 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.720 -0.489 19638 1640 1 9 . 1 1 98 98 LEU H H 98 8.933 8.933 7.670 1.263 19638 1641 1 9 . 1 1 99 99 LYS HA H 99 3.492 3.492 2.932 0.560 19638 1642 1 9 . 1 1 99 99 LYS H H 99 8.454 8.454 8.442 0.012 19638 1643 1 9 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.863 0.231 19638 1644 1 9 . 1 1 100 100 LYS H H 100 6.501 6.501 7.666 -1.165 19638 1645 1 9 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.047 -0.092 19638 1646 1 9 . 1 1 101 101 ALA H H 101 8.296 8.296 7.422 0.874 19638 1647 1 9 . 1 1 102 102 THR H H 102 7.330 7.330 7.551 -0.221 19638 1648 1 10 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.573 -0.314 19638 1649 1 10 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.638 0.970 19638 1650 1 10 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.291 -0.498 19638 1651 1 10 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.876 -1.299 19638 1652 1 10 . 1 1 2 2 SER H H 2 9.424 9.424 8.810 0.614 19638 1653 1 10 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.225 -0.245 19638 1654 1 10 . 1 1 3 3 ALA H H 3 9.092 9.092 8.739 0.353 19638 1655 1 10 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.989 0.284 19638 1656 1 10 . 1 1 4 4 LYS H H 4 8.086 8.086 8.333 -0.247 19638 1657 1 10 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.087 -0.037 19638 1658 1 10 . 1 1 5 5 LYS H H 5 7.755 7.755 8.462 -0.707 19638 1659 1 10 . 1 1 6 6 GLY H H 6 8.694 8.694 8.236 0.458 19638 1660 1 10 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.393 -1.047 19638 1661 1 10 . 1 1 7 7 ALA H H 7 7.999 7.999 8.517 -0.518 19638 1662 1 10 . 1 1 8 8 THR HA H 8 3.898 3.898 4.020 -0.122 19638 1663 1 10 . 1 1 8 8 THR H H 8 7.203 7.203 7.516 -0.313 19638 1664 1 10 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.181 -0.337 19638 1665 1 10 . 1 1 9 9 LEU H H 9 7.846 7.846 7.781 0.065 19638 1666 1 10 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.070 -0.567 19638 1667 1 10 . 1 1 10 10 PHE H H 10 8.651 8.651 8.678 -0.027 19638 1668 1 10 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.946 0.277 19638 1669 1 10 . 1 1 11 11 LYS H H 11 8.365 8.365 8.253 0.112 19638 1670 1 10 . 1 1 12 12 THR HA H 12 4.361 4.361 4.150 0.211 19638 1671 1 10 . 1 1 12 12 THR H H 12 7.959 7.959 8.339 -0.380 19638 1672 1 10 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.623 -0.037 19638 1673 1 10 . 1 1 13 13 ARG H H 13 8.338 8.338 7.679 0.659 19638 1674 1 10 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.343 -3.429 19638 1675 1 10 . 1 1 14 14 CYS H H 14 8.047 8.047 8.291 -0.244 19638 1676 1 10 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.324 1.794 19638 1677 1 10 . 1 1 15 15 LEU H H 15 8.070 8.070 7.600 0.470 19638 1678 1 10 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.975 0.683 19638 1679 1 10 . 1 1 16 16 GLN H H 16 10.022 10.022 8.349 1.673 19638 1680 1 10 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.430 1.758 19638 1681 1 10 . 1 1 17 17 CYS H H 17 9.730 9.730 7.365 2.365 19638 1682 1 10 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.911 3.933 19638 1683 1 10 . 1 1 18 18 HIS H H 18 11.098 11.098 8.518 2.580 19638 1684 1 10 . 1 1 19 19 THR HA H 19 6.298 6.298 4.330 1.968 19638 1685 1 10 . 1 1 19 19 THR H H 19 10.180 10.180 8.678 1.502 19638 1686 1 10 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.968 1.036 19638 1687 1 10 . 1 1 20 20 VAL H H 20 8.927 8.927 8.235 0.692 19638 1688 1 10 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.457 0.162 19638 1689 1 10 . 1 1 21 21 GLU H H 21 9.460 9.460 7.298 2.162 19638 1690 1 10 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.754 -0.128 19638 1691 1 10 . 1 1 22 22 LYS H H 22 9.064 9.064 8.522 0.542 19638 1692 1 10 . 1 1 23 23 GLY H H 23 9.543 9.543 7.614 1.929 19638 1693 1 10 . 1 1 24 24 GLY H H 24 8.296 8.296 7.231 1.065 19638 1694 1 10 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.283 0.214 19638 1695 1 10 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.136 1.139 19638 1696 1 10 . 1 1 26 26 HIS H H 26 8.931 8.931 7.790 1.141 19638 1697 1 10 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.086 0.584 19638 1698 1 10 . 1 1 27 27 LYS H H 27 8.362 8.362 8.046 0.316 19638 1699 1 10 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.896 -0.760 19638 1700 1 10 . 1 1 28 28 VAL H H 28 7.720 7.720 8.265 -0.545 19638 1701 1 10 . 1 1 29 29 GLY H H 29 7.705 7.705 7.342 0.363 19638 1702 1 10 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.115 0.003 19638 1703 1 10 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.768 1.149 19638 1704 1 10 . 1 1 31 31 ASN H H 31 11.993 11.993 8.312 3.681 19638 1705 1 10 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.498 -0.038 19638 1706 1 10 . 1 1 32 32 LEU H H 32 9.445 9.445 8.293 1.152 19638 1707 1 10 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.668 -0.562 19638 1708 1 10 . 1 1 33 33 HIS H H 33 8.051 8.051 8.665 -0.614 19638 1709 1 10 . 1 1 34 34 GLY H H 34 9.066 9.066 8.634 0.432 19638 1710 1 10 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.929 -0.368 19638 1711 1 10 . 1 1 35 35 ILE H H 35 7.068 7.068 7.911 -0.843 19638 1712 1 10 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.299 -0.387 19638 1713 1 10 . 1 1 36 36 PHE H H 36 7.901 7.901 7.626 0.275 19638 1714 1 10 . 1 1 37 37 GLY H H 37 8.766 8.766 9.231 -0.465 19638 1715 1 10 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.578 0.037 19638 1716 1 10 . 1 1 38 38 ARG H H 38 7.962 7.962 7.601 0.361 19638 1717 1 10 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.783 0.279 19638 1718 1 10 . 1 1 39 39 HIS H H 39 8.064 8.064 8.779 -0.715 19638 1719 1 10 . 1 1 40 40 SER HA H 40 4.601 4.601 4.528 0.073 19638 1720 1 10 . 1 1 40 40 SER H H 40 8.588 8.588 8.115 0.473 19638 1721 1 10 . 1 1 41 41 GLY H H 41 8.930 8.930 8.421 0.509 19638 1722 1 10 . 1 1 42 42 GLN H H 42 7.865 7.865 7.739 0.126 19638 1723 1 10 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.327 0.009 19638 1724 1 10 . 1 1 43 43 ALA H H 43 8.062 8.062 7.574 0.488 19638 1725 1 10 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.545 -0.370 19638 1726 1 10 . 1 1 44 44 GLU H H 44 8.924 8.924 8.517 0.407 19638 1727 1 10 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.522 -0.677 19638 1728 1 10 . 1 1 46 46 TYR H H 46 7.033 7.033 7.406 -0.373 19638 1729 1 10 . 1 1 47 47 SER HA H 47 4.283 4.283 4.533 -0.250 19638 1730 1 10 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.764 -0.522 19638 1731 1 10 . 1 1 48 48 TYR H H 48 7.905 7.905 8.525 -0.620 19638 1732 1 10 . 1 1 49 49 THR HA H 49 4.124 4.124 4.416 -0.292 19638 1733 1 10 . 1 1 49 49 THR H H 49 9.712 9.712 8.481 1.231 19638 1734 1 10 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.278 -0.017 19638 1735 1 10 . 1 1 50 50 ASP H H 50 8.682 8.682 8.950 -0.268 19638 1736 1 10 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.856 0.326 19638 1737 1 10 . 1 1 51 51 ALA H H 51 7.802 7.802 8.510 -0.708 19638 1738 1 10 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.583 0.104 19638 1739 1 10 . 1 1 52 52 ASN H H 52 8.422 8.422 8.258 0.164 19638 1740 1 10 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.641 0.039 19638 1741 1 10 . 1 1 53 53 ILE H H 53 7.686 7.686 7.647 0.039 19638 1742 1 10 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.092 -0.163 19638 1743 1 10 . 1 1 54 54 LYS H H 54 9.101 9.101 8.409 0.692 19638 1744 1 10 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.404 -0.368 19638 1745 1 10 . 1 1 55 55 LYS H H 55 7.355 7.355 7.887 -0.532 19638 1746 1 10 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.477 -0.152 19638 1747 1 10 . 1 1 56 56 ASN H H 56 7.506 7.506 7.694 -0.188 19638 1748 1 10 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.252 -0.061 19638 1749 1 10 . 1 1 57 57 VAL H H 57 7.341 7.341 7.834 -0.493 19638 1750 1 10 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.031 -0.233 19638 1751 1 10 . 1 1 58 58 LEU H H 58 8.220 8.220 8.237 -0.017 19638 1752 1 10 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.592 0.523 19638 1753 1 10 . 1 1 59 59 TRP H H 59 7.973 7.973 8.899 -0.926 19638 1754 1 10 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.879 -0.142 19638 1755 1 10 . 1 1 60 60 ASP H H 60 10.093 10.093 8.342 1.751 19638 1756 1 10 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.075 -0.737 19638 1757 1 10 . 1 1 61 61 GLU H H 61 10.090 10.090 8.955 1.135 19638 1758 1 10 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.572 -0.116 19638 1759 1 10 . 1 1 62 62 ASN H H 62 8.211 8.211 8.410 -0.199 19638 1760 1 10 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.569 -0.019 19638 1761 1 10 . 1 1 63 63 ASN H H 63 9.331 9.331 9.402 -0.071 19638 1762 1 10 . 1 1 64 64 MET HA H 64 4.321 4.321 4.291 0.030 19638 1763 1 10 . 1 1 64 64 MET H H 64 8.702 8.702 8.702 -0.000 19638 1764 1 10 . 1 1 65 65 SER HA H 65 3.445 3.445 4.205 -0.760 19638 1765 1 10 . 1 1 65 65 SER H H 65 7.442 7.442 7.891 -0.449 19638 1766 1 10 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.208 -0.351 19638 1767 1 10 . 1 1 66 66 GLU H H 66 7.574 7.574 7.551 0.023 19638 1768 1 10 . 1 1 67 67 HIS HA H 67 4.279 4.279 4.067 0.212 19638 1769 1 10 . 1 1 67 67 HIS H H 67 8.297 8.297 7.882 0.415 19638 1770 1 10 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.167 -0.811 19638 1771 1 10 . 1 1 68 68 LEU H H 68 8.060 8.060 7.902 0.158 19638 1772 1 10 . 1 1 69 69 THR HA H 69 3.792 3.792 4.141 -0.349 19638 1773 1 10 . 1 1 69 69 THR H H 69 7.327 7.327 7.832 -0.505 19638 1774 1 10 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.106 -0.079 19638 1775 1 10 . 1 1 70 70 ASN H H 70 6.715 6.715 7.773 -1.058 19638 1776 1 10 . 1 1 71 71 PRO HA H 71 5.961 5.961 3.969 1.992 19638 1777 1 10 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.062 1.063 19638 1778 1 10 . 1 1 72 72 ALA H H 72 9.052 9.052 8.229 0.823 19638 1779 1 10 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.074 0.495 19638 1780 1 10 . 1 1 73 73 LYS H H 73 7.914 7.914 8.263 -0.349 19638 1781 1 10 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.272 0.755 19638 1782 1 10 . 1 1 74 74 TYR H H 74 8.520 8.520 7.522 0.998 19638 1783 1 10 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.797 -0.136 19638 1784 1 10 . 1 1 75 75 ILE H H 75 9.542 9.542 7.650 1.892 19638 1785 1 10 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.627 0.500 19638 1786 1 10 . 1 1 77 77 GLY H H 77 9.573 9.573 8.651 0.922 19638 1787 1 10 . 1 1 78 78 THR HA H 78 5.058 5.058 4.619 0.439 19638 1788 1 10 . 1 1 78 78 THR H H 78 9.274 9.274 7.589 1.685 19638 1789 1 10 . 1 1 79 79 LYS H H 79 8.060 8.060 8.783 -0.723 19638 1790 1 10 . 1 1 80 80 MET H H 80 8.670 8.670 7.945 0.725 19638 1791 1 10 . 1 1 81 81 ALA H H 81 8.060 8.060 8.628 -0.568 19638 1792 1 10 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.608 -0.046 19638 1793 1 10 . 1 1 82 82 PHE H H 82 8.446 8.446 7.792 0.654 19638 1794 1 10 . 1 1 83 83 GLY H H 83 7.142 7.142 7.907 -0.765 19638 1795 1 10 . 1 1 84 84 GLY H H 84 8.211 8.211 8.055 0.156 19638 1796 1 10 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.640 -0.385 19638 1797 1 10 . 1 1 85 85 LEU H H 85 8.160 8.160 8.065 0.095 19638 1798 1 10 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.093 -0.138 19638 1799 1 10 . 1 1 86 86 LYS H H 86 8.440 8.440 8.649 -0.209 19638 1800 1 10 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.402 -0.032 19638 1801 1 10 . 1 1 87 87 LYS H H 87 8.800 8.800 8.014 0.786 19638 1802 1 10 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.072 -0.646 19638 1803 1 10 . 1 1 88 88 GLU H H 88 8.971 8.971 9.079 -0.108 19638 1804 1 10 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.985 -0.168 19638 1805 1 10 . 1 1 89 89 LYS H H 89 8.679 8.679 8.333 0.346 19638 1806 1 10 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.468 -0.427 19638 1807 1 10 . 1 1 90 90 ASP H H 90 6.295 6.295 8.481 -2.186 19638 1808 1 10 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.064 -0.783 19638 1809 1 10 . 1 1 91 91 ARG H H 91 7.285 7.285 7.547 -0.262 19638 1810 1 10 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.522 -0.717 19638 1811 1 10 . 1 1 92 92 ASN H H 92 8.541 8.541 8.513 0.028 19638 1812 1 10 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.504 -0.511 19638 1813 1 10 . 1 1 93 93 ASP H H 93 8.518 8.518 7.786 0.732 19638 1814 1 10 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.079 -0.301 19638 1815 1 10 . 1 1 94 94 LEU H H 94 8.167 8.167 8.267 -0.100 19638 1816 1 10 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.740 -0.771 19638 1817 1 10 . 1 1 95 95 ILE H H 95 8.718 8.718 8.469 0.249 19638 1818 1 10 . 1 1 96 96 THR HA H 96 3.661 3.661 3.886 -0.225 19638 1819 1 10 . 1 1 96 96 THR H H 96 7.955 7.955 8.042 -0.087 19638 1820 1 10 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.103 -0.111 19638 1821 1 10 . 1 1 97 97 TYR H H 97 7.619 7.619 7.942 -0.323 19638 1822 1 10 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.703 -0.472 19638 1823 1 10 . 1 1 98 98 LEU H H 98 8.933 8.933 7.752 1.181 19638 1824 1 10 . 1 1 99 99 LYS HA H 99 3.492 3.492 2.890 0.602 19638 1825 1 10 . 1 1 99 99 LYS H H 99 8.454 8.454 8.355 0.099 19638 1826 1 10 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.835 0.259 19638 1827 1 10 . 1 1 100 100 LYS H H 100 6.501 6.501 7.693 -1.192 19638 1828 1 10 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.076 -0.121 19638 1829 1 10 . 1 1 101 101 ALA H H 101 8.296 8.296 7.286 1.010 19638 1830 1 10 . 1 1 102 102 THR H H 102 7.330 7.330 7.463 -0.133 19638 1831 1 11 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.987 -0.728 19638 1832 1 11 . 1 1 -3 -3 PHE H H -3 8.608 8.608 6.890 1.718 19638 1833 1 11 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 3.986 -0.193 19638 1834 1 11 . 1 1 -2 -2 LYS H H -2 6.577 6.577 8.810 -2.233 19638 1835 1 11 . 1 1 2 2 SER H H 2 9.424 9.424 8.150 1.274 19638 1836 1 11 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.625 -0.645 19638 1837 1 11 . 1 1 3 3 ALA H H 3 9.092 9.092 7.472 1.620 19638 1838 1 11 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.901 0.372 19638 1839 1 11 . 1 1 4 4 LYS H H 4 8.086 8.086 8.913 -0.827 19638 1840 1 11 . 1 1 5 5 LYS HA H 5 4.050 4.050 3.967 0.083 19638 1841 1 11 . 1 1 5 5 LYS H H 5 7.755 7.755 8.340 -0.585 19638 1842 1 11 . 1 1 6 6 GLY H H 6 8.694 8.694 7.948 0.746 19638 1843 1 11 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.252 -0.906 19638 1844 1 11 . 1 1 7 7 ALA H H 7 7.999 7.999 7.287 0.712 19638 1845 1 11 . 1 1 8 8 THR HA H 8 3.898 3.898 3.932 -0.034 19638 1846 1 11 . 1 1 8 8 THR H H 8 7.203 7.203 8.152 -0.949 19638 1847 1 11 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.105 -0.261 19638 1848 1 11 . 1 1 9 9 LEU H H 9 7.846 7.846 8.048 -0.202 19638 1849 1 11 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.070 -0.567 19638 1850 1 11 . 1 1 10 10 PHE H H 10 8.651 8.651 7.917 0.734 19638 1851 1 11 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.962 0.261 19638 1852 1 11 . 1 1 11 11 LYS H H 11 8.365 8.365 7.902 0.463 19638 1853 1 11 . 1 1 12 12 THR HA H 12 4.361 4.361 4.135 0.226 19638 1854 1 11 . 1 1 12 12 THR H H 12 7.959 7.959 8.236 -0.277 19638 1855 1 11 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.571 0.015 19638 1856 1 11 . 1 1 13 13 ARG H H 13 8.338 8.338 8.103 0.235 19638 1857 1 11 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.371 -3.457 19638 1858 1 11 . 1 1 14 14 CYS H H 14 8.047 8.047 8.383 -0.336 19638 1859 1 11 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.277 1.841 19638 1860 1 11 . 1 1 15 15 LEU H H 15 8.070 8.070 7.810 0.260 19638 1861 1 11 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.990 0.668 19638 1862 1 11 . 1 1 16 16 GLN H H 16 10.022 10.022 8.395 1.627 19638 1863 1 11 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.438 1.750 19638 1864 1 11 . 1 1 17 17 CYS H H 17 9.730 9.730 7.507 2.223 19638 1865 1 11 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.893 3.951 19638 1866 1 11 . 1 1 18 18 HIS H H 18 11.098 11.098 8.774 2.324 19638 1867 1 11 . 1 1 19 19 THR HA H 19 6.298 6.298 4.407 1.891 19638 1868 1 11 . 1 1 19 19 THR H H 19 10.180 10.180 8.751 1.429 19638 1869 1 11 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.804 1.200 19638 1870 1 11 . 1 1 20 20 VAL H H 20 8.927 8.927 8.314 0.613 19638 1871 1 11 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.124 0.495 19638 1872 1 11 . 1 1 21 21 GLU H H 21 9.460 9.460 7.350 2.110 19638 1873 1 11 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.798 -0.172 19638 1874 1 11 . 1 1 22 22 LYS H H 22 9.064 9.064 8.275 0.789 19638 1875 1 11 . 1 1 23 23 GLY H H 23 9.543 9.543 7.726 1.817 19638 1876 1 11 . 1 1 24 24 GLY H H 24 8.296 8.296 7.697 0.599 19638 1877 1 11 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.289 0.208 19638 1878 1 11 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.716 0.559 19638 1879 1 11 . 1 1 26 26 HIS H H 26 8.931 8.931 8.391 0.540 19638 1880 1 11 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.109 0.561 19638 1881 1 11 . 1 1 27 27 LYS H H 27 8.362 8.362 8.531 -0.169 19638 1882 1 11 . 1 1 28 28 VAL HA H 28 3.136 3.136 4.103 -0.967 19638 1883 1 11 . 1 1 28 28 VAL H H 28 7.720 7.720 7.511 0.209 19638 1884 1 11 . 1 1 29 29 GLY H H 29 7.705 7.705 7.638 0.067 19638 1885 1 11 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.004 0.114 19638 1886 1 11 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.412 1.505 19638 1887 1 11 . 1 1 31 31 ASN H H 31 11.993 11.993 8.117 3.876 19638 1888 1 11 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.505 -0.045 19638 1889 1 11 . 1 1 32 32 LEU H H 32 9.445 9.445 8.489 0.956 19638 1890 1 11 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.679 -0.573 19638 1891 1 11 . 1 1 33 33 HIS H H 33 8.051 8.051 8.625 -0.574 19638 1892 1 11 . 1 1 34 34 GLY H H 34 9.066 9.066 8.634 0.432 19638 1893 1 11 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.828 -0.267 19638 1894 1 11 . 1 1 35 35 ILE H H 35 7.068 7.068 8.066 -0.998 19638 1895 1 11 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.358 -0.446 19638 1896 1 11 . 1 1 36 36 PHE H H 36 7.901 7.901 7.595 0.306 19638 1897 1 11 . 1 1 37 37 GLY H H 37 8.766 8.766 9.251 -0.485 19638 1898 1 11 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.525 0.090 19638 1899 1 11 . 1 1 38 38 ARG H H 38 7.962 7.962 7.636 0.326 19638 1900 1 11 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.812 0.250 19638 1901 1 11 . 1 1 39 39 HIS H H 39 8.064 8.064 8.719 -0.655 19638 1902 1 11 . 1 1 40 40 SER HA H 40 4.601 4.601 4.399 0.202 19638 1903 1 11 . 1 1 40 40 SER H H 40 8.588 8.588 8.465 0.123 19638 1904 1 11 . 1 1 41 41 GLY H H 41 8.930 8.930 8.621 0.309 19638 1905 1 11 . 1 1 42 42 GLN H H 42 7.865 7.865 7.888 -0.023 19638 1906 1 11 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.204 0.132 19638 1907 1 11 . 1 1 43 43 ALA H H 43 8.062 8.062 8.550 -0.488 19638 1908 1 11 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.027 0.148 19638 1909 1 11 . 1 1 44 44 GLU H H 44 8.924 8.924 7.726 1.198 19638 1910 1 11 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.419 -0.574 19638 1911 1 11 . 1 1 46 46 TYR H H 46 7.033 7.033 7.667 -0.634 19638 1912 1 11 . 1 1 47 47 SER HA H 47 4.283 4.283 4.194 0.089 19638 1913 1 11 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.742 -0.500 19638 1914 1 11 . 1 1 48 48 TYR H H 48 7.905 7.905 8.479 -0.574 19638 1915 1 11 . 1 1 49 49 THR HA H 49 4.124 4.124 4.454 -0.330 19638 1916 1 11 . 1 1 49 49 THR H H 49 9.712 9.712 8.499 1.213 19638 1917 1 11 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.338 -0.077 19638 1918 1 11 . 1 1 50 50 ASP H H 50 8.682 8.682 8.973 -0.291 19638 1919 1 11 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.979 0.203 19638 1920 1 11 . 1 1 51 51 ALA H H 51 7.802 7.802 7.743 0.059 19638 1921 1 11 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.688 -0.001 19638 1922 1 11 . 1 1 52 52 ASN H H 52 8.422 8.422 8.255 0.167 19638 1923 1 11 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.678 0.002 19638 1924 1 11 . 1 1 53 53 ILE H H 53 7.686 7.686 7.784 -0.098 19638 1925 1 11 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.082 -0.153 19638 1926 1 11 . 1 1 54 54 LYS H H 54 9.101 9.101 8.251 0.850 19638 1927 1 11 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.385 -0.349 19638 1928 1 11 . 1 1 55 55 LYS H H 55 7.355 7.355 7.812 -0.457 19638 1929 1 11 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.711 -0.386 19638 1930 1 11 . 1 1 56 56 ASN H H 56 7.506 7.506 8.539 -1.033 19638 1931 1 11 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.200 -0.009 19638 1932 1 11 . 1 1 57 57 VAL H H 57 7.341 7.341 8.251 -0.910 19638 1933 1 11 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.150 -0.352 19638 1934 1 11 . 1 1 58 58 LEU H H 58 8.220 8.220 8.204 0.016 19638 1935 1 11 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.526 0.589 19638 1936 1 11 . 1 1 59 59 TRP H H 59 7.973 7.973 8.971 -0.998 19638 1937 1 11 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.920 -0.183 19638 1938 1 11 . 1 1 60 60 ASP H H 60 10.093 10.093 8.484 1.609 19638 1939 1 11 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.193 -0.855 19638 1940 1 11 . 1 1 61 61 GLU H H 61 10.090 10.090 9.020 1.070 19638 1941 1 11 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.584 -0.128 19638 1942 1 11 . 1 1 62 62 ASN H H 62 8.211 8.211 8.584 -0.373 19638 1943 1 11 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.581 -0.031 19638 1944 1 11 . 1 1 63 63 ASN H H 63 9.331 9.331 8.475 0.856 19638 1945 1 11 . 1 1 64 64 MET HA H 64 4.321 4.321 4.158 0.163 19638 1946 1 11 . 1 1 64 64 MET H H 64 8.702 8.702 8.857 -0.155 19638 1947 1 11 . 1 1 65 65 SER HA H 65 3.445 3.445 4.135 -0.690 19638 1948 1 11 . 1 1 65 65 SER H H 65 7.442 7.442 7.955 -0.513 19638 1949 1 11 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.149 -0.292 19638 1950 1 11 . 1 1 66 66 GLU H H 66 7.574 7.574 7.596 -0.022 19638 1951 1 11 . 1 1 67 67 HIS HA H 67 4.279 4.279 4.407 -0.128 19638 1952 1 11 . 1 1 67 67 HIS H H 67 8.297 8.297 8.181 0.116 19638 1953 1 11 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.174 -0.818 19638 1954 1 11 . 1 1 68 68 LEU H H 68 8.060 8.060 7.753 0.307 19638 1955 1 11 . 1 1 69 69 THR HA H 69 3.792 3.792 4.410 -0.618 19638 1956 1 11 . 1 1 69 69 THR H H 69 7.327 7.327 7.233 0.094 19638 1957 1 11 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.515 0.512 19638 1958 1 11 . 1 1 70 70 ASN H H 70 6.715 6.715 8.958 -2.243 19638 1959 1 11 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.308 1.653 19638 1960 1 11 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.089 1.036 19638 1961 1 11 . 1 1 72 72 ALA H H 72 9.052 9.052 8.377 0.675 19638 1962 1 11 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.274 0.295 19638 1963 1 11 . 1 1 73 73 LYS H H 73 7.914 7.914 7.591 0.323 19638 1964 1 11 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.551 0.476 19638 1965 1 11 . 1 1 74 74 TYR H H 74 8.520 8.520 7.850 0.670 19638 1966 1 11 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.003 0.658 19638 1967 1 11 . 1 1 75 75 ILE H H 75 9.542 9.542 8.975 0.567 19638 1968 1 11 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.427 0.700 19638 1969 1 11 . 1 1 77 77 GLY H H 77 9.573 9.573 8.256 1.317 19638 1970 1 11 . 1 1 78 78 THR HA H 78 5.058 5.058 4.743 0.315 19638 1971 1 11 . 1 1 78 78 THR H H 78 9.274 9.274 7.492 1.782 19638 1972 1 11 . 1 1 79 79 LYS H H 79 8.060 8.060 8.611 -0.550 19638 1973 1 11 . 1 1 80 80 MET H H 80 8.670 8.670 7.769 0.901 19638 1974 1 11 . 1 1 81 81 ALA H H 81 8.060 8.060 8.530 -0.470 19638 1975 1 11 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.339 0.223 19638 1976 1 11 . 1 1 82 82 PHE H H 82 8.446 8.446 7.977 0.469 19638 1977 1 11 . 1 1 83 83 GLY H H 83 7.142 7.142 7.459 -0.317 19638 1978 1 11 . 1 1 84 84 GLY H H 84 8.211 8.211 8.093 0.118 19638 1979 1 11 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.475 -0.220 19638 1980 1 11 . 1 1 85 85 LEU H H 85 8.160 8.160 7.898 0.262 19638 1981 1 11 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.119 -0.164 19638 1982 1 11 . 1 1 86 86 LYS H H 86 8.440 8.440 8.602 -0.162 19638 1983 1 11 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.390 -0.020 19638 1984 1 11 . 1 1 87 87 LYS H H 87 8.800 8.800 8.057 0.743 19638 1985 1 11 . 1 1 88 88 GLU HA H 88 3.426 3.426 3.998 -0.572 19638 1986 1 11 . 1 1 88 88 GLU H H 88 8.971 8.971 8.838 0.133 19638 1987 1 11 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.016 -0.199 19638 1988 1 11 . 1 1 89 89 LYS H H 89 8.679 8.679 8.460 0.219 19638 1989 1 11 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.408 -0.367 19638 1990 1 11 . 1 1 90 90 ASP H H 90 6.295 6.295 8.640 -2.345 19638 1991 1 11 . 1 1 91 91 ARG HA H 91 3.281 3.281 3.981 -0.700 19638 1992 1 11 . 1 1 91 91 ARG H H 91 7.285 7.285 7.534 -0.249 19638 1993 1 11 . 1 1 92 92 ASN HA H 92 3.805 3.805 3.862 -0.057 19638 1994 1 11 . 1 1 92 92 ASN H H 92 8.541 8.541 7.637 0.904 19638 1995 1 11 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.535 -0.542 19638 1996 1 11 . 1 1 93 93 ASP H H 93 8.518 8.518 7.554 0.964 19638 1997 1 11 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.257 -0.479 19638 1998 1 11 . 1 1 94 94 LEU H H 94 8.167 8.167 7.624 0.543 19638 1999 1 11 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.732 -0.763 19638 2000 1 11 . 1 1 95 95 ILE H H 95 8.718 8.718 7.957 0.761 19638 2001 1 11 . 1 1 96 96 THR HA H 96 3.661 3.661 3.974 -0.313 19638 2002 1 11 . 1 1 96 96 THR H H 96 7.955 7.955 7.682 0.273 19638 2003 1 11 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.083 -0.091 19638 2004 1 11 . 1 1 97 97 TYR H H 97 7.619 7.619 8.020 -0.401 19638 2005 1 11 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.641 -0.410 19638 2006 1 11 . 1 1 98 98 LEU H H 98 8.933 8.933 7.680 1.253 19638 2007 1 11 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.574 -0.082 19638 2008 1 11 . 1 1 99 99 LYS H H 99 8.454 8.454 7.538 0.916 19638 2009 1 11 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.882 0.212 19638 2010 1 11 . 1 1 100 100 LYS H H 100 6.501 6.501 7.425 -0.924 19638 2011 1 11 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.037 -0.082 19638 2012 1 11 . 1 1 101 101 ALA H H 101 8.296 8.296 7.405 0.891 19638 2013 1 11 . 1 1 102 102 THR H H 102 7.330 7.330 7.617 -0.287 19638 2014 1 12 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.639 -0.380 19638 2015 1 12 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.652 -0.044 19638 2016 1 12 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.225 -0.432 19638 2017 1 12 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.796 -1.219 19638 2018 1 12 . 1 1 2 2 SER H H 2 9.424 9.424 7.808 1.616 19638 2019 1 12 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.345 -0.365 19638 2020 1 12 . 1 1 3 3 ALA H H 3 9.092 9.092 8.660 0.432 19638 2021 1 12 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.853 0.420 19638 2022 1 12 . 1 1 4 4 LYS H H 4 8.086 8.086 8.251 -0.165 19638 2023 1 12 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.064 -0.014 19638 2024 1 12 . 1 1 5 5 LYS H H 5 7.755 7.755 8.454 -0.699 19638 2025 1 12 . 1 1 6 6 GLY H H 6 8.694 8.694 8.626 0.068 19638 2026 1 12 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.010 -0.664 19638 2027 1 12 . 1 1 7 7 ALA H H 7 7.999 7.999 7.927 0.072 19638 2028 1 12 . 1 1 8 8 THR HA H 8 3.898 3.898 3.981 -0.083 19638 2029 1 12 . 1 1 8 8 THR H H 8 7.203 7.203 7.649 -0.446 19638 2030 1 12 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.081 -0.237 19638 2031 1 12 . 1 1 9 9 LEU H H 9 7.846 7.846 8.721 -0.875 19638 2032 1 12 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.040 -0.537 19638 2033 1 12 . 1 1 10 10 PHE H H 10 8.651 8.651 8.300 0.351 19638 2034 1 12 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.963 0.260 19638 2035 1 12 . 1 1 11 11 LYS H H 11 8.365 8.365 7.925 0.440 19638 2036 1 12 . 1 1 12 12 THR HA H 12 4.361 4.361 4.174 0.187 19638 2037 1 12 . 1 1 12 12 THR H H 12 7.959 7.959 8.142 -0.183 19638 2038 1 12 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.576 0.010 19638 2039 1 12 . 1 1 13 13 ARG H H 13 8.338 8.338 7.771 0.567 19638 2040 1 12 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.341 -3.427 19638 2041 1 12 . 1 1 14 14 CYS H H 14 8.047 8.047 8.073 -0.026 19638 2042 1 12 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.410 1.708 19638 2043 1 12 . 1 1 15 15 LEU H H 15 8.070 8.070 7.564 0.506 19638 2044 1 12 . 1 1 16 16 GLN HA H 16 4.658 4.658 4.004 0.654 19638 2045 1 12 . 1 1 16 16 GLN H H 16 10.022 10.022 8.469 1.553 19638 2046 1 12 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.467 1.721 19638 2047 1 12 . 1 1 17 17 CYS H H 17 9.730 9.730 7.544 2.186 19638 2048 1 12 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.908 3.936 19638 2049 1 12 . 1 1 18 18 HIS H H 18 11.098 11.098 8.649 2.449 19638 2050 1 12 . 1 1 19 19 THR HA H 19 6.298 6.298 4.433 1.865 19638 2051 1 12 . 1 1 19 19 THR H H 19 10.180 10.180 8.801 1.379 19638 2052 1 12 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.924 1.080 19638 2053 1 12 . 1 1 20 20 VAL H H 20 8.927 8.927 8.227 0.700 19638 2054 1 12 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.457 0.162 19638 2055 1 12 . 1 1 21 21 GLU H H 21 9.460 9.460 7.335 2.125 19638 2056 1 12 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.916 -0.290 19638 2057 1 12 . 1 1 22 22 LYS H H 22 9.064 9.064 8.503 0.561 19638 2058 1 12 . 1 1 23 23 GLY H H 23 9.543 9.543 8.218 1.325 19638 2059 1 12 . 1 1 24 24 GLY H H 24 8.296 8.296 7.856 0.440 19638 2060 1 12 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.381 0.116 19638 2061 1 12 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.772 0.503 19638 2062 1 12 . 1 1 26 26 HIS H H 26 8.931 8.931 8.411 0.520 19638 2063 1 12 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.507 0.163 19638 2064 1 12 . 1 1 27 27 LYS H H 27 8.362 8.362 7.947 0.415 19638 2065 1 12 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.814 -0.678 19638 2066 1 12 . 1 1 28 28 VAL H H 28 7.720 7.720 8.368 -0.648 19638 2067 1 12 . 1 1 29 29 GLY H H 29 7.705 7.705 7.355 0.350 19638 2068 1 12 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.292 -0.174 19638 2069 1 12 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.838 1.079 19638 2070 1 12 . 1 1 31 31 ASN H H 31 11.993 11.993 8.308 3.685 19638 2071 1 12 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.550 -0.090 19638 2072 1 12 . 1 1 32 32 LEU H H 32 9.445 9.445 8.608 0.837 19638 2073 1 12 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.753 -0.647 19638 2074 1 12 . 1 1 33 33 HIS H H 33 8.051 8.051 8.342 -0.291 19638 2075 1 12 . 1 1 34 34 GLY H H 34 9.066 9.066 8.682 0.384 19638 2076 1 12 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.722 -0.161 19638 2077 1 12 . 1 1 35 35 ILE H H 35 7.068 7.068 7.804 -0.736 19638 2078 1 12 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.194 -0.282 19638 2079 1 12 . 1 1 36 36 PHE H H 36 7.901 7.901 7.663 0.237 19638 2080 1 12 . 1 1 37 37 GLY H H 37 8.766 8.766 8.905 -0.139 19638 2081 1 12 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.742 -0.127 19638 2082 1 12 . 1 1 38 38 ARG H H 38 7.962 7.962 7.625 0.337 19638 2083 1 12 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.823 0.239 19638 2084 1 12 . 1 1 39 39 HIS H H 39 8.064 8.064 8.612 -0.548 19638 2085 1 12 . 1 1 40 40 SER HA H 40 4.601 4.601 4.392 0.209 19638 2086 1 12 . 1 1 40 40 SER H H 40 8.588 8.588 8.404 0.184 19638 2087 1 12 . 1 1 41 41 GLY H H 41 8.930 8.930 8.633 0.297 19638 2088 1 12 . 1 1 42 42 GLN H H 42 7.865 7.865 7.892 -0.027 19638 2089 1 12 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.374 -0.038 19638 2090 1 12 . 1 1 43 43 ALA H H 43 8.062 8.062 8.248 -0.186 19638 2091 1 12 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.570 -0.395 19638 2092 1 12 . 1 1 44 44 GLU H H 44 8.924 8.924 8.573 0.351 19638 2093 1 12 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.552 -0.707 19638 2094 1 12 . 1 1 46 46 TYR H H 46 7.033 7.033 7.408 -0.375 19638 2095 1 12 . 1 1 47 47 SER HA H 47 4.283 4.283 4.364 -0.081 19638 2096 1 12 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.779 -0.537 19638 2097 1 12 . 1 1 48 48 TYR H H 48 7.905 7.905 8.482 -0.577 19638 2098 1 12 . 1 1 49 49 THR HA H 49 4.124 4.124 4.429 -0.305 19638 2099 1 12 . 1 1 49 49 THR H H 49 9.712 9.712 8.455 1.257 19638 2100 1 12 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.328 -0.067 19638 2101 1 12 . 1 1 50 50 ASP H H 50 8.682 8.682 8.972 -0.290 19638 2102 1 12 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.921 0.261 19638 2103 1 12 . 1 1 51 51 ALA H H 51 7.802 7.802 8.302 -0.500 19638 2104 1 12 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.663 0.024 19638 2105 1 12 . 1 1 52 52 ASN H H 52 8.422 8.422 7.822 0.600 19638 2106 1 12 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.749 -0.069 19638 2107 1 12 . 1 1 53 53 ILE H H 53 7.686 7.686 7.764 -0.078 19638 2108 1 12 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.034 -0.105 19638 2109 1 12 . 1 1 54 54 LYS H H 54 9.101 9.101 8.265 0.836 19638 2110 1 12 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.423 -0.387 19638 2111 1 12 . 1 1 55 55 LYS H H 55 7.355 7.355 8.036 -0.681 19638 2112 1 12 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.937 -0.612 19638 2113 1 12 . 1 1 56 56 ASN H H 56 7.506 7.506 8.595 -1.089 19638 2114 1 12 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.269 -0.078 19638 2115 1 12 . 1 1 57 57 VAL H H 57 7.341 7.341 8.412 -1.071 19638 2116 1 12 . 1 1 58 58 LEU HA H 58 3.798 3.798 3.335 0.463 19638 2117 1 12 . 1 1 58 58 LEU H H 58 8.220 8.220 7.972 0.248 19638 2118 1 12 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.590 0.525 19638 2119 1 12 . 1 1 59 59 TRP H H 59 7.973 7.973 9.055 -1.082 19638 2120 1 12 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.843 -0.106 19638 2121 1 12 . 1 1 60 60 ASP H H 60 10.093 10.093 8.281 1.812 19638 2122 1 12 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.097 -0.759 19638 2123 1 12 . 1 1 61 61 GLU H H 61 10.090 10.090 8.790 1.300 19638 2124 1 12 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.557 -0.101 19638 2125 1 12 . 1 1 62 62 ASN H H 62 8.211 8.211 8.338 -0.127 19638 2126 1 12 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.464 0.086 19638 2127 1 12 . 1 1 63 63 ASN H H 63 9.331 9.331 9.415 -0.084 19638 2128 1 12 . 1 1 64 64 MET HA H 64 4.321 4.321 4.328 -0.007 19638 2129 1 12 . 1 1 64 64 MET H H 64 8.702 8.702 8.644 0.058 19638 2130 1 12 . 1 1 65 65 SER HA H 65 3.445 3.445 4.253 -0.808 19638 2131 1 12 . 1 1 65 65 SER H H 65 7.442 7.442 7.755 -0.313 19638 2132 1 12 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.047 -0.190 19638 2133 1 12 . 1 1 66 66 GLU H H 66 7.574 7.574 7.641 -0.067 19638 2134 1 12 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.313 0.966 19638 2135 1 12 . 1 1 67 67 HIS H H 67 8.297 8.297 7.596 0.701 19638 2136 1 12 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.008 -0.652 19638 2137 1 12 . 1 1 68 68 LEU H H 68 8.060 8.060 7.571 0.489 19638 2138 1 12 . 1 1 69 69 THR HA H 69 3.792 3.792 4.075 -0.283 19638 2139 1 12 . 1 1 69 69 THR H H 69 7.327 7.327 7.677 -0.350 19638 2140 1 12 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.111 -0.084 19638 2141 1 12 . 1 1 70 70 ASN H H 70 6.715 6.715 7.532 -0.818 19638 2142 1 12 . 1 1 71 71 PRO HA H 71 5.961 5.961 3.999 1.962 19638 2143 1 12 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.104 1.021 19638 2144 1 12 . 1 1 72 72 ALA H H 72 9.052 9.052 7.946 1.106 19638 2145 1 12 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.102 0.467 19638 2146 1 12 . 1 1 73 73 LYS H H 73 7.914 7.914 8.038 -0.124 19638 2147 1 12 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.250 0.777 19638 2148 1 12 . 1 1 74 74 TYR H H 74 8.520 8.520 7.804 0.716 19638 2149 1 12 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.519 0.142 19638 2150 1 12 . 1 1 75 75 ILE H H 75 9.542 9.542 7.704 1.838 19638 2151 1 12 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.753 0.374 19638 2152 1 12 . 1 1 77 77 GLY H H 77 9.573 9.573 8.750 0.823 19638 2153 1 12 . 1 1 78 78 THR HA H 78 5.058 5.058 4.663 0.395 19638 2154 1 12 . 1 1 78 78 THR H H 78 9.274 9.274 7.788 1.486 19638 2155 1 12 . 1 1 79 79 LYS H H 79 8.060 8.060 8.440 -0.380 19638 2156 1 12 . 1 1 80 80 MET H H 80 8.670 8.670 7.909 0.761 19638 2157 1 12 . 1 1 81 81 ALA H H 81 8.060 8.060 8.584 -0.524 19638 2158 1 12 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.584 -0.022 19638 2159 1 12 . 1 1 82 82 PHE H H 82 8.446 8.446 7.747 0.699 19638 2160 1 12 . 1 1 83 83 GLY H H 83 7.142 7.142 7.827 -0.685 19638 2161 1 12 . 1 1 84 84 GLY H H 84 8.211 8.211 8.140 0.071 19638 2162 1 12 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.559 -0.304 19638 2163 1 12 . 1 1 85 85 LEU H H 85 8.160 8.160 7.953 0.207 19638 2164 1 12 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.293 -0.338 19638 2165 1 12 . 1 1 86 86 LYS H H 86 8.440 8.440 8.668 -0.228 19638 2166 1 12 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.447 -0.077 19638 2167 1 12 . 1 1 87 87 LYS H H 87 8.800 8.800 7.893 0.907 19638 2168 1 12 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.028 -0.602 19638 2169 1 12 . 1 1 88 88 GLU H H 88 8.971 8.971 8.928 0.043 19638 2170 1 12 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.966 -0.149 19638 2171 1 12 . 1 1 89 89 LYS H H 89 8.679 8.679 8.416 0.263 19638 2172 1 12 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.431 -0.390 19638 2173 1 12 . 1 1 90 90 ASP H H 90 6.295 6.295 8.415 -2.120 19638 2174 1 12 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.014 -0.733 19638 2175 1 12 . 1 1 91 91 ARG H H 91 7.285 7.285 7.692 -0.407 19638 2176 1 12 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.504 -0.699 19638 2177 1 12 . 1 1 92 92 ASN H H 92 8.541 8.541 8.264 0.277 19638 2178 1 12 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.593 -0.600 19638 2179 1 12 . 1 1 93 93 ASP H H 93 8.518 8.518 7.553 0.965 19638 2180 1 12 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.195 -0.417 19638 2181 1 12 . 1 1 94 94 LEU H H 94 8.167 8.167 7.607 0.560 19638 2182 1 12 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.764 -0.795 19638 2183 1 12 . 1 1 95 95 ILE H H 95 8.718 8.718 7.753 0.965 19638 2184 1 12 . 1 1 96 96 THR HA H 96 3.661 3.661 3.963 -0.302 19638 2185 1 12 . 1 1 96 96 THR H H 96 7.955 7.955 8.129 -0.174 19638 2186 1 12 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.054 -0.062 19638 2187 1 12 . 1 1 97 97 TYR H H 97 7.619 7.619 8.097 -0.478 19638 2188 1 12 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.651 -0.420 19638 2189 1 12 . 1 1 98 98 LEU H H 98 8.933 8.933 7.728 1.205 19638 2190 1 12 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.575 -0.083 19638 2191 1 12 . 1 1 99 99 LYS H H 99 8.454 8.454 7.663 0.791 19638 2192 1 12 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.872 0.222 19638 2193 1 12 . 1 1 100 100 LYS H H 100 6.501 6.501 7.782 -1.281 19638 2194 1 12 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.013 -0.058 19638 2195 1 12 . 1 1 101 101 ALA H H 101 8.296 8.296 7.277 1.019 19638 2196 1 12 . 1 1 102 102 THR H H 102 7.330 7.330 7.510 -0.180 19638 2197 1 13 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.657 -0.398 19638 2198 1 13 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.846 0.762 19638 2199 1 13 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.550 -0.757 19638 2200 1 13 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.587 -1.010 19638 2201 1 13 . 1 1 2 2 SER H H 2 9.424 9.424 8.456 0.968 19638 2202 1 13 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.406 -0.426 19638 2203 1 13 . 1 1 3 3 ALA H H 3 9.092 9.092 9.064 0.028 19638 2204 1 13 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.021 0.252 19638 2205 1 13 . 1 1 4 4 LYS H H 4 8.086 8.086 7.776 0.310 19638 2206 1 13 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.114 -0.064 19638 2207 1 13 . 1 1 5 5 LYS H H 5 7.755 7.755 7.764 -0.009 19638 2208 1 13 . 1 1 6 6 GLY H H 6 8.694 8.694 7.751 0.943 19638 2209 1 13 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.357 -1.011 19638 2210 1 13 . 1 1 7 7 ALA H H 7 7.999 7.999 8.608 -0.609 19638 2211 1 13 . 1 1 8 8 THR HA H 8 3.898 3.898 4.032 -0.134 19638 2212 1 13 . 1 1 8 8 THR H H 8 7.203 7.203 7.560 -0.357 19638 2213 1 13 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.117 -0.273 19638 2214 1 13 . 1 1 9 9 LEU H H 9 7.846 7.846 7.632 0.214 19638 2215 1 13 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.030 -0.527 19638 2216 1 13 . 1 1 10 10 PHE H H 10 8.651 8.651 8.496 0.155 19638 2217 1 13 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.947 0.276 19638 2218 1 13 . 1 1 11 11 LYS H H 11 8.365 8.365 7.856 0.509 19638 2219 1 13 . 1 1 12 12 THR HA H 12 4.361 4.361 4.158 0.203 19638 2220 1 13 . 1 1 12 12 THR H H 12 7.959 7.959 8.201 -0.242 19638 2221 1 13 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.601 -0.015 19638 2222 1 13 . 1 1 13 13 ARG H H 13 8.338 8.338 7.896 0.442 19638 2223 1 13 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.371 -3.457 19638 2224 1 13 . 1 1 14 14 CYS H H 14 8.047 8.047 8.333 -0.286 19638 2225 1 13 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.312 1.806 19638 2226 1 13 . 1 1 15 15 LEU H H 15 8.070 8.070 7.783 0.287 19638 2227 1 13 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.973 0.685 19638 2228 1 13 . 1 1 16 16 GLN H H 16 10.022 10.022 8.368 1.654 19638 2229 1 13 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.438 1.750 19638 2230 1 13 . 1 1 17 17 CYS H H 17 9.730 9.730 7.481 2.249 19638 2231 1 13 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.947 3.897 19638 2232 1 13 . 1 1 18 18 HIS H H 18 11.098 11.098 8.702 2.396 19638 2233 1 13 . 1 1 19 19 THR HA H 19 6.298 6.298 4.369 1.929 19638 2234 1 13 . 1 1 19 19 THR H H 19 10.180 10.180 8.907 1.273 19638 2235 1 13 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.946 1.058 19638 2236 1 13 . 1 1 20 20 VAL H H 20 8.927 8.927 8.341 0.586 19638 2237 1 13 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.425 0.194 19638 2238 1 13 . 1 1 21 21 GLU H H 21 9.460 9.460 7.459 2.001 19638 2239 1 13 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.003 -0.377 19638 2240 1 13 . 1 1 22 22 LYS H H 22 9.064 9.064 8.164 0.900 19638 2241 1 13 . 1 1 23 23 GLY H H 23 9.543 9.543 8.330 1.213 19638 2242 1 13 . 1 1 24 24 GLY H H 24 8.296 8.296 7.851 0.445 19638 2243 1 13 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.290 0.207 19638 2244 1 13 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.889 0.386 19638 2245 1 13 . 1 1 26 26 HIS H H 26 8.931 8.931 8.340 0.591 19638 2246 1 13 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.506 0.164 19638 2247 1 13 . 1 1 27 27 LYS H H 27 8.362 8.362 8.210 0.152 19638 2248 1 13 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.592 -0.456 19638 2249 1 13 . 1 1 28 28 VAL H H 28 7.720 7.720 8.752 -1.032 19638 2250 1 13 . 1 1 29 29 GLY H H 29 7.705 7.705 7.927 -0.222 19638 2251 1 13 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.300 -0.182 19638 2252 1 13 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.879 1.038 19638 2253 1 13 . 1 1 31 31 ASN H H 31 11.993 11.993 8.395 3.599 19638 2254 1 13 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.540 -0.080 19638 2255 1 13 . 1 1 32 32 LEU H H 32 9.445 9.445 8.366 1.079 19638 2256 1 13 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.639 -0.533 19638 2257 1 13 . 1 1 33 33 HIS H H 33 8.051 8.051 8.597 -0.546 19638 2258 1 13 . 1 1 34 34 GLY H H 34 9.066 9.066 8.696 0.370 19638 2259 1 13 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.863 -0.302 19638 2260 1 13 . 1 1 35 35 ILE H H 35 7.068 7.068 7.884 -0.816 19638 2261 1 13 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.404 -0.492 19638 2262 1 13 . 1 1 36 36 PHE H H 36 7.901 7.901 7.711 0.190 19638 2263 1 13 . 1 1 37 37 GLY H H 37 8.766 8.766 9.282 -0.516 19638 2264 1 13 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.545 0.070 19638 2265 1 13 . 1 1 38 38 ARG H H 38 7.962 7.962 7.525 0.437 19638 2266 1 13 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.891 0.171 19638 2267 1 13 . 1 1 39 39 HIS H H 39 8.064 8.064 8.726 -0.662 19638 2268 1 13 . 1 1 40 40 SER HA H 40 4.601 4.601 4.179 0.422 19638 2269 1 13 . 1 1 40 40 SER H H 40 8.588 8.588 8.489 0.099 19638 2270 1 13 . 1 1 41 41 GLY H H 41 8.930 8.930 8.054 0.876 19638 2271 1 13 . 1 1 42 42 GLN H H 42 7.865 7.865 8.123 -0.258 19638 2272 1 13 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.445 -0.109 19638 2273 1 13 . 1 1 43 43 ALA H H 43 8.062 8.062 7.980 0.082 19638 2274 1 13 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.172 0.003 19638 2275 1 13 . 1 1 44 44 GLU H H 44 8.924 8.924 8.593 0.331 19638 2276 1 13 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.366 -0.521 19638 2277 1 13 . 1 1 46 46 TYR H H 46 7.033 7.033 7.077 -0.044 19638 2278 1 13 . 1 1 47 47 SER HA H 47 4.283 4.283 4.258 0.025 19638 2279 1 13 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.696 -0.454 19638 2280 1 13 . 1 1 48 48 TYR H H 48 7.905 7.905 8.384 -0.479 19638 2281 1 13 . 1 1 49 49 THR HA H 49 4.124 4.124 4.360 -0.236 19638 2282 1 13 . 1 1 49 49 THR H H 49 9.712 9.712 8.515 1.197 19638 2283 1 13 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.270 -0.009 19638 2284 1 13 . 1 1 50 50 ASP H H 50 8.682 8.682 8.908 -0.226 19638 2285 1 13 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.969 0.213 19638 2286 1 13 . 1 1 51 51 ALA H H 51 7.802 7.802 8.111 -0.309 19638 2287 1 13 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.490 0.197 19638 2288 1 13 . 1 1 52 52 ASN H H 52 8.422 8.422 7.841 0.581 19638 2289 1 13 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.599 0.081 19638 2290 1 13 . 1 1 53 53 ILE H H 53 7.686 7.686 7.760 -0.074 19638 2291 1 13 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.073 -0.144 19638 2292 1 13 . 1 1 54 54 LYS H H 54 9.101 9.101 8.445 0.656 19638 2293 1 13 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.332 -0.296 19638 2294 1 13 . 1 1 55 55 LYS H H 55 7.355 7.355 8.142 -0.787 19638 2295 1 13 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.490 -0.165 19638 2296 1 13 . 1 1 56 56 ASN H H 56 7.506 7.506 7.565 -0.059 19638 2297 1 13 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.119 0.072 19638 2298 1 13 . 1 1 57 57 VAL H H 57 7.341 7.341 7.942 -0.601 19638 2299 1 13 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.114 -0.316 19638 2300 1 13 . 1 1 58 58 LEU H H 58 8.220 8.220 8.158 0.062 19638 2301 1 13 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.593 0.522 19638 2302 1 13 . 1 1 59 59 TRP H H 59 7.973 7.973 8.820 -0.847 19638 2303 1 13 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.920 -0.183 19638 2304 1 13 . 1 1 60 60 ASP H H 60 10.093 10.093 8.342 1.751 19638 2305 1 13 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.191 -0.853 19638 2306 1 13 . 1 1 61 61 GLU H H 61 10.090 10.090 8.854 1.236 19638 2307 1 13 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.534 -0.078 19638 2308 1 13 . 1 1 62 62 ASN H H 62 8.211 8.211 8.520 -0.309 19638 2309 1 13 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.470 0.080 19638 2310 1 13 . 1 1 63 63 ASN H H 63 9.331 9.331 9.336 -0.005 19638 2311 1 13 . 1 1 64 64 MET HA H 64 4.321 4.321 4.366 -0.045 19638 2312 1 13 . 1 1 64 64 MET H H 64 8.702 8.702 8.655 0.047 19638 2313 1 13 . 1 1 65 65 SER HA H 65 3.445 3.445 4.159 -0.714 19638 2314 1 13 . 1 1 65 65 SER H H 65 7.442 7.442 7.821 -0.379 19638 2315 1 13 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.096 -0.239 19638 2316 1 13 . 1 1 66 66 GLU H H 66 7.574 7.574 7.959 -0.385 19638 2317 1 13 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.800 0.479 19638 2318 1 13 . 1 1 67 67 HIS H H 67 8.297 8.297 7.310 0.987 19638 2319 1 13 . 1 1 68 68 LEU HA H 68 3.356 3.356 3.976 -0.620 19638 2320 1 13 . 1 1 68 68 LEU H H 68 8.060 8.060 7.617 0.443 19638 2321 1 13 . 1 1 69 69 THR HA H 69 3.792 3.792 4.336 -0.544 19638 2322 1 13 . 1 1 69 69 THR H H 69 7.327 7.327 7.157 0.170 19638 2323 1 13 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.395 0.632 19638 2324 1 13 . 1 1 70 70 ASN H H 70 6.715 6.715 8.825 -2.110 19638 2325 1 13 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.240 1.721 19638 2326 1 13 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.093 1.032 19638 2327 1 13 . 1 1 72 72 ALA H H 72 9.052 9.052 8.621 0.431 19638 2328 1 13 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.095 0.474 19638 2329 1 13 . 1 1 73 73 LYS H H 73 7.914 7.914 8.182 -0.268 19638 2330 1 13 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.280 0.747 19638 2331 1 13 . 1 1 74 74 TYR H H 74 8.520 8.520 7.441 1.079 19638 2332 1 13 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.516 0.145 19638 2333 1 13 . 1 1 75 75 ILE H H 75 9.542 9.542 8.097 1.445 19638 2334 1 13 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.737 0.390 19638 2335 1 13 . 1 1 77 77 GLY H H 77 9.573 9.573 8.561 1.012 19638 2336 1 13 . 1 1 78 78 THR HA H 78 5.058 5.058 4.519 0.539 19638 2337 1 13 . 1 1 78 78 THR H H 78 9.274 9.274 7.333 1.941 19638 2338 1 13 . 1 1 79 79 LYS H H 79 8.060 8.060 8.595 -0.535 19638 2339 1 13 . 1 1 80 80 MET H H 80 8.670 8.670 7.451 1.219 19638 2340 1 13 . 1 1 81 81 ALA H H 81 8.060 8.060 8.481 -0.421 19638 2341 1 13 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.766 -0.204 19638 2342 1 13 . 1 1 82 82 PHE H H 82 8.446 8.446 8.134 0.312 19638 2343 1 13 . 1 1 83 83 GLY H H 83 7.142 7.142 7.633 -0.491 19638 2344 1 13 . 1 1 84 84 GLY H H 84 8.211 8.211 8.109 0.102 19638 2345 1 13 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.424 -0.169 19638 2346 1 13 . 1 1 85 85 LEU H H 85 8.160 8.160 8.486 -0.326 19638 2347 1 13 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.096 -0.141 19638 2348 1 13 . 1 1 86 86 LYS H H 86 8.440 8.440 8.594 -0.154 19638 2349 1 13 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.395 -0.025 19638 2350 1 13 . 1 1 87 87 LYS H H 87 8.800 8.800 8.102 0.698 19638 2351 1 13 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.039 -0.613 19638 2352 1 13 . 1 1 88 88 GLU H H 88 8.971 8.971 9.051 -0.080 19638 2353 1 13 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.962 -0.145 19638 2354 1 13 . 1 1 89 89 LYS H H 89 8.679 8.679 8.274 0.405 19638 2355 1 13 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.427 -0.386 19638 2356 1 13 . 1 1 90 90 ASP H H 90 6.295 6.295 8.429 -2.134 19638 2357 1 13 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.001 -0.720 19638 2358 1 13 . 1 1 91 91 ARG H H 91 7.285 7.285 7.507 -0.222 19638 2359 1 13 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.486 -0.681 19638 2360 1 13 . 1 1 92 92 ASN H H 92 8.541 8.541 7.966 0.575 19638 2361 1 13 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.440 -0.447 19638 2362 1 13 . 1 1 93 93 ASP H H 93 8.518 8.518 7.685 0.833 19638 2363 1 13 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.170 -0.392 19638 2364 1 13 . 1 1 94 94 LEU H H 94 8.167 8.167 7.523 0.644 19638 2365 1 13 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.751 -0.782 19638 2366 1 13 . 1 1 95 95 ILE H H 95 8.718 8.718 7.784 0.934 19638 2367 1 13 . 1 1 96 96 THR HA H 96 3.661 3.661 3.886 -0.225 19638 2368 1 13 . 1 1 96 96 THR H H 96 7.955 7.955 7.969 -0.014 19638 2369 1 13 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.086 -0.094 19638 2370 1 13 . 1 1 97 97 TYR H H 97 7.619 7.619 7.862 -0.243 19638 2371 1 13 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.642 -0.411 19638 2372 1 13 . 1 1 98 98 LEU H H 98 8.933 8.933 7.673 1.260 19638 2373 1 13 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.443 0.049 19638 2374 1 13 . 1 1 99 99 LYS H H 99 8.454 8.454 7.883 0.571 19638 2375 1 13 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.885 0.209 19638 2376 1 13 . 1 1 100 100 LYS H H 100 6.501 6.501 7.504 -1.003 19638 2377 1 13 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.039 -0.084 19638 2378 1 13 . 1 1 101 101 ALA H H 101 8.296 8.296 7.407 0.889 19638 2379 1 13 . 1 1 102 102 THR H H 102 7.330 7.330 7.653 -0.323 19638 2380 1 14 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.908 -0.649 19638 2381 1 14 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.315 0.293 19638 2382 1 14 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.211 -0.418 19638 2383 1 14 . 1 1 -2 -2 LYS H H -2 6.577 6.577 8.638 -2.061 19638 2384 1 14 . 1 1 2 2 SER H H 2 9.424 9.424 8.445 0.979 19638 2385 1 14 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.741 -0.761 19638 2386 1 14 . 1 1 3 3 ALA H H 3 9.092 9.092 8.835 0.257 19638 2387 1 14 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.046 0.227 19638 2388 1 14 . 1 1 4 4 LYS H H 4 8.086 8.086 8.452 -0.366 19638 2389 1 14 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.129 -0.079 19638 2390 1 14 . 1 1 5 5 LYS H H 5 7.755 7.755 7.561 0.194 19638 2391 1 14 . 1 1 6 6 GLY H H 6 8.694 8.694 8.171 0.523 19638 2392 1 14 . 1 1 7 7 ALA HA H 7 2.346 2.346 2.937 -0.591 19638 2393 1 14 . 1 1 7 7 ALA H H 7 7.999 7.999 8.410 -0.411 19638 2394 1 14 . 1 1 8 8 THR HA H 8 3.898 3.898 3.999 -0.101 19638 2395 1 14 . 1 1 8 8 THR H H 8 7.203 7.203 7.505 -0.302 19638 2396 1 14 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.082 -0.238 19638 2397 1 14 . 1 1 9 9 LEU H H 9 7.846 7.846 7.875 -0.029 19638 2398 1 14 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.055 -0.552 19638 2399 1 14 . 1 1 10 10 PHE H H 10 8.651 8.651 8.510 0.141 19638 2400 1 14 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.966 0.257 19638 2401 1 14 . 1 1 11 11 LYS H H 11 8.365 8.365 7.974 0.391 19638 2402 1 14 . 1 1 12 12 THR HA H 12 4.361 4.361 4.144 0.217 19638 2403 1 14 . 1 1 12 12 THR H H 12 7.959 7.959 8.181 -0.222 19638 2404 1 14 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.562 0.024 19638 2405 1 14 . 1 1 13 13 ARG H H 13 8.338 8.338 7.869 0.469 19638 2406 1 14 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.375 -3.461 19638 2407 1 14 . 1 1 14 14 CYS H H 14 8.047 8.047 8.168 -0.121 19638 2408 1 14 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.390 1.728 19638 2409 1 14 . 1 1 15 15 LEU H H 15 8.070 8.070 7.693 0.377 19638 2410 1 14 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.950 0.708 19638 2411 1 14 . 1 1 16 16 GLN H H 16 10.022 10.022 8.379 1.643 19638 2412 1 14 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.408 1.780 19638 2413 1 14 . 1 1 17 17 CYS H H 17 9.730 9.730 7.427 2.303 19638 2414 1 14 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.862 3.982 19638 2415 1 14 . 1 1 18 18 HIS H H 18 11.098 11.098 8.691 2.407 19638 2416 1 14 . 1 1 19 19 THR HA H 19 6.298 6.298 4.351 1.947 19638 2417 1 14 . 1 1 19 19 THR H H 19 10.180 10.180 8.670 1.510 19638 2418 1 14 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.976 1.028 19638 2419 1 14 . 1 1 20 20 VAL H H 20 8.927 8.927 8.161 0.766 19638 2420 1 14 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.604 0.015 19638 2421 1 14 . 1 1 21 21 GLU H H 21 9.460 9.460 8.185 1.275 19638 2422 1 14 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.608 0.018 19638 2423 1 14 . 1 1 22 22 LYS H H 22 9.064 9.064 8.550 0.514 19638 2424 1 14 . 1 1 23 23 GLY H H 23 9.543 9.543 8.135 1.408 19638 2425 1 14 . 1 1 24 24 GLY H H 24 8.296 8.296 7.709 0.587 19638 2426 1 14 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.303 0.194 19638 2427 1 14 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.785 0.490 19638 2428 1 14 . 1 1 26 26 HIS H H 26 8.931 8.931 8.476 0.455 19638 2429 1 14 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.521 0.149 19638 2430 1 14 . 1 1 27 27 LYS H H 27 8.362 8.362 7.896 0.466 19638 2431 1 14 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.882 -0.746 19638 2432 1 14 . 1 1 28 28 VAL H H 28 7.720 7.720 8.097 -0.377 19638 2433 1 14 . 1 1 29 29 GLY H H 29 7.705 7.705 7.239 0.466 19638 2434 1 14 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.378 -0.260 19638 2435 1 14 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.797 1.120 19638 2436 1 14 . 1 1 31 31 ASN H H 31 11.993 11.993 8.337 3.656 19638 2437 1 14 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.526 -0.066 19638 2438 1 14 . 1 1 32 32 LEU H H 32 9.445 9.445 8.350 1.095 19638 2439 1 14 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.722 -0.616 19638 2440 1 14 . 1 1 33 33 HIS H H 33 8.051 8.051 8.667 -0.616 19638 2441 1 14 . 1 1 34 34 GLY H H 34 9.066 9.066 8.618 0.448 19638 2442 1 14 . 1 1 35 35 ILE HA H 35 3.561 3.561 4.046 -0.485 19638 2443 1 14 . 1 1 35 35 ILE H H 35 7.068 7.068 8.036 -0.968 19638 2444 1 14 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.361 -0.449 19638 2445 1 14 . 1 1 36 36 PHE H H 36 7.901 7.901 7.753 0.148 19638 2446 1 14 . 1 1 37 37 GLY H H 37 8.766 8.766 9.212 -0.446 19638 2447 1 14 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.591 0.024 19638 2448 1 14 . 1 1 38 38 ARG H H 38 7.962 7.962 7.657 0.305 19638 2449 1 14 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.952 0.110 19638 2450 1 14 . 1 1 39 39 HIS H H 39 8.064 8.064 8.751 -0.687 19638 2451 1 14 . 1 1 40 40 SER HA H 40 4.601 4.601 4.504 0.097 19638 2452 1 14 . 1 1 40 40 SER H H 40 8.588 8.588 8.119 0.469 19638 2453 1 14 . 1 1 41 41 GLY H H 41 8.930 8.930 8.879 0.051 19638 2454 1 14 . 1 1 42 42 GLN H H 42 7.865 7.865 7.882 -0.017 19638 2455 1 14 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.237 0.099 19638 2456 1 14 . 1 1 43 43 ALA H H 43 8.062 8.062 8.512 -0.450 19638 2457 1 14 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.117 0.058 19638 2458 1 14 . 1 1 44 44 GLU H H 44 8.924 8.924 7.860 1.064 19638 2459 1 14 . 1 1 46 46 TYR HA H 46 3.845 3.845 3.886 -0.041 19638 2460 1 14 . 1 1 46 46 TYR H H 46 7.033 7.033 8.232 -1.199 19638 2461 1 14 . 1 1 47 47 SER HA H 47 4.283 4.283 4.423 -0.140 19638 2462 1 14 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.861 -0.619 19638 2463 1 14 . 1 1 48 48 TYR H H 48 7.905 7.905 8.659 -0.754 19638 2464 1 14 . 1 1 49 49 THR HA H 49 4.124 4.124 4.446 -0.322 19638 2465 1 14 . 1 1 49 49 THR H H 49 9.712 9.712 8.412 1.300 19638 2466 1 14 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.302 -0.041 19638 2467 1 14 . 1 1 50 50 ASP H H 50 8.682 8.682 8.982 -0.300 19638 2468 1 14 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.900 0.282 19638 2469 1 14 . 1 1 51 51 ALA H H 51 7.802 7.802 8.227 -0.425 19638 2470 1 14 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.618 0.069 19638 2471 1 14 . 1 1 52 52 ASN H H 52 8.422 8.422 7.845 0.577 19638 2472 1 14 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.681 -0.001 19638 2473 1 14 . 1 1 53 53 ILE H H 53 7.686 7.686 7.828 -0.142 19638 2474 1 14 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.081 -0.152 19638 2475 1 14 . 1 1 54 54 LYS H H 54 9.101 9.101 8.187 0.914 19638 2476 1 14 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.350 -0.314 19638 2477 1 14 . 1 1 55 55 LYS H H 55 7.355 7.355 8.076 -0.721 19638 2478 1 14 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.725 -0.400 19638 2479 1 14 . 1 1 56 56 ASN H H 56 7.506 7.506 8.523 -1.017 19638 2480 1 14 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.109 0.082 19638 2481 1 14 . 1 1 57 57 VAL H H 57 7.341 7.341 8.267 -0.926 19638 2482 1 14 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.128 -0.330 19638 2483 1 14 . 1 1 58 58 LEU H H 58 8.220 8.220 8.147 0.073 19638 2484 1 14 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.577 0.538 19638 2485 1 14 . 1 1 59 59 TRP H H 59 7.973 7.973 8.982 -1.009 19638 2486 1 14 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.948 -0.211 19638 2487 1 14 . 1 1 60 60 ASP H H 60 10.093 10.093 8.356 1.737 19638 2488 1 14 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.255 -0.917 19638 2489 1 14 . 1 1 61 61 GLU H H 61 10.090 10.090 8.916 1.174 19638 2490 1 14 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.592 -0.136 19638 2491 1 14 . 1 1 62 62 ASN H H 62 8.211 8.211 8.497 -0.286 19638 2492 1 14 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.513 0.037 19638 2493 1 14 . 1 1 63 63 ASN H H 63 9.331 9.331 8.415 0.916 19638 2494 1 14 . 1 1 64 64 MET HA H 64 4.321 4.321 4.182 0.139 19638 2495 1 14 . 1 1 64 64 MET H H 64 8.702 8.702 8.825 -0.123 19638 2496 1 14 . 1 1 65 65 SER HA H 65 3.445 3.445 4.106 -0.661 19638 2497 1 14 . 1 1 65 65 SER H H 65 7.442 7.442 7.927 -0.485 19638 2498 1 14 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.154 -0.297 19638 2499 1 14 . 1 1 66 66 GLU H H 66 7.574 7.574 7.718 -0.144 19638 2500 1 14 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.886 0.393 19638 2501 1 14 . 1 1 67 67 HIS H H 67 8.297 8.297 7.818 0.479 19638 2502 1 14 . 1 1 68 68 LEU HA H 68 3.356 3.356 3.911 -0.555 19638 2503 1 14 . 1 1 68 68 LEU H H 68 8.060 8.060 7.931 0.129 19638 2504 1 14 . 1 1 69 69 THR HA H 69 3.792 3.792 4.039 -0.247 19638 2505 1 14 . 1 1 69 69 THR H H 69 7.327 7.327 7.493 -0.166 19638 2506 1 14 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.101 -0.074 19638 2507 1 14 . 1 1 70 70 ASN H H 70 6.715 6.715 7.502 -0.787 19638 2508 1 14 . 1 1 71 71 PRO HA H 71 5.961 5.961 3.950 2.011 19638 2509 1 14 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.028 1.097 19638 2510 1 14 . 1 1 72 72 ALA H H 72 9.052 9.052 8.533 0.519 19638 2511 1 14 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.040 0.529 19638 2512 1 14 . 1 1 73 73 LYS H H 73 7.914 7.914 7.954 -0.040 19638 2513 1 14 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.253 0.774 19638 2514 1 14 . 1 1 74 74 TYR H H 74 8.520 8.520 7.650 0.870 19638 2515 1 14 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.780 -0.119 19638 2516 1 14 . 1 1 75 75 ILE H H 75 9.542 9.542 8.001 1.541 19638 2517 1 14 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.503 0.624 19638 2518 1 14 . 1 1 77 77 GLY H H 77 9.573 9.573 8.695 0.878 19638 2519 1 14 . 1 1 78 78 THR HA H 78 5.058 5.058 4.578 0.480 19638 2520 1 14 . 1 1 78 78 THR H H 78 9.274 9.274 7.574 1.700 19638 2521 1 14 . 1 1 79 79 LYS H H 79 8.060 8.060 8.526 -0.466 19638 2522 1 14 . 1 1 80 80 MET H H 80 8.670 8.670 7.489 1.181 19638 2523 1 14 . 1 1 81 81 ALA H H 81 8.060 8.060 8.574 -0.514 19638 2524 1 14 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.581 -0.019 19638 2525 1 14 . 1 1 82 82 PHE H H 82 8.446 8.446 8.349 0.097 19638 2526 1 14 . 1 1 83 83 GLY H H 83 7.142 7.142 7.735 -0.593 19638 2527 1 14 . 1 1 84 84 GLY H H 84 8.211 8.211 8.135 0.076 19638 2528 1 14 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.551 -0.296 19638 2529 1 14 . 1 1 85 85 LEU H H 85 8.160 8.160 7.889 0.271 19638 2530 1 14 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.282 -0.327 19638 2531 1 14 . 1 1 86 86 LYS H H 86 8.440 8.440 8.700 -0.260 19638 2532 1 14 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.493 -0.123 19638 2533 1 14 . 1 1 87 87 LYS H H 87 8.800 8.800 7.799 1.001 19638 2534 1 14 . 1 1 88 88 GLU HA H 88 3.426 3.426 3.964 -0.538 19638 2535 1 14 . 1 1 88 88 GLU H H 88 8.971 8.971 9.150 -0.179 19638 2536 1 14 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.005 -0.188 19638 2537 1 14 . 1 1 89 89 LYS H H 89 8.679 8.679 8.278 0.401 19638 2538 1 14 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.409 -0.368 19638 2539 1 14 . 1 1 90 90 ASP H H 90 6.295 6.295 8.414 -2.119 19638 2540 1 14 . 1 1 91 91 ARG HA H 91 3.281 3.281 3.940 -0.659 19638 2541 1 14 . 1 1 91 91 ARG H H 91 7.285 7.285 7.748 -0.463 19638 2542 1 14 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.000 -0.195 19638 2543 1 14 . 1 1 92 92 ASN H H 92 8.541 8.541 8.361 0.180 19638 2544 1 14 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.553 -0.560 19638 2545 1 14 . 1 1 93 93 ASP H H 93 8.518 8.518 7.525 0.993 19638 2546 1 14 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.144 -0.366 19638 2547 1 14 . 1 1 94 94 LEU H H 94 8.167 8.167 7.444 0.723 19638 2548 1 14 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.741 -0.772 19638 2549 1 14 . 1 1 95 95 ILE H H 95 8.718 8.718 7.426 1.292 19638 2550 1 14 . 1 1 96 96 THR HA H 96 3.661 3.661 3.980 -0.319 19638 2551 1 14 . 1 1 96 96 THR H H 96 7.955 7.955 7.978 -0.023 19638 2552 1 14 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.067 -0.075 19638 2553 1 14 . 1 1 97 97 TYR H H 97 7.619 7.619 8.081 -0.462 19638 2554 1 14 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.697 -0.466 19638 2555 1 14 . 1 1 98 98 LEU H H 98 8.933 8.933 7.707 1.226 19638 2556 1 14 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.096 0.396 19638 2557 1 14 . 1 1 99 99 LYS H H 99 8.454 8.454 8.229 0.225 19638 2558 1 14 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.889 0.205 19638 2559 1 14 . 1 1 100 100 LYS H H 100 6.501 6.501 7.685 -1.184 19638 2560 1 14 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.072 -0.117 19638 2561 1 14 . 1 1 101 101 ALA H H 101 8.296 8.296 7.483 0.813 19638 2562 1 14 . 1 1 102 102 THR H H 102 7.330 7.330 7.490 -0.160 19638 2563 1 15 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.521 -0.262 19638 2564 1 15 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.520 0.088 19638 2565 1 15 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.267 -0.474 19638 2566 1 15 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.928 -1.351 19638 2567 1 15 . 1 1 2 2 SER H H 2 9.424 9.424 8.167 1.257 19638 2568 1 15 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.962 -0.982 19638 2569 1 15 . 1 1 3 3 ALA H H 3 9.092 9.092 8.631 0.461 19638 2570 1 15 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.341 -0.068 19638 2571 1 15 . 1 1 4 4 LYS H H 4 8.086 8.086 8.168 -0.082 19638 2572 1 15 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.161 -0.111 19638 2573 1 15 . 1 1 5 5 LYS H H 5 7.755 7.755 8.034 -0.279 19638 2574 1 15 . 1 1 6 6 GLY H H 6 8.694 8.694 8.924 -0.230 19638 2575 1 15 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.144 -0.798 19638 2576 1 15 . 1 1 7 7 ALA H H 7 7.999 7.999 8.147 -0.148 19638 2577 1 15 . 1 1 8 8 THR HA H 8 3.898 3.898 4.025 -0.127 19638 2578 1 15 . 1 1 8 8 THR H H 8 7.203 7.203 7.684 -0.481 19638 2579 1 15 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.090 -0.246 19638 2580 1 15 . 1 1 9 9 LEU H H 9 7.846 7.846 8.697 -0.851 19638 2581 1 15 . 1 1 10 10 PHE HA H 10 3.503 3.503 3.969 -0.466 19638 2582 1 15 . 1 1 10 10 PHE H H 10 8.651 8.651 8.137 0.514 19638 2583 1 15 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.944 0.279 19638 2584 1 15 . 1 1 11 11 LYS H H 11 8.365 8.365 7.655 0.710 19638 2585 1 15 . 1 1 12 12 THR HA H 12 4.361 4.361 4.149 0.212 19638 2586 1 15 . 1 1 12 12 THR H H 12 7.959 7.959 8.209 -0.250 19638 2587 1 15 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.594 -0.008 19638 2588 1 15 . 1 1 13 13 ARG H H 13 8.338 8.338 7.850 0.488 19638 2589 1 15 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.258 -3.344 19638 2590 1 15 . 1 1 14 14 CYS H H 14 8.047 8.047 8.327 -0.280 19638 2591 1 15 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.254 1.864 19638 2592 1 15 . 1 1 15 15 LEU H H 15 8.070 8.070 7.830 0.240 19638 2593 1 15 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.979 0.679 19638 2594 1 15 . 1 1 16 16 GLN H H 16 10.022 10.022 8.389 1.633 19638 2595 1 15 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.410 1.778 19638 2596 1 15 . 1 1 17 17 CYS H H 17 9.730 9.730 7.350 2.380 19638 2597 1 15 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.870 3.974 19638 2598 1 15 . 1 1 18 18 HIS H H 18 11.098 11.098 8.554 2.544 19638 2599 1 15 . 1 1 19 19 THR HA H 19 6.298 6.298 4.420 1.878 19638 2600 1 15 . 1 1 19 19 THR H H 19 10.180 10.180 8.588 1.592 19638 2601 1 15 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.959 1.045 19638 2602 1 15 . 1 1 20 20 VAL H H 20 8.927 8.927 8.108 0.819 19638 2603 1 15 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.417 0.202 19638 2604 1 15 . 1 1 21 21 GLU H H 21 9.460 9.460 7.319 2.141 19638 2605 1 15 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.938 -0.312 19638 2606 1 15 . 1 1 22 22 LYS H H 22 9.064 9.064 8.422 0.642 19638 2607 1 15 . 1 1 23 23 GLY H H 23 9.543 9.543 8.216 1.327 19638 2608 1 15 . 1 1 24 24 GLY H H 24 8.296 8.296 7.727 0.569 19638 2609 1 15 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.187 0.310 19638 2610 1 15 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.345 0.930 19638 2611 1 15 . 1 1 26 26 HIS H H 26 8.931 8.931 8.196 0.735 19638 2612 1 15 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.243 0.427 19638 2613 1 15 . 1 1 27 27 LYS H H 27 8.362 8.362 8.227 0.135 19638 2614 1 15 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.823 -0.687 19638 2615 1 15 . 1 1 28 28 VAL H H 28 7.720 7.720 8.408 -0.688 19638 2616 1 15 . 1 1 29 29 GLY H H 29 7.705 7.705 7.262 0.443 19638 2617 1 15 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.301 -0.183 19638 2618 1 15 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.742 1.175 19638 2619 1 15 . 1 1 31 31 ASN H H 31 11.993 11.993 8.576 3.417 19638 2620 1 15 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.542 -0.082 19638 2621 1 15 . 1 1 32 32 LEU H H 32 9.445 9.445 8.677 0.768 19638 2622 1 15 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.640 -0.534 19638 2623 1 15 . 1 1 33 33 HIS H H 33 8.051 8.051 8.345 -0.294 19638 2624 1 15 . 1 1 34 34 GLY H H 34 9.066 9.066 8.655 0.411 19638 2625 1 15 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.712 -0.151 19638 2626 1 15 . 1 1 35 35 ILE H H 35 7.068 7.068 7.731 -0.663 19638 2627 1 15 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.312 -0.400 19638 2628 1 15 . 1 1 36 36 PHE H H 36 7.901 7.901 7.591 0.310 19638 2629 1 15 . 1 1 37 37 GLY H H 37 8.766 8.766 9.106 -0.340 19638 2630 1 15 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.504 0.111 19638 2631 1 15 . 1 1 38 38 ARG H H 38 7.962 7.962 7.513 0.449 19638 2632 1 15 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.028 0.034 19638 2633 1 15 . 1 1 39 39 HIS H H 39 8.064 8.064 8.722 -0.658 19638 2634 1 15 . 1 1 40 40 SER HA H 40 4.601 4.601 4.334 0.267 19638 2635 1 15 . 1 1 40 40 SER H H 40 8.588 8.588 8.349 0.239 19638 2636 1 15 . 1 1 41 41 GLY H H 41 8.930 8.930 7.930 1.000 19638 2637 1 15 . 1 1 42 42 GLN H H 42 7.865 7.865 8.196 -0.331 19638 2638 1 15 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.465 -0.129 19638 2639 1 15 . 1 1 43 43 ALA H H 43 8.062 8.062 8.396 -0.334 19638 2640 1 15 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.138 0.037 19638 2641 1 15 . 1 1 44 44 GLU H H 44 8.924 8.924 8.537 0.387 19638 2642 1 15 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.562 -0.717 19638 2643 1 15 . 1 1 46 46 TYR H H 46 7.033 7.033 7.386 -0.353 19638 2644 1 15 . 1 1 47 47 SER HA H 47 4.283 4.283 4.332 -0.049 19638 2645 1 15 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.819 -0.577 19638 2646 1 15 . 1 1 48 48 TYR H H 48 7.905 7.905 8.386 -0.481 19638 2647 1 15 . 1 1 49 49 THR HA H 49 4.124 4.124 4.414 -0.290 19638 2648 1 15 . 1 1 49 49 THR H H 49 9.712 9.712 8.423 1.289 19638 2649 1 15 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.322 -0.061 19638 2650 1 15 . 1 1 50 50 ASP H H 50 8.682 8.682 9.033 -0.351 19638 2651 1 15 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.932 0.250 19638 2652 1 15 . 1 1 51 51 ALA H H 51 7.802 7.802 8.288 -0.486 19638 2653 1 15 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.553 0.134 19638 2654 1 15 . 1 1 52 52 ASN H H 52 8.422 8.422 7.901 0.521 19638 2655 1 15 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.631 0.049 19638 2656 1 15 . 1 1 53 53 ILE H H 53 7.686 7.686 7.855 -0.169 19638 2657 1 15 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.089 -0.160 19638 2658 1 15 . 1 1 54 54 LYS H H 54 9.101 9.101 8.488 0.613 19638 2659 1 15 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.411 -0.375 19638 2660 1 15 . 1 1 55 55 LYS H H 55 7.355 7.355 7.920 -0.565 19638 2661 1 15 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.428 -0.103 19638 2662 1 15 . 1 1 56 56 ASN H H 56 7.506 7.506 7.632 -0.126 19638 2663 1 15 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.228 -0.037 19638 2664 1 15 . 1 1 57 57 VAL H H 57 7.341 7.341 7.635 -0.294 19638 2665 1 15 . 1 1 58 58 LEU HA H 58 3.798 3.798 3.885 -0.087 19638 2666 1 15 . 1 1 58 58 LEU H H 58 8.220 8.220 8.153 0.067 19638 2667 1 15 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.555 0.560 19638 2668 1 15 . 1 1 59 59 TRP H H 59 7.973 7.973 8.964 -0.991 19638 2669 1 15 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.930 -0.193 19638 2670 1 15 . 1 1 60 60 ASP H H 60 10.093 10.093 8.421 1.672 19638 2671 1 15 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.225 -0.887 19638 2672 1 15 . 1 1 61 61 GLU H H 61 10.090 10.090 8.840 1.250 19638 2673 1 15 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.594 -0.138 19638 2674 1 15 . 1 1 62 62 ASN H H 62 8.211 8.211 8.461 -0.250 19638 2675 1 15 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.561 -0.011 19638 2676 1 15 . 1 1 63 63 ASN H H 63 9.331 9.331 8.466 0.865 19638 2677 1 15 . 1 1 64 64 MET HA H 64 4.321 4.321 4.171 0.150 19638 2678 1 15 . 1 1 64 64 MET H H 64 8.702 8.702 8.757 -0.055 19638 2679 1 15 . 1 1 65 65 SER HA H 65 3.445 3.445 4.232 -0.787 19638 2680 1 15 . 1 1 65 65 SER H H 65 7.442 7.442 7.806 -0.364 19638 2681 1 15 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.250 -0.393 19638 2682 1 15 . 1 1 66 66 GLU H H 66 7.574 7.574 7.702 -0.128 19638 2683 1 15 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.895 0.384 19638 2684 1 15 . 1 1 67 67 HIS H H 67 8.297 8.297 7.965 0.332 19638 2685 1 15 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.187 -0.831 19638 2686 1 15 . 1 1 68 68 LEU H H 68 8.060 8.060 7.884 0.176 19638 2687 1 15 . 1 1 69 69 THR HA H 69 3.792 3.792 4.119 -0.327 19638 2688 1 15 . 1 1 69 69 THR H H 69 7.327 7.327 7.703 -0.376 19638 2689 1 15 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.034 -0.007 19638 2690 1 15 . 1 1 70 70 ASN H H 70 6.715 6.715 7.700 -0.985 19638 2691 1 15 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.221 1.740 19638 2692 1 15 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.066 1.059 19638 2693 1 15 . 1 1 72 72 ALA H H 72 9.052 9.052 8.515 0.537 19638 2694 1 15 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.288 0.281 19638 2695 1 15 . 1 1 73 73 LYS H H 73 7.914 7.914 7.920 -0.006 19638 2696 1 15 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.274 0.753 19638 2697 1 15 . 1 1 74 74 TYR H H 74 8.520 8.520 7.511 1.009 19638 2698 1 15 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.796 -0.135 19638 2699 1 15 . 1 1 75 75 ILE H H 75 9.542 9.542 7.464 2.078 19638 2700 1 15 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.591 0.536 19638 2701 1 15 . 1 1 77 77 GLY H H 77 9.573 9.573 8.838 0.735 19638 2702 1 15 . 1 1 78 78 THR HA H 78 5.058 5.058 4.726 0.332 19638 2703 1 15 . 1 1 78 78 THR H H 78 9.274 9.274 7.544 1.730 19638 2704 1 15 . 1 1 79 79 LYS H H 79 8.060 8.060 8.511 -0.451 19638 2705 1 15 . 1 1 80 80 MET H H 80 8.670 8.670 7.951 0.719 19638 2706 1 15 . 1 1 81 81 ALA H H 81 8.060 8.060 8.634 -0.574 19638 2707 1 15 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.509 0.053 19638 2708 1 15 . 1 1 82 82 PHE H H 82 8.446 8.446 7.817 0.629 19638 2709 1 15 . 1 1 83 83 GLY H H 83 7.142 7.142 7.651 -0.509 19638 2710 1 15 . 1 1 84 84 GLY H H 84 8.211 8.211 8.056 0.155 19638 2711 1 15 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.512 -0.257 19638 2712 1 15 . 1 1 85 85 LEU H H 85 8.160 8.160 8.051 0.109 19638 2713 1 15 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.060 -0.105 19638 2714 1 15 . 1 1 86 86 LYS H H 86 8.440 8.440 8.601 -0.161 19638 2715 1 15 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.375 -0.005 19638 2716 1 15 . 1 1 87 87 LYS H H 87 8.800 8.800 8.026 0.774 19638 2717 1 15 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.073 -0.647 19638 2718 1 15 . 1 1 88 88 GLU H H 88 8.971 8.971 9.055 -0.084 19638 2719 1 15 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.892 -0.075 19638 2720 1 15 . 1 1 89 89 LYS H H 89 8.679 8.679 8.438 0.241 19638 2721 1 15 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.411 -0.370 19638 2722 1 15 . 1 1 90 90 ASP H H 90 6.295 6.295 8.496 -2.201 19638 2723 1 15 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.033 -0.752 19638 2724 1 15 . 1 1 91 91 ARG H H 91 7.285 7.285 7.536 -0.251 19638 2725 1 15 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.388 -0.583 19638 2726 1 15 . 1 1 92 92 ASN H H 92 8.541 8.541 8.325 0.216 19638 2727 1 15 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.497 -0.504 19638 2728 1 15 . 1 1 93 93 ASP H H 93 8.518 8.518 7.585 0.933 19638 2729 1 15 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.130 -0.352 19638 2730 1 15 . 1 1 94 94 LEU H H 94 8.167 8.167 7.458 0.709 19638 2731 1 15 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.807 -0.838 19638 2732 1 15 . 1 1 95 95 ILE H H 95 8.718 8.718 7.878 0.840 19638 2733 1 15 . 1 1 96 96 THR HA H 96 3.661 3.661 4.071 -0.410 19638 2734 1 15 . 1 1 96 96 THR H H 96 7.955 7.955 8.068 -0.113 19638 2735 1 15 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.097 -0.105 19638 2736 1 15 . 1 1 97 97 TYR H H 97 7.619 7.619 8.008 -0.389 19638 2737 1 15 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.716 -0.485 19638 2738 1 15 . 1 1 98 98 LEU H H 98 8.933 8.933 7.748 1.185 19638 2739 1 15 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.018 0.474 19638 2740 1 15 . 1 1 99 99 LYS H H 99 8.454 8.454 8.340 0.114 19638 2741 1 15 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.928 0.166 19638 2742 1 15 . 1 1 100 100 LYS H H 100 6.501 6.501 7.731 -1.230 19638 2743 1 15 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.995 -0.040 19638 2744 1 15 . 1 1 101 101 ALA H H 101 8.296 8.296 7.232 1.064 19638 2745 1 15 . 1 1 102 102 THR H H 102 7.330 7.330 7.452 -0.122 19638 2746 1 16 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.645 -0.386 19638 2747 1 16 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.521 0.087 19638 2748 1 16 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.167 -0.374 19638 2749 1 16 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.816 -1.239 19638 2750 1 16 . 1 1 2 2 SER H H 2 9.424 9.424 8.526 0.898 19638 2751 1 16 . 1 1 3 3 ALA HA H 3 3.980 3.980 3.984 -0.004 19638 2752 1 16 . 1 1 3 3 ALA H H 3 9.092 9.092 8.363 0.729 19638 2753 1 16 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.841 0.432 19638 2754 1 16 . 1 1 4 4 LYS H H 4 8.086 8.086 8.671 -0.585 19638 2755 1 16 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.057 -0.007 19638 2756 1 16 . 1 1 5 5 LYS H H 5 7.755 7.755 8.360 -0.605 19638 2757 1 16 . 1 1 6 6 GLY H H 6 8.694 8.694 7.798 0.896 19638 2758 1 16 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.064 -0.718 19638 2759 1 16 . 1 1 7 7 ALA H H 7 7.999 7.999 7.348 0.651 19638 2760 1 16 . 1 1 8 8 THR HA H 8 3.898 3.898 4.022 -0.124 19638 2761 1 16 . 1 1 8 8 THR H H 8 7.203 7.203 7.560 -0.357 19638 2762 1 16 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.101 -0.257 19638 2763 1 16 . 1 1 9 9 LEU H H 9 7.846 7.846 8.268 -0.422 19638 2764 1 16 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.030 -0.527 19638 2765 1 16 . 1 1 10 10 PHE H H 10 8.651 8.651 8.440 0.211 19638 2766 1 16 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.932 0.291 19638 2767 1 16 . 1 1 11 11 LYS H H 11 8.365 8.365 7.804 0.561 19638 2768 1 16 . 1 1 12 12 THR HA H 12 4.361 4.361 4.198 0.163 19638 2769 1 16 . 1 1 12 12 THR H H 12 7.959 7.959 8.156 -0.197 19638 2770 1 16 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.581 0.005 19638 2771 1 16 . 1 1 13 13 ARG H H 13 8.338 8.338 7.760 0.578 19638 2772 1 16 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.316 -3.402 19638 2773 1 16 . 1 1 14 14 CYS H H 14 8.047 8.047 8.120 -0.073 19638 2774 1 16 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.389 1.729 19638 2775 1 16 . 1 1 15 15 LEU H H 15 8.070 8.070 7.604 0.466 19638 2776 1 16 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.979 0.679 19638 2777 1 16 . 1 1 16 16 GLN H H 16 10.022 10.022 8.397 1.625 19638 2778 1 16 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.496 1.692 19638 2779 1 16 . 1 1 17 17 CYS H H 17 9.730 9.730 7.463 2.267 19638 2780 1 16 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.899 3.945 19638 2781 1 16 . 1 1 18 18 HIS H H 18 11.098 11.098 8.607 2.491 19638 2782 1 16 . 1 1 19 19 THR HA H 19 6.298 6.298 4.355 1.943 19638 2783 1 16 . 1 1 19 19 THR H H 19 10.180 10.180 8.830 1.350 19638 2784 1 16 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.959 1.045 19638 2785 1 16 . 1 1 20 20 VAL H H 20 8.927 8.927 8.189 0.738 19638 2786 1 16 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.397 0.222 19638 2787 1 16 . 1 1 21 21 GLU H H 21 9.460 9.460 7.389 2.071 19638 2788 1 16 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.999 -0.373 19638 2789 1 16 . 1 1 22 22 LYS H H 22 9.064 9.064 8.159 0.905 19638 2790 1 16 . 1 1 23 23 GLY H H 23 9.543 9.543 8.232 1.311 19638 2791 1 16 . 1 1 24 24 GLY H H 24 8.296 8.296 7.723 0.573 19638 2792 1 16 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.301 0.196 19638 2793 1 16 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.790 0.485 19638 2794 1 16 . 1 1 26 26 HIS H H 26 8.931 8.931 8.396 0.535 19638 2795 1 16 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.496 0.174 19638 2796 1 16 . 1 1 27 27 LYS H H 27 8.362 8.362 7.953 0.409 19638 2797 1 16 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.896 -0.760 19638 2798 1 16 . 1 1 28 28 VAL H H 28 7.720 7.720 8.376 -0.656 19638 2799 1 16 . 1 1 29 29 GLY H H 29 7.705 7.705 7.191 0.514 19638 2800 1 16 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.270 -0.152 19638 2801 1 16 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.671 1.246 19638 2802 1 16 . 1 1 31 31 ASN H H 31 11.993 11.993 8.325 3.668 19638 2803 1 16 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.530 -0.070 19638 2804 1 16 . 1 1 32 32 LEU H H 32 9.445 9.445 8.503 0.942 19638 2805 1 16 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.721 -0.615 19638 2806 1 16 . 1 1 33 33 HIS H H 33 8.051 8.051 8.412 -0.361 19638 2807 1 16 . 1 1 34 34 GLY H H 34 9.066 9.066 8.345 0.721 19638 2808 1 16 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.768 -0.207 19638 2809 1 16 . 1 1 35 35 ILE H H 35 7.068 7.068 7.933 -0.865 19638 2810 1 16 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.356 -0.444 19638 2811 1 16 . 1 1 36 36 PHE H H 36 7.901 7.901 7.587 0.314 19638 2812 1 16 . 1 1 37 37 GLY H H 37 8.766 8.766 9.273 -0.507 19638 2813 1 16 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.739 -0.124 19638 2814 1 16 . 1 1 38 38 ARG H H 38 7.962 7.962 7.456 0.506 19638 2815 1 16 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.725 0.337 19638 2816 1 16 . 1 1 39 39 HIS H H 39 8.064 8.064 8.560 -0.496 19638 2817 1 16 . 1 1 40 40 SER HA H 40 4.601 4.601 4.141 0.460 19638 2818 1 16 . 1 1 40 40 SER H H 40 8.588 8.588 8.354 0.234 19638 2819 1 16 . 1 1 41 41 GLY H H 41 8.930 8.930 8.608 0.322 19638 2820 1 16 . 1 1 42 42 GLN H H 42 7.865 7.865 8.842 -0.977 19638 2821 1 16 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.214 0.122 19638 2822 1 16 . 1 1 43 43 ALA H H 43 8.062 8.062 8.468 -0.406 19638 2823 1 16 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.003 0.172 19638 2824 1 16 . 1 1 44 44 GLU H H 44 8.924 8.924 7.726 1.198 19638 2825 1 16 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.524 -0.679 19638 2826 1 16 . 1 1 46 46 TYR H H 46 7.033 7.033 7.644 -0.611 19638 2827 1 16 . 1 1 47 47 SER HA H 47 4.283 4.283 4.222 0.061 19638 2828 1 16 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.685 -0.443 19638 2829 1 16 . 1 1 48 48 TYR H H 48 7.905 7.905 8.428 -0.523 19638 2830 1 16 . 1 1 49 49 THR HA H 49 4.124 4.124 4.438 -0.314 19638 2831 1 16 . 1 1 49 49 THR H H 49 9.712 9.712 8.468 1.244 19638 2832 1 16 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.271 -0.010 19638 2833 1 16 . 1 1 50 50 ASP H H 50 8.682 8.682 8.987 -0.305 19638 2834 1 16 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.930 0.252 19638 2835 1 16 . 1 1 51 51 ALA H H 51 7.802 7.802 8.387 -0.585 19638 2836 1 16 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.600 0.087 19638 2837 1 16 . 1 1 52 52 ASN H H 52 8.422 8.422 8.245 0.177 19638 2838 1 16 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.819 -0.139 19638 2839 1 16 . 1 1 53 53 ILE H H 53 7.686 7.686 7.973 -0.287 19638 2840 1 16 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.029 -0.100 19638 2841 1 16 . 1 1 54 54 LYS H H 54 9.101 9.101 8.477 0.624 19638 2842 1 16 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.091 -0.055 19638 2843 1 16 . 1 1 55 55 LYS H H 55 7.355 7.355 7.974 -0.619 19638 2844 1 16 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.403 -0.078 19638 2845 1 16 . 1 1 56 56 ASN H H 56 7.506 7.506 8.455 -0.949 19638 2846 1 16 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.156 0.035 19638 2847 1 16 . 1 1 57 57 VAL H H 57 7.341 7.341 7.592 -0.251 19638 2848 1 16 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.129 -0.331 19638 2849 1 16 . 1 1 58 58 LEU H H 58 8.220 8.220 8.195 0.025 19638 2850 1 16 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.615 0.500 19638 2851 1 16 . 1 1 59 59 TRP H H 59 7.973 7.973 8.775 -0.802 19638 2852 1 16 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.908 -0.171 19638 2853 1 16 . 1 1 60 60 ASP H H 60 10.093 10.093 8.334 1.759 19638 2854 1 16 . 1 1 61 61 GLU HA H 61 3.338 3.338 3.980 -0.642 19638 2855 1 16 . 1 1 61 61 GLU H H 61 10.090 10.090 8.794 1.296 19638 2856 1 16 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.567 -0.111 19638 2857 1 16 . 1 1 62 62 ASN H H 62 8.211 8.211 8.414 -0.203 19638 2858 1 16 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.589 -0.039 19638 2859 1 16 . 1 1 63 63 ASN H H 63 9.331 9.331 8.403 0.928 19638 2860 1 16 . 1 1 64 64 MET HA H 64 4.321 4.321 4.131 0.190 19638 2861 1 16 . 1 1 64 64 MET H H 64 8.702 8.702 8.874 -0.172 19638 2862 1 16 . 1 1 65 65 SER HA H 65 3.445 3.445 4.230 -0.785 19638 2863 1 16 . 1 1 65 65 SER H H 65 7.442 7.442 7.978 -0.536 19638 2864 1 16 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.199 -0.342 19638 2865 1 16 . 1 1 66 66 GLU H H 66 7.574 7.574 7.923 -0.349 19638 2866 1 16 . 1 1 67 67 HIS HA H 67 4.279 4.279 4.081 0.198 19638 2867 1 16 . 1 1 67 67 HIS H H 67 8.297 8.297 7.918 0.379 19638 2868 1 16 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.107 -0.751 19638 2869 1 16 . 1 1 68 68 LEU H H 68 8.060 8.060 7.992 0.068 19638 2870 1 16 . 1 1 69 69 THR HA H 69 3.792 3.792 4.085 -0.293 19638 2871 1 16 . 1 1 69 69 THR H H 69 7.327 7.327 8.055 -0.728 19638 2872 1 16 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.188 -0.161 19638 2873 1 16 . 1 1 70 70 ASN H H 70 6.715 6.715 7.748 -1.033 19638 2874 1 16 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.039 1.922 19638 2875 1 16 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.125 1.000 19638 2876 1 16 . 1 1 72 72 ALA H H 72 9.052 9.052 8.274 0.778 19638 2877 1 16 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.081 0.488 19638 2878 1 16 . 1 1 73 73 LYS H H 73 7.914 7.914 7.899 0.015 19638 2879 1 16 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.207 0.820 19638 2880 1 16 . 1 1 74 74 TYR H H 74 8.520 8.520 7.708 0.812 19638 2881 1 16 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.709 -0.048 19638 2882 1 16 . 1 1 75 75 ILE H H 75 9.542 9.542 7.826 1.716 19638 2883 1 16 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.292 0.835 19638 2884 1 16 . 1 1 77 77 GLY H H 77 9.573 9.573 8.242 1.331 19638 2885 1 16 . 1 1 78 78 THR HA H 78 5.058 5.058 4.199 0.859 19638 2886 1 16 . 1 1 78 78 THR H H 78 9.274 9.274 7.891 1.383 19638 2887 1 16 . 1 1 79 79 LYS H H 79 8.060 8.060 8.615 -0.555 19638 2888 1 16 . 1 1 80 80 MET H H 80 8.670 8.670 7.863 0.807 19638 2889 1 16 . 1 1 81 81 ALA H H 81 8.060 8.060 8.660 -0.600 19638 2890 1 16 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.248 0.314 19638 2891 1 16 . 1 1 82 82 PHE H H 82 8.446 8.446 7.977 0.469 19638 2892 1 16 . 1 1 83 83 GLY H H 83 7.142 7.142 7.496 -0.354 19638 2893 1 16 . 1 1 84 84 GLY H H 84 8.211 8.211 8.043 0.168 19638 2894 1 16 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.525 -0.270 19638 2895 1 16 . 1 1 85 85 LEU H H 85 8.160 8.160 7.884 0.276 19638 2896 1 16 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.326 -0.371 19638 2897 1 16 . 1 1 86 86 LYS H H 86 8.440 8.440 8.702 -0.262 19638 2898 1 16 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.474 -0.104 19638 2899 1 16 . 1 1 87 87 LYS H H 87 8.800 8.800 7.907 0.893 19638 2900 1 16 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.040 -0.614 19638 2901 1 16 . 1 1 88 88 GLU H H 88 8.971 8.971 8.943 0.028 19638 2902 1 16 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.988 -0.171 19638 2903 1 16 . 1 1 89 89 LYS H H 89 8.679 8.679 8.424 0.255 19638 2904 1 16 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.609 -0.568 19638 2905 1 16 . 1 1 90 90 ASP H H 90 6.295 6.295 8.433 -2.138 19638 2906 1 16 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.043 -0.762 19638 2907 1 16 . 1 1 91 91 ARG H H 91 7.285 7.285 7.740 -0.455 19638 2908 1 16 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.760 -0.955 19638 2909 1 16 . 1 1 92 92 ASN H H 92 8.541 8.541 8.319 0.222 19638 2910 1 16 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.525 -0.532 19638 2911 1 16 . 1 1 93 93 ASP H H 93 8.518 8.518 7.752 0.766 19638 2912 1 16 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.217 -0.439 19638 2913 1 16 . 1 1 94 94 LEU H H 94 8.167 8.167 7.585 0.582 19638 2914 1 16 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.801 -0.832 19638 2915 1 16 . 1 1 95 95 ILE H H 95 8.718 8.718 7.801 0.917 19638 2916 1 16 . 1 1 96 96 THR HA H 96 3.661 3.661 3.990 -0.329 19638 2917 1 16 . 1 1 96 96 THR H H 96 7.955 7.955 8.503 -0.548 19638 2918 1 16 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.087 -0.095 19638 2919 1 16 . 1 1 97 97 TYR H H 97 7.619 7.619 8.194 -0.575 19638 2920 1 16 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.698 -0.467 19638 2921 1 16 . 1 1 98 98 LEU H H 98 8.933 8.933 7.736 1.197 19638 2922 1 16 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.378 0.114 19638 2923 1 16 . 1 1 99 99 LYS H H 99 8.454 8.454 8.205 0.249 19638 2924 1 16 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.930 0.164 19638 2925 1 16 . 1 1 100 100 LYS H H 100 6.501 6.501 7.837 -1.336 19638 2926 1 16 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.994 -0.039 19638 2927 1 16 . 1 1 101 101 ALA H H 101 8.296 8.296 7.338 0.958 19638 2928 1 16 . 1 1 102 102 THR H H 102 7.330 7.330 7.495 -0.165 19638 2929 1 17 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.612 -0.353 19638 2930 1 17 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.539 1.069 19638 2931 1 17 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.180 -0.387 19638 2932 1 17 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.751 -1.174 19638 2933 1 17 . 1 1 2 2 SER H H 2 9.424 9.424 9.402 0.022 19638 2934 1 17 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.400 -0.420 19638 2935 1 17 . 1 1 3 3 ALA H H 3 9.092 9.092 9.015 0.077 19638 2936 1 17 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.964 0.309 19638 2937 1 17 . 1 1 4 4 LYS H H 4 8.086 8.086 7.790 0.296 19638 2938 1 17 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.147 -0.097 19638 2939 1 17 . 1 1 5 5 LYS H H 5 7.755 7.755 7.880 -0.125 19638 2940 1 17 . 1 1 6 6 GLY H H 6 8.694 8.694 7.851 0.843 19638 2941 1 17 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.246 -0.900 19638 2942 1 17 . 1 1 7 7 ALA H H 7 7.999 7.999 8.540 -0.541 19638 2943 1 17 . 1 1 8 8 THR HA H 8 3.898 3.898 4.005 -0.107 19638 2944 1 17 . 1 1 8 8 THR H H 8 7.203 7.203 7.505 -0.302 19638 2945 1 17 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.107 -0.263 19638 2946 1 17 . 1 1 9 9 LEU H H 9 7.846 7.846 8.026 -0.180 19638 2947 1 17 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.021 -0.518 19638 2948 1 17 . 1 1 10 10 PHE H H 10 8.651 8.651 8.799 -0.148 19638 2949 1 17 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.945 0.278 19638 2950 1 17 . 1 1 11 11 LYS H H 11 8.365 8.365 7.913 0.452 19638 2951 1 17 . 1 1 12 12 THR HA H 12 4.361 4.361 4.165 0.196 19638 2952 1 17 . 1 1 12 12 THR H H 12 7.959 7.959 8.118 -0.159 19638 2953 1 17 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.607 -0.021 19638 2954 1 17 . 1 1 13 13 ARG H H 13 8.338 8.338 7.872 0.467 19638 2955 1 17 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.351 -3.437 19638 2956 1 17 . 1 1 14 14 CYS H H 14 8.047 8.047 8.302 -0.255 19638 2957 1 17 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.352 1.766 19638 2958 1 17 . 1 1 15 15 LEU H H 15 8.070 8.070 7.722 0.348 19638 2959 1 17 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.975 0.683 19638 2960 1 17 . 1 1 16 16 GLN H H 16 10.022 10.022 8.401 1.621 19638 2961 1 17 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.458 1.730 19638 2962 1 17 . 1 1 17 17 CYS H H 17 9.730 9.730 7.395 2.335 19638 2963 1 17 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.904 3.940 19638 2964 1 17 . 1 1 18 18 HIS H H 18 11.098 11.098 8.639 2.459 19638 2965 1 17 . 1 1 19 19 THR HA H 19 6.298 6.298 4.390 1.908 19638 2966 1 17 . 1 1 19 19 THR H H 19 10.180 10.180 8.789 1.391 19638 2967 1 17 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.845 1.159 19638 2968 1 17 . 1 1 20 20 VAL H H 20 8.927 8.927 8.148 0.779 19638 2969 1 17 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.406 0.213 19638 2970 1 17 . 1 1 21 21 GLU H H 21 9.460 9.460 7.391 2.069 19638 2971 1 17 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.134 -0.508 19638 2972 1 17 . 1 1 22 22 LYS H H 22 9.064 9.064 8.135 0.929 19638 2973 1 17 . 1 1 23 23 GLY H H 23 9.543 9.543 8.235 1.308 19638 2974 1 17 . 1 1 24 24 GLY H H 24 8.296 8.296 7.668 0.628 19638 2975 1 17 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.390 0.107 19638 2976 1 17 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.479 0.796 19638 2977 1 17 . 1 1 26 26 HIS H H 26 8.931 8.931 8.484 0.447 19638 2978 1 17 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.567 0.103 19638 2979 1 17 . 1 1 27 27 LYS H H 27 8.362 8.362 8.142 0.220 19638 2980 1 17 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.797 -0.661 19638 2981 1 17 . 1 1 28 28 VAL H H 28 7.720 7.720 8.524 -0.804 19638 2982 1 17 . 1 1 29 29 GLY H H 29 7.705 7.705 7.432 0.273 19638 2983 1 17 . 1 1 30 30 PRO HA H 30 4.118 4.118 3.831 0.287 19638 2984 1 17 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.423 1.494 19638 2985 1 17 . 1 1 31 31 ASN H H 31 11.993 11.993 7.818 4.175 19638 2986 1 17 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.532 -0.072 19638 2987 1 17 . 1 1 32 32 LEU H H 32 9.445 9.445 8.435 1.010 19638 2988 1 17 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.729 -0.623 19638 2989 1 17 . 1 1 33 33 HIS H H 33 8.051 8.051 8.503 -0.452 19638 2990 1 17 . 1 1 34 34 GLY H H 34 9.066 9.066 8.570 0.496 19638 2991 1 17 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.770 -0.209 19638 2992 1 17 . 1 1 35 35 ILE H H 35 7.068 7.068 7.906 -0.838 19638 2993 1 17 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.309 -0.397 19638 2994 1 17 . 1 1 36 36 PHE H H 36 7.901 7.901 7.600 0.301 19638 2995 1 17 . 1 1 37 37 GLY H H 37 8.766 8.766 9.215 -0.449 19638 2996 1 17 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.561 0.054 19638 2997 1 17 . 1 1 38 38 ARG H H 38 7.962 7.962 7.465 0.497 19638 2998 1 17 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.300 -0.238 19638 2999 1 17 . 1 1 39 39 HIS H H 39 8.064 8.064 8.683 -0.619 19638 3000 1 17 . 1 1 40 40 SER HA H 40 4.601 4.601 4.291 0.310 19638 3001 1 17 . 1 1 40 40 SER H H 40 8.588 8.588 8.376 0.212 19638 3002 1 17 . 1 1 41 41 GLY H H 41 8.930 8.930 8.279 0.651 19638 3003 1 17 . 1 1 42 42 GLN H H 42 7.865 7.865 8.112 -0.247 19638 3004 1 17 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.241 0.095 19638 3005 1 17 . 1 1 43 43 ALA H H 43 8.062 8.062 8.065 -0.003 19638 3006 1 17 . 1 1 44 44 GLU HA H 44 4.175 4.175 3.964 0.211 19638 3007 1 17 . 1 1 44 44 GLU H H 44 8.924 8.924 7.989 0.935 19638 3008 1 17 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.508 -0.663 19638 3009 1 17 . 1 1 46 46 TYR H H 46 7.033 7.033 7.737 -0.704 19638 3010 1 17 . 1 1 47 47 SER HA H 47 4.283 4.283 4.358 -0.075 19638 3011 1 17 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.793 -0.551 19638 3012 1 17 . 1 1 48 48 TYR H H 48 7.905 7.905 8.231 -0.326 19638 3013 1 17 . 1 1 49 49 THR HA H 49 4.124 4.124 4.393 -0.269 19638 3014 1 17 . 1 1 49 49 THR H H 49 9.712 9.712 8.549 1.163 19638 3015 1 17 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.335 -0.074 19638 3016 1 17 . 1 1 50 50 ASP H H 50 8.682 8.682 8.990 -0.308 19638 3017 1 17 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.909 0.273 19638 3018 1 17 . 1 1 51 51 ALA H H 51 7.802 7.802 7.890 -0.088 19638 3019 1 17 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.533 0.154 19638 3020 1 17 . 1 1 52 52 ASN H H 52 8.422 8.422 7.772 0.650 19638 3021 1 17 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.803 -0.123 19638 3022 1 17 . 1 1 53 53 ILE H H 53 7.686 7.686 7.706 -0.020 19638 3023 1 17 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.093 -0.164 19638 3024 1 17 . 1 1 54 54 LYS H H 54 9.101 9.101 8.165 0.936 19638 3025 1 17 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.365 -0.329 19638 3026 1 17 . 1 1 55 55 LYS H H 55 7.355 7.355 7.732 -0.377 19638 3027 1 17 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.666 -0.341 19638 3028 1 17 . 1 1 56 56 ASN H H 56 7.506 7.506 8.502 -0.996 19638 3029 1 17 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.273 -0.082 19638 3030 1 17 . 1 1 57 57 VAL H H 57 7.341 7.341 8.374 -1.033 19638 3031 1 17 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.163 -0.365 19638 3032 1 17 . 1 1 58 58 LEU H H 58 8.220 8.220 8.234 -0.014 19638 3033 1 17 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.590 0.525 19638 3034 1 17 . 1 1 59 59 TRP H H 59 7.973 7.973 9.021 -1.048 19638 3035 1 17 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.936 -0.199 19638 3036 1 17 . 1 1 60 60 ASP H H 60 10.093 10.093 8.401 1.692 19638 3037 1 17 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.078 -0.740 19638 3038 1 17 . 1 1 61 61 GLU H H 61 10.090 10.090 8.785 1.305 19638 3039 1 17 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.603 -0.147 19638 3040 1 17 . 1 1 62 62 ASN H H 62 8.211 8.211 8.347 -0.136 19638 3041 1 17 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.436 0.114 19638 3042 1 17 . 1 1 63 63 ASN H H 63 9.331 9.331 8.370 0.961 19638 3043 1 17 . 1 1 64 64 MET HA H 64 4.321 4.321 4.374 -0.053 19638 3044 1 17 . 1 1 64 64 MET H H 64 8.702 8.702 8.831 -0.129 19638 3045 1 17 . 1 1 65 65 SER HA H 65 3.445 3.445 4.239 -0.794 19638 3046 1 17 . 1 1 65 65 SER H H 65 7.442 7.442 7.806 -0.364 19638 3047 1 17 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.022 -0.165 19638 3048 1 17 . 1 1 66 66 GLU H H 66 7.574 7.574 7.577 -0.003 19638 3049 1 17 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.841 0.438 19638 3050 1 17 . 1 1 67 67 HIS H H 67 8.297 8.297 7.365 0.932 19638 3051 1 17 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.131 -0.775 19638 3052 1 17 . 1 1 68 68 LEU H H 68 8.060 8.060 7.569 0.491 19638 3053 1 17 . 1 1 69 69 THR HA H 69 3.792 3.792 4.340 -0.548 19638 3054 1 17 . 1 1 69 69 THR H H 69 7.327 7.327 7.141 0.186 19638 3055 1 17 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.501 0.526 19638 3056 1 17 . 1 1 70 70 ASN H H 70 6.715 6.715 8.997 -2.282 19638 3057 1 17 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.125 1.836 19638 3058 1 17 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.185 0.940 19638 3059 1 17 . 1 1 72 72 ALA H H 72 9.052 9.052 7.796 1.256 19638 3060 1 17 . 1 1 73 73 LYS HA H 73 4.569 4.569 3.890 0.679 19638 3061 1 17 . 1 1 73 73 LYS H H 73 7.914 7.914 8.921 -1.007 19638 3062 1 17 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.299 0.728 19638 3063 1 17 . 1 1 74 74 TYR H H 74 8.520 8.520 8.148 0.372 19638 3064 1 17 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.503 0.158 19638 3065 1 17 . 1 1 75 75 ILE H H 75 9.542 9.542 7.633 1.909 19638 3066 1 17 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.731 0.396 19638 3067 1 17 . 1 1 77 77 GLY H H 77 9.573 9.573 8.613 0.960 19638 3068 1 17 . 1 1 78 78 THR HA H 78 5.058 5.058 4.745 0.313 19638 3069 1 17 . 1 1 78 78 THR H H 78 9.274 9.274 7.822 1.452 19638 3070 1 17 . 1 1 79 79 LYS H H 79 8.060 8.060 8.583 -0.523 19638 3071 1 17 . 1 1 80 80 MET H H 80 8.670 8.670 7.464 1.206 19638 3072 1 17 . 1 1 81 81 ALA H H 81 8.060 8.060 8.520 -0.460 19638 3073 1 17 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.631 -0.069 19638 3074 1 17 . 1 1 82 82 PHE H H 82 8.446 8.446 8.071 0.375 19638 3075 1 17 . 1 1 83 83 GLY H H 83 7.142 7.142 7.549 -0.407 19638 3076 1 17 . 1 1 84 84 GLY H H 84 8.211 8.211 8.141 0.070 19638 3077 1 17 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.503 -0.248 19638 3078 1 17 . 1 1 85 85 LEU H H 85 8.160 8.160 8.457 -0.297 19638 3079 1 17 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.091 -0.136 19638 3080 1 17 . 1 1 86 86 LYS H H 86 8.440 8.440 8.650 -0.210 19638 3081 1 17 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.413 -0.043 19638 3082 1 17 . 1 1 87 87 LYS H H 87 8.800 8.800 8.000 0.800 19638 3083 1 17 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.022 -0.596 19638 3084 1 17 . 1 1 88 88 GLU H H 88 8.971 8.971 9.113 -0.142 19638 3085 1 17 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.146 -0.329 19638 3086 1 17 . 1 1 89 89 LYS H H 89 8.679 8.679 8.300 0.379 19638 3087 1 17 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.407 -0.366 19638 3088 1 17 . 1 1 90 90 ASP H H 90 6.295 6.295 8.470 -2.175 19638 3089 1 17 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.006 -0.725 19638 3090 1 17 . 1 1 91 91 ARG H H 91 7.285 7.285 7.589 -0.304 19638 3091 1 17 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.588 -0.782 19638 3092 1 17 . 1 1 92 92 ASN H H 92 8.541 8.541 8.039 0.502 19638 3093 1 17 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.574 -0.581 19638 3094 1 17 . 1 1 93 93 ASP H H 93 8.518 8.518 7.524 0.994 19638 3095 1 17 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.155 -0.377 19638 3096 1 17 . 1 1 94 94 LEU H H 94 8.167 8.167 7.706 0.461 19638 3097 1 17 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.808 -0.839 19638 3098 1 17 . 1 1 95 95 ILE H H 95 8.718 8.718 8.257 0.461 19638 3099 1 17 . 1 1 96 96 THR HA H 96 3.661 3.661 3.970 -0.309 19638 3100 1 17 . 1 1 96 96 THR H H 96 7.955 7.955 8.464 -0.509 19638 3101 1 17 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.087 -0.095 19638 3102 1 17 . 1 1 97 97 TYR H H 97 7.619 7.619 7.866 -0.247 19638 3103 1 17 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.679 -0.448 19638 3104 1 17 . 1 1 98 98 LEU H H 98 8.933 8.933 7.667 1.266 19638 3105 1 17 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.210 0.282 19638 3106 1 17 . 1 1 99 99 LYS H H 99 8.454 8.454 8.340 0.114 19638 3107 1 17 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.879 0.215 19638 3108 1 17 . 1 1 100 100 LYS H H 100 6.501 6.501 7.910 -1.409 19638 3109 1 17 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.047 -0.092 19638 3110 1 17 . 1 1 101 101 ALA H H 101 8.296 8.296 7.612 0.684 19638 3111 1 17 . 1 1 102 102 THR H H 102 7.330 7.330 7.574 -0.244 19638 3112 1 18 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.641 -0.382 19638 3113 1 18 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.762 0.846 19638 3114 1 18 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.454 -0.661 19638 3115 1 18 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.991 -1.414 19638 3116 1 18 . 1 1 2 2 SER H H 2 9.424 9.424 8.590 0.834 19638 3117 1 18 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.506 -0.526 19638 3118 1 18 . 1 1 3 3 ALA H H 3 9.092 9.092 8.817 0.275 19638 3119 1 18 . 1 1 4 4 LYS HA H 4 4.273 4.273 3.998 0.275 19638 3120 1 18 . 1 1 4 4 LYS H H 4 8.086 8.086 8.492 -0.406 19638 3121 1 18 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.154 -0.103 19638 3122 1 18 . 1 1 5 5 LYS H H 5 7.755 7.755 7.465 0.290 19638 3123 1 18 . 1 1 6 6 GLY H H 6 8.694 8.694 8.022 0.672 19638 3124 1 18 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.391 -1.045 19638 3125 1 18 . 1 1 7 7 ALA H H 7 7.999 7.999 8.579 -0.580 19638 3126 1 18 . 1 1 8 8 THR HA H 8 3.898 3.898 4.006 -0.108 19638 3127 1 18 . 1 1 8 8 THR H H 8 7.203 7.203 7.562 -0.359 19638 3128 1 18 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.098 -0.254 19638 3129 1 18 . 1 1 9 9 LEU H H 9 7.846 7.846 7.823 0.023 19638 3130 1 18 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.059 -0.556 19638 3131 1 18 . 1 1 10 10 PHE H H 10 8.651 8.651 8.643 0.008 19638 3132 1 18 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.921 0.302 19638 3133 1 18 . 1 1 11 11 LYS H H 11 8.365 8.365 8.021 0.344 19638 3134 1 18 . 1 1 12 12 THR HA H 12 4.361 4.361 4.164 0.197 19638 3135 1 18 . 1 1 12 12 THR H H 12 7.959 7.959 8.226 -0.267 19638 3136 1 18 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.668 -0.082 19638 3137 1 18 . 1 1 13 13 ARG H H 13 8.338 8.338 8.038 0.300 19638 3138 1 18 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.367 -3.453 19638 3139 1 18 . 1 1 14 14 CYS H H 14 8.047 8.047 8.240 -0.193 19638 3140 1 18 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.380 1.738 19638 3141 1 18 . 1 1 15 15 LEU H H 15 8.070 8.070 7.824 0.246 19638 3142 1 18 . 1 1 16 16 GLN HA H 16 4.658 4.658 4.003 0.655 19638 3143 1 18 . 1 1 16 16 GLN H H 16 10.022 10.022 8.394 1.628 19638 3144 1 18 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.477 1.711 19638 3145 1 18 . 1 1 17 17 CYS H H 17 9.730 9.730 7.402 2.328 19638 3146 1 18 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.901 3.943 19638 3147 1 18 . 1 1 18 18 HIS H H 18 11.098 11.098 8.663 2.435 19638 3148 1 18 . 1 1 19 19 THR HA H 19 6.298 6.298 4.411 1.887 19638 3149 1 18 . 1 1 19 19 THR H H 19 10.180 10.180 8.713 1.467 19638 3150 1 18 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.971 1.033 19638 3151 1 18 . 1 1 20 20 VAL H H 20 8.927 8.927 7.930 0.997 19638 3152 1 18 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.478 0.141 19638 3153 1 18 . 1 1 21 21 GLU H H 21 9.460 9.460 7.576 1.884 19638 3154 1 18 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.178 -0.552 19638 3155 1 18 . 1 1 22 22 LYS H H 22 9.064 9.064 8.654 0.410 19638 3156 1 18 . 1 1 23 23 GLY H H 23 9.543 9.543 8.589 0.954 19638 3157 1 18 . 1 1 24 24 GLY H H 24 8.296 8.296 7.532 0.764 19638 3158 1 18 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.408 0.089 19638 3159 1 18 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.677 0.598 19638 3160 1 18 . 1 1 26 26 HIS H H 26 8.931 8.931 8.329 0.603 19638 3161 1 18 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.514 0.156 19638 3162 1 18 . 1 1 27 27 LYS H H 27 8.362 8.362 8.090 0.272 19638 3163 1 18 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.803 -0.667 19638 3164 1 18 . 1 1 28 28 VAL H H 28 7.720 7.720 8.343 -0.623 19638 3165 1 18 . 1 1 29 29 GLY H H 29 7.705 7.705 7.345 0.360 19638 3166 1 18 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.348 -0.230 19638 3167 1 18 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.803 1.114 19638 3168 1 18 . 1 1 31 31 ASN H H 31 11.993 11.993 8.508 3.485 19638 3169 1 18 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.530 -0.070 19638 3170 1 18 . 1 1 32 32 LEU H H 32 9.445 9.445 8.503 0.942 19638 3171 1 18 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.610 -0.504 19638 3172 1 18 . 1 1 33 33 HIS H H 33 8.051 8.051 8.714 -0.663 19638 3173 1 18 . 1 1 34 34 GLY H H 34 9.066 9.066 8.674 0.392 19638 3174 1 18 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.748 -0.187 19638 3175 1 18 . 1 1 35 35 ILE H H 35 7.068 7.068 7.954 -0.886 19638 3176 1 18 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.329 -0.417 19638 3177 1 18 . 1 1 36 36 PHE H H 36 7.901 7.901 7.690 0.211 19638 3178 1 18 . 1 1 37 37 GLY H H 37 8.766 8.766 9.279 -0.513 19638 3179 1 18 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.783 -0.168 19638 3180 1 18 . 1 1 38 38 ARG H H 38 7.962 7.962 7.634 0.328 19638 3181 1 18 . 1 1 39 39 HIS HA H 39 5.062 5.062 5.039 0.023 19638 3182 1 18 . 1 1 39 39 HIS H H 39 8.064 8.064 8.806 -0.742 19638 3183 1 18 . 1 1 40 40 SER HA H 40 4.601 4.601 4.539 0.062 19638 3184 1 18 . 1 1 40 40 SER H H 40 8.588 8.588 8.434 0.154 19638 3185 1 18 . 1 1 41 41 GLY H H 41 8.930 8.930 8.271 0.659 19638 3186 1 18 . 1 1 42 42 GLN H H 42 7.865 7.865 7.904 -0.039 19638 3187 1 18 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.211 0.125 19638 3188 1 18 . 1 1 43 43 ALA H H 43 8.062 8.062 8.439 -0.377 19638 3189 1 18 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.083 0.092 19638 3190 1 18 . 1 1 44 44 GLU H H 44 8.924 8.924 9.002 -0.078 19638 3191 1 18 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.411 -0.566 19638 3192 1 18 . 1 1 46 46 TYR H H 46 7.033 7.033 7.370 -0.337 19638 3193 1 18 . 1 1 47 47 SER HA H 47 4.283 4.283 4.284 -0.001 19638 3194 1 18 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.778 -0.536 19638 3195 1 18 . 1 1 48 48 TYR H H 48 7.905 7.905 8.513 -0.608 19638 3196 1 18 . 1 1 49 49 THR HA H 49 4.124 4.124 4.409 -0.285 19638 3197 1 18 . 1 1 49 49 THR H H 49 9.712 9.712 8.313 1.399 19638 3198 1 18 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.310 -0.049 19638 3199 1 18 . 1 1 50 50 ASP H H 50 8.682 8.682 9.013 -0.331 19638 3200 1 18 . 1 1 51 51 ALA HA H 51 4.182 4.182 4.081 0.101 19638 3201 1 18 . 1 1 51 51 ALA H H 51 7.802 7.802 7.819 -0.017 19638 3202 1 18 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.593 0.094 19638 3203 1 18 . 1 1 52 52 ASN H H 52 8.422 8.422 7.937 0.485 19638 3204 1 18 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.677 0.003 19638 3205 1 18 . 1 1 53 53 ILE H H 53 7.686 7.686 7.831 -0.145 19638 3206 1 18 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.065 -0.136 19638 3207 1 18 . 1 1 54 54 LYS H H 54 9.101 9.101 8.229 0.872 19638 3208 1 18 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.351 -0.315 19638 3209 1 18 . 1 1 55 55 LYS H H 55 7.355 7.355 7.587 -0.232 19638 3210 1 18 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.684 -0.359 19638 3211 1 18 . 1 1 56 56 ASN H H 56 7.506 7.506 8.483 -0.977 19638 3212 1 18 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.097 0.094 19638 3213 1 18 . 1 1 57 57 VAL H H 57 7.341 7.341 8.229 -0.888 19638 3214 1 18 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.103 -0.305 19638 3215 1 18 . 1 1 58 58 LEU H H 58 8.220 8.220 8.118 0.102 19638 3216 1 18 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.612 0.503 19638 3217 1 18 . 1 1 59 59 TRP H H 59 7.973 7.973 8.986 -1.013 19638 3218 1 18 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.939 -0.202 19638 3219 1 18 . 1 1 60 60 ASP H H 60 10.093 10.093 8.476 1.617 19638 3220 1 18 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.427 -1.089 19638 3221 1 18 . 1 1 61 61 GLU H H 61 10.090 10.090 9.033 1.057 19638 3222 1 18 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.624 -0.168 19638 3223 1 18 . 1 1 62 62 ASN H H 62 8.211 8.211 8.583 -0.372 19638 3224 1 18 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.468 0.082 19638 3225 1 18 . 1 1 63 63 ASN H H 63 9.331 9.331 8.340 0.991 19638 3226 1 18 . 1 1 64 64 MET HA H 64 4.321 4.321 4.471 -0.150 19638 3227 1 18 . 1 1 64 64 MET H H 64 8.702 8.702 8.837 -0.135 19638 3228 1 18 . 1 1 65 65 SER HA H 65 3.445 3.445 4.194 -0.749 19638 3229 1 18 . 1 1 65 65 SER H H 65 7.442 7.442 7.880 -0.438 19638 3230 1 18 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.036 -0.179 19638 3231 1 18 . 1 1 66 66 GLU H H 66 7.574 7.574 7.551 0.023 19638 3232 1 18 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.769 0.510 19638 3233 1 18 . 1 1 67 67 HIS H H 67 8.297 8.297 7.278 1.019 19638 3234 1 18 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.118 -0.762 19638 3235 1 18 . 1 1 68 68 LEU H H 68 8.060 8.060 7.357 0.703 19638 3236 1 18 . 1 1 69 69 THR HA H 69 3.792 3.792 4.245 -0.453 19638 3237 1 18 . 1 1 69 69 THR H H 69 7.327 7.327 7.522 -0.195 19638 3238 1 18 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.497 0.530 19638 3239 1 18 . 1 1 70 70 ASN H H 70 6.715 6.715 8.857 -2.142 19638 3240 1 18 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.329 1.632 19638 3241 1 18 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.288 0.837 19638 3242 1 18 . 1 1 72 72 ALA H H 72 9.052 9.052 8.296 0.756 19638 3243 1 18 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.002 0.567 19638 3244 1 18 . 1 1 73 73 LYS H H 73 7.914 7.914 8.503 -0.589 19638 3245 1 18 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.277 0.750 19638 3246 1 18 . 1 1 74 74 TYR H H 74 8.520 8.520 8.310 0.210 19638 3247 1 18 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.514 0.147 19638 3248 1 18 . 1 1 75 75 ILE H H 75 9.542 9.542 7.676 1.866 19638 3249 1 18 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.702 0.425 19638 3250 1 18 . 1 1 77 77 GLY H H 77 9.573 9.573 8.734 0.839 19638 3251 1 18 . 1 1 78 78 THR HA H 78 5.058 5.058 4.656 0.402 19638 3252 1 18 . 1 1 78 78 THR H H 78 9.274 9.274 7.788 1.486 19638 3253 1 18 . 1 1 79 79 LYS H H 79 8.060 8.060 8.681 -0.621 19638 3254 1 18 . 1 1 80 80 MET H H 80 8.670 8.670 7.738 0.932 19638 3255 1 18 . 1 1 81 81 ALA H H 81 8.060 8.060 8.064 -0.004 19638 3256 1 18 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.631 -0.069 19638 3257 1 18 . 1 1 82 82 PHE H H 82 8.446 8.446 8.033 0.413 19638 3258 1 18 . 1 1 83 83 GLY H H 83 7.142 7.142 7.720 -0.578 19638 3259 1 18 . 1 1 84 84 GLY H H 84 8.211 8.211 8.067 0.144 19638 3260 1 18 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.556 -0.301 19638 3261 1 18 . 1 1 85 85 LEU H H 85 8.160 8.160 7.838 0.322 19638 3262 1 18 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.212 -0.257 19638 3263 1 18 . 1 1 86 86 LYS H H 86 8.440 8.440 8.615 -0.175 19638 3264 1 18 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.487 -0.117 19638 3265 1 18 . 1 1 87 87 LYS H H 87 8.800 8.800 7.743 1.057 19638 3266 1 18 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.016 -0.590 19638 3267 1 18 . 1 1 88 88 GLU H H 88 8.971 8.971 9.096 -0.125 19638 3268 1 18 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.964 -0.147 19638 3269 1 18 . 1 1 89 89 LYS H H 89 8.679 8.679 8.258 0.421 19638 3270 1 18 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.425 -0.384 19638 3271 1 18 . 1 1 90 90 ASP H H 90 6.295 6.295 8.412 -2.117 19638 3272 1 18 . 1 1 91 91 ARG HA H 91 3.281 3.281 3.990 -0.709 19638 3273 1 18 . 1 1 91 91 ARG H H 91 7.285 7.285 7.554 -0.269 19638 3274 1 18 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.414 -0.609 19638 3275 1 18 . 1 1 92 92 ASN H H 92 8.541 8.541 8.037 0.504 19638 3276 1 18 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.545 -0.552 19638 3277 1 18 . 1 1 93 93 ASP H H 93 8.518 8.518 7.623 0.895 19638 3278 1 18 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.137 -0.359 19638 3279 1 18 . 1 1 94 94 LEU H H 94 8.167 8.167 7.809 0.358 19638 3280 1 18 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.785 -0.816 19638 3281 1 18 . 1 1 95 95 ILE H H 95 8.718 8.718 8.044 0.674 19638 3282 1 18 . 1 1 96 96 THR HA H 96 3.661 3.661 3.974 -0.313 19638 3283 1 18 . 1 1 96 96 THR H H 96 7.955 7.955 8.200 -0.245 19638 3284 1 18 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.104 -0.112 19638 3285 1 18 . 1 1 97 97 TYR H H 97 7.619 7.619 7.897 -0.278 19638 3286 1 18 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.678 -0.447 19638 3287 1 18 . 1 1 98 98 LEU H H 98 8.933 8.933 7.683 1.250 19638 3288 1 18 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.216 0.276 19638 3289 1 18 . 1 1 99 99 LYS H H 99 8.454 8.454 8.497 -0.043 19638 3290 1 18 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.851 0.243 19638 3291 1 18 . 1 1 100 100 LYS H H 100 6.501 6.501 7.898 -1.397 19638 3292 1 18 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.942 0.013 19638 3293 1 18 . 1 1 101 101 ALA H H 101 8.296 8.296 7.359 0.937 19638 3294 1 18 . 1 1 102 102 THR H H 102 7.330 7.330 7.415 -0.085 19638 3295 1 19 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.553 -0.294 19638 3296 1 19 . 1 1 -3 -3 PHE H H -3 8.608 8.608 7.917 0.691 19638 3297 1 19 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.240 -0.447 19638 3298 1 19 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.737 -1.160 19638 3299 1 19 . 1 1 2 2 SER H H 2 9.424 9.424 8.145 1.279 19638 3300 1 19 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.625 -0.645 19638 3301 1 19 . 1 1 3 3 ALA H H 3 9.092 9.092 8.695 0.397 19638 3302 1 19 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.304 -0.031 19638 3303 1 19 . 1 1 4 4 LYS H H 4 8.086 8.086 8.439 -0.353 19638 3304 1 19 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.168 -0.118 19638 3305 1 19 . 1 1 5 5 LYS H H 5 7.755 7.755 8.563 -0.808 19638 3306 1 19 . 1 1 6 6 GLY H H 6 8.694 8.694 8.520 0.174 19638 3307 1 19 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.055 -0.709 19638 3308 1 19 . 1 1 7 7 ALA H H 7 7.999 7.999 7.239 0.760 19638 3309 1 19 . 1 1 8 8 THR HA H 8 3.898 3.898 4.012 -0.114 19638 3310 1 19 . 1 1 8 8 THR H H 8 7.203 7.203 7.456 -0.253 19638 3311 1 19 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.109 -0.265 19638 3312 1 19 . 1 1 9 9 LEU H H 9 7.846 7.846 8.495 -0.649 19638 3313 1 19 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.111 -0.608 19638 3314 1 19 . 1 1 10 10 PHE H H 10 8.651 8.651 8.287 0.364 19638 3315 1 19 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.998 0.225 19638 3316 1 19 . 1 1 11 11 LYS H H 11 8.365 8.365 7.694 0.671 19638 3317 1 19 . 1 1 12 12 THR HA H 12 4.361 4.361 4.176 0.185 19638 3318 1 19 . 1 1 12 12 THR H H 12 7.959 7.959 8.248 -0.289 19638 3319 1 19 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.614 -0.028 19638 3320 1 19 . 1 1 13 13 ARG H H 13 8.338 8.338 7.961 0.377 19638 3321 1 19 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.368 -3.454 19638 3322 1 19 . 1 1 14 14 CYS H H 14 8.047 8.047 8.218 -0.171 19638 3323 1 19 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.369 1.749 19638 3324 1 19 . 1 1 15 15 LEU H H 15 8.070 8.070 7.754 0.316 19638 3325 1 19 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.966 0.692 19638 3326 1 19 . 1 1 16 16 GLN H H 16 10.022 10.022 8.389 1.633 19638 3327 1 19 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.465 1.723 19638 3328 1 19 . 1 1 17 17 CYS H H 17 9.730 9.730 7.446 2.284 19638 3329 1 19 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.881 3.963 19638 3330 1 19 . 1 1 18 18 HIS H H 18 11.098 11.098 8.685 2.413 19638 3331 1 19 . 1 1 19 19 THR HA H 19 6.298 6.298 4.406 1.892 19638 3332 1 19 . 1 1 19 19 THR H H 19 10.180 10.180 8.766 1.414 19638 3333 1 19 . 1 1 20 20 VAL HA H 20 5.004 5.004 4.026 0.978 19638 3334 1 19 . 1 1 20 20 VAL H H 20 8.927 8.927 8.153 0.773 19638 3335 1 19 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.406 0.213 19638 3336 1 19 . 1 1 21 21 GLU H H 21 9.460 9.460 7.420 2.040 19638 3337 1 19 . 1 1 22 22 LYS HA H 22 3.626 3.626 4.103 -0.477 19638 3338 1 19 . 1 1 22 22 LYS H H 22 9.064 9.064 8.367 0.697 19638 3339 1 19 . 1 1 23 23 GLY H H 23 9.543 9.543 8.316 1.227 19638 3340 1 19 . 1 1 24 24 GLY H H 24 8.296 8.296 7.726 0.570 19638 3341 1 19 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.261 0.236 19638 3342 1 19 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.806 0.469 19638 3343 1 19 . 1 1 26 26 HIS H H 26 8.931 8.931 8.348 0.583 19638 3344 1 19 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.487 0.183 19638 3345 1 19 . 1 1 27 27 LYS H H 27 8.362 8.362 8.101 0.261 19638 3346 1 19 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.916 -0.780 19638 3347 1 19 . 1 1 28 28 VAL H H 28 7.720 7.720 8.094 -0.374 19638 3348 1 19 . 1 1 29 29 GLY H H 29 7.705 7.705 7.314 0.391 19638 3349 1 19 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.114 0.004 19638 3350 1 19 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.825 1.092 19638 3351 1 19 . 1 1 31 31 ASN H H 31 11.993 11.993 8.538 3.455 19638 3352 1 19 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.482 -0.022 19638 3353 1 19 . 1 1 32 32 LEU H H 32 9.445 9.445 8.365 1.080 19638 3354 1 19 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.654 -0.548 19638 3355 1 19 . 1 1 33 33 HIS H H 33 8.051 8.051 8.693 -0.642 19638 3356 1 19 . 1 1 34 34 GLY H H 34 9.066 9.066 8.525 0.541 19638 3357 1 19 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.858 -0.297 19638 3358 1 19 . 1 1 35 35 ILE H H 35 7.068 7.068 7.866 -0.798 19638 3359 1 19 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.509 -0.597 19638 3360 1 19 . 1 1 36 36 PHE H H 36 7.901 7.901 7.690 0.211 19638 3361 1 19 . 1 1 37 37 GLY H H 37 8.766 8.766 9.224 -0.458 19638 3362 1 19 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.551 0.064 19638 3363 1 19 . 1 1 38 38 ARG H H 38 7.962 7.962 7.542 0.420 19638 3364 1 19 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.927 0.135 19638 3365 1 19 . 1 1 39 39 HIS H H 39 8.064 8.064 8.731 -0.667 19638 3366 1 19 . 1 1 40 40 SER HA H 40 4.601 4.601 4.423 0.178 19638 3367 1 19 . 1 1 40 40 SER H H 40 8.588 8.588 8.305 0.283 19638 3368 1 19 . 1 1 41 41 GLY H H 41 8.930 8.930 8.257 0.673 19638 3369 1 19 . 1 1 42 42 GLN H H 42 7.865 7.865 7.892 -0.027 19638 3370 1 19 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.309 0.027 19638 3371 1 19 . 1 1 43 43 ALA H H 43 8.062 8.062 7.803 0.259 19638 3372 1 19 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.577 -0.402 19638 3373 1 19 . 1 1 44 44 GLU H H 44 8.924 8.924 8.576 0.348 19638 3374 1 19 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.609 -0.764 19638 3375 1 19 . 1 1 46 46 TYR H H 46 7.033 7.033 7.330 -0.297 19638 3376 1 19 . 1 1 47 47 SER HA H 47 4.283 4.283 4.425 -0.142 19638 3377 1 19 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.772 -0.530 19638 3378 1 19 . 1 1 48 48 TYR H H 48 7.905 7.905 8.525 -0.620 19638 3379 1 19 . 1 1 49 49 THR HA H 49 4.124 4.124 4.416 -0.292 19638 3380 1 19 . 1 1 49 49 THR H H 49 9.712 9.712 8.493 1.219 19638 3381 1 19 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.300 -0.039 19638 3382 1 19 . 1 1 50 50 ASP H H 50 8.682 8.682 9.044 -0.362 19638 3383 1 19 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.908 0.274 19638 3384 1 19 . 1 1 51 51 ALA H H 51 7.802 7.802 8.292 -0.490 19638 3385 1 19 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.656 0.031 19638 3386 1 19 . 1 1 52 52 ASN H H 52 8.422 8.422 8.378 0.044 19638 3387 1 19 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.681 -0.001 19638 3388 1 19 . 1 1 53 53 ILE H H 53 7.686 7.686 7.846 -0.160 19638 3389 1 19 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.082 -0.153 19638 3390 1 19 . 1 1 54 54 LYS H H 54 9.101 9.101 8.278 0.823 19638 3391 1 19 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.416 -0.380 19638 3392 1 19 . 1 1 55 55 LYS H H 55 7.355 7.355 7.817 -0.462 19638 3393 1 19 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.700 -0.375 19638 3394 1 19 . 1 1 56 56 ASN H H 56 7.506 7.506 8.495 -0.989 19638 3395 1 19 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.214 -0.023 19638 3396 1 19 . 1 1 57 57 VAL H H 57 7.341 7.341 8.338 -0.997 19638 3397 1 19 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.261 -0.463 19638 3398 1 19 . 1 1 58 58 LEU H H 58 8.220 8.220 8.315 -0.095 19638 3399 1 19 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.617 0.498 19638 3400 1 19 . 1 1 59 59 TRP H H 59 7.973 7.973 9.074 -1.101 19638 3401 1 19 . 1 1 60 60 ASP HA H 60 4.737 4.737 5.048 -0.311 19638 3402 1 19 . 1 1 60 60 ASP H H 60 10.093 10.093 8.179 1.914 19638 3403 1 19 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.061 -0.723 19638 3404 1 19 . 1 1 61 61 GLU H H 61 10.090 10.090 8.776 1.314 19638 3405 1 19 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.561 -0.105 19638 3406 1 19 . 1 1 62 62 ASN H H 62 8.211 8.211 8.347 -0.136 19638 3407 1 19 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.501 0.049 19638 3408 1 19 . 1 1 63 63 ASN H H 63 9.331 9.331 8.420 0.911 19638 3409 1 19 . 1 1 64 64 MET HA H 64 4.321 4.321 4.346 -0.025 19638 3410 1 19 . 1 1 64 64 MET H H 64 8.702 8.702 8.880 -0.178 19638 3411 1 19 . 1 1 65 65 SER HA H 65 3.445 3.445 4.191 -0.746 19638 3412 1 19 . 1 1 65 65 SER H H 65 7.442 7.442 7.830 -0.388 19638 3413 1 19 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.077 -0.220 19638 3414 1 19 . 1 1 66 66 GLU H H 66 7.574 7.574 7.582 -0.008 19638 3415 1 19 . 1 1 67 67 HIS HA H 67 4.279 4.279 4.104 0.175 19638 3416 1 19 . 1 1 67 67 HIS H H 67 8.297 8.297 7.807 0.490 19638 3417 1 19 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.080 -0.724 19638 3418 1 19 . 1 1 68 68 LEU H H 68 8.060 8.060 7.634 0.426 19638 3419 1 19 . 1 1 69 69 THR HA H 69 3.792 3.792 4.119 -0.327 19638 3420 1 19 . 1 1 69 69 THR H H 69 7.327 7.327 7.659 -0.332 19638 3421 1 19 . 1 1 70 70 ASN HA H 70 5.027 5.027 5.166 -0.139 19638 3422 1 19 . 1 1 70 70 ASN H H 70 6.715 6.715 7.719 -1.004 19638 3423 1 19 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.139 1.822 19638 3424 1 19 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.066 1.059 19638 3425 1 19 . 1 1 72 72 ALA H H 72 9.052 9.052 8.194 0.858 19638 3426 1 19 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.195 0.374 19638 3427 1 19 . 1 1 73 73 LYS H H 73 7.914 7.914 7.754 0.160 19638 3428 1 19 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.241 0.786 19638 3429 1 19 . 1 1 74 74 TYR H H 74 8.520 8.520 7.449 1.071 19638 3430 1 19 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.751 -0.090 19638 3431 1 19 . 1 1 75 75 ILE H H 75 9.542 9.542 7.512 2.030 19638 3432 1 19 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.511 0.616 19638 3433 1 19 . 1 1 77 77 GLY H H 77 9.573 9.573 8.828 0.745 19638 3434 1 19 . 1 1 78 78 THR HA H 78 5.058 5.058 4.708 0.350 19638 3435 1 19 . 1 1 78 78 THR H H 78 9.274 9.274 7.580 1.694 19638 3436 1 19 . 1 1 79 79 LYS H H 79 8.060 8.060 8.725 -0.665 19638 3437 1 19 . 1 1 80 80 MET H H 80 8.670 8.670 7.923 0.747 19638 3438 1 19 . 1 1 81 81 ALA H H 81 8.060 8.060 8.585 -0.525 19638 3439 1 19 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.656 -0.094 19638 3440 1 19 . 1 1 82 82 PHE H H 82 8.446 8.446 7.939 0.507 19638 3441 1 19 . 1 1 83 83 GLY H H 83 7.142 7.142 7.627 -0.485 19638 3442 1 19 . 1 1 84 84 GLY H H 84 8.211 8.211 8.047 0.164 19638 3443 1 19 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.589 -0.334 19638 3444 1 19 . 1 1 85 85 LEU H H 85 8.160 8.160 8.191 -0.031 19638 3445 1 19 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.325 -0.370 19638 3446 1 19 . 1 1 86 86 LYS H H 86 8.440 8.440 8.755 -0.315 19638 3447 1 19 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.458 -0.088 19638 3448 1 19 . 1 1 87 87 LYS H H 87 8.800 8.800 7.798 1.002 19638 3449 1 19 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.057 -0.631 19638 3450 1 19 . 1 1 88 88 GLU H H 88 8.971 8.971 8.945 0.026 19638 3451 1 19 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.984 -0.167 19638 3452 1 19 . 1 1 89 89 LYS H H 89 8.679 8.679 8.462 0.217 19638 3453 1 19 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.429 -0.388 19638 3454 1 19 . 1 1 90 90 ASP H H 90 6.295 6.295 8.496 -2.201 19638 3455 1 19 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.024 -0.743 19638 3456 1 19 . 1 1 91 91 ARG H H 91 7.285 7.285 7.566 -0.281 19638 3457 1 19 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.545 -0.740 19638 3458 1 19 . 1 1 92 92 ASN H H 92 8.541 8.541 8.159 0.382 19638 3459 1 19 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.586 -0.593 19638 3460 1 19 . 1 1 93 93 ASP H H 93 8.518 8.518 7.648 0.870 19638 3461 1 19 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.161 -0.383 19638 3462 1 19 . 1 1 94 94 LEU H H 94 8.167 8.167 7.703 0.464 19638 3463 1 19 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.755 -0.786 19638 3464 1 19 . 1 1 95 95 ILE H H 95 8.718 8.718 7.661 1.057 19638 3465 1 19 . 1 1 96 96 THR HA H 96 3.661 3.661 3.940 -0.279 19638 3466 1 19 . 1 1 96 96 THR H H 96 7.955 7.955 8.256 -0.301 19638 3467 1 19 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.057 -0.065 19638 3468 1 19 . 1 1 97 97 TYR H H 97 7.619 7.619 8.490 -0.871 19638 3469 1 19 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.680 -0.449 19638 3470 1 19 . 1 1 98 98 LEU H H 98 8.933 8.933 7.747 1.186 19638 3471 1 19 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.350 0.142 19638 3472 1 19 . 1 1 99 99 LYS H H 99 8.454 8.454 8.126 0.328 19638 3473 1 19 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.892 0.202 19638 3474 1 19 . 1 1 100 100 LYS H H 100 6.501 6.501 7.908 -1.407 19638 3475 1 19 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.011 -0.056 19638 3476 1 19 . 1 1 101 101 ALA H H 101 8.296 8.296 7.349 0.947 19638 3477 1 19 . 1 1 102 102 THR H H 102 7.330 7.330 7.558 -0.228 19638 3478 1 20 . 1 1 -3 -3 PHE HA H -3 4.259 4.259 4.674 -0.415 19638 3479 1 20 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.386 0.222 19638 3480 1 20 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.429 -0.636 19638 3481 1 20 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.914 -1.337 19638 3482 1 20 . 1 1 2 2 SER H H 2 9.424 9.424 8.532 0.892 19638 3483 1 20 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.206 -0.226 19638 3484 1 20 . 1 1 3 3 ALA H H 3 9.092 9.092 8.748 0.344 19638 3485 1 20 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.000 0.273 19638 3486 1 20 . 1 1 4 4 LYS H H 4 8.086 8.086 8.190 -0.104 19638 3487 1 20 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.065 -0.015 19638 3488 1 20 . 1 1 5 5 LYS H H 5 7.755 7.755 8.463 -0.708 19638 3489 1 20 . 1 1 6 6 GLY H H 6 8.694 8.694 8.256 0.438 19638 3490 1 20 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.084 -0.738 19638 3491 1 20 . 1 1 7 7 ALA H H 7 7.999 7.999 8.198 -0.200 19638 3492 1 20 . 1 1 8 8 THR HA H 8 3.898 3.898 3.969 -0.071 19638 3493 1 20 . 1 1 8 8 THR H H 8 7.203 7.203 7.485 -0.282 19638 3494 1 20 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.039 -0.195 19638 3495 1 20 . 1 1 9 9 LEU H H 9 7.846 7.846 7.845 0.001 19638 3496 1 20 . 1 1 10 10 PHE HA H 10 3.503 3.503 3.918 -0.415 19638 3497 1 20 . 1 1 10 10 PHE H H 10 8.651 8.651 8.328 0.323 19638 3498 1 20 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.918 0.305 19638 3499 1 20 . 1 1 11 11 LYS H H 11 8.365 8.365 7.801 0.564 19638 3500 1 20 . 1 1 12 12 THR HA H 12 4.361 4.361 4.127 0.234 19638 3501 1 20 . 1 1 12 12 THR H H 12 7.959 7.959 8.132 -0.173 19638 3502 1 20 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.431 0.155 19638 3503 1 20 . 1 1 13 13 ARG H H 13 8.338 8.338 7.723 0.615 19638 3504 1 20 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.204 -3.290 19638 3505 1 20 . 1 1 14 14 CYS H H 14 8.047 8.047 8.214 -0.167 19638 3506 1 20 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.190 1.928 19638 3507 1 20 . 1 1 15 15 LEU H H 15 8.070 8.070 7.675 0.395 19638 3508 1 20 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.909 0.750 19638 3509 1 20 . 1 1 16 16 GLN H H 16 10.022 10.022 8.243 1.779 19638 3510 1 20 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.419 1.769 19638 3511 1 20 . 1 1 17 17 CYS H H 17 9.730 9.730 7.386 2.344 19638 3512 1 20 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.923 3.921 19638 3513 1 20 . 1 1 18 18 HIS H H 18 11.098 11.098 8.562 2.536 19638 3514 1 20 . 1 1 19 19 THR HA H 19 6.298 6.298 4.301 1.997 19638 3515 1 20 . 1 1 19 19 THR H H 19 10.180 10.180 8.682 1.498 19638 3516 1 20 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.932 1.072 19638 3517 1 20 . 1 1 20 20 VAL H H 20 8.927 8.927 8.142 0.785 19638 3518 1 20 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.474 0.145 19638 3519 1 20 . 1 1 21 21 GLU H H 21 9.460 9.460 7.361 2.099 19638 3520 1 20 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.939 -0.313 19638 3521 1 20 . 1 1 22 22 LYS H H 22 9.064 9.064 8.712 0.352 19638 3522 1 20 . 1 1 23 23 GLY H H 23 9.543 9.543 7.960 1.583 19638 3523 1 20 . 1 1 24 24 GLY H H 24 8.296 8.296 7.587 0.709 19638 3524 1 20 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.186 0.311 19638 3525 1 20 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.170 1.105 19638 3526 1 20 . 1 1 26 26 HIS H H 26 8.931 8.931 8.675 0.256 19638 3527 1 20 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.075 0.595 19638 3528 1 20 . 1 1 27 27 LYS H H 27 8.362 8.362 8.077 0.285 19638 3529 1 20 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.871 -0.735 19638 3530 1 20 . 1 1 28 28 VAL H H 28 7.720 7.720 8.101 -0.381 19638 3531 1 20 . 1 1 29 29 GLY H H 29 7.705 7.705 7.267 0.438 19638 3532 1 20 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.383 -0.265 19638 3533 1 20 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.882 1.035 19638 3534 1 20 . 1 1 31 31 ASN H H 31 11.993 11.993 8.126 3.867 19638 3535 1 20 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.534 -0.074 19638 3536 1 20 . 1 1 32 32 LEU H H 32 9.445 9.445 8.653 0.792 19638 3537 1 20 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.777 -0.671 19638 3538 1 20 . 1 1 33 33 HIS H H 33 8.051 8.051 8.375 -0.324 19638 3539 1 20 . 1 1 34 34 GLY H H 34 9.066 9.066 8.747 0.319 19638 3540 1 20 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.715 -0.154 19638 3541 1 20 . 1 1 35 35 ILE H H 35 7.068 7.068 8.059 -0.991 19638 3542 1 20 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.442 -0.530 19638 3543 1 20 . 1 1 36 36 PHE H H 36 7.901 7.901 7.816 0.085 19638 3544 1 20 . 1 1 37 37 GLY H H 37 8.766 8.766 9.278 -0.512 19638 3545 1 20 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.556 0.059 19638 3546 1 20 . 1 1 38 38 ARG H H 38 7.962 7.962 7.551 0.411 19638 3547 1 20 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.901 0.161 19638 3548 1 20 . 1 1 39 39 HIS H H 39 8.064 8.064 8.781 -0.717 19638 3549 1 20 . 1 1 40 40 SER HA H 40 4.601 4.601 4.216 0.385 19638 3550 1 20 . 1 1 40 40 SER H H 40 8.588 8.588 8.167 0.421 19638 3551 1 20 . 1 1 41 41 GLY H H 41 8.930 8.930 8.236 0.694 19638 3552 1 20 . 1 1 42 42 GLN H H 42 7.865 7.865 7.837 0.028 19638 3553 1 20 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.421 -0.085 19638 3554 1 20 . 1 1 43 43 ALA H H 43 8.062 8.062 8.523 -0.461 19638 3555 1 20 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.075 0.100 19638 3556 1 20 . 1 1 44 44 GLU H H 44 8.924 8.924 8.807 0.117 19638 3557 1 20 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.536 -0.691 19638 3558 1 20 . 1 1 46 46 TYR H H 46 7.033 7.033 7.495 -0.462 19638 3559 1 20 . 1 1 47 47 SER HA H 47 4.283 4.283 4.415 -0.132 19638 3560 1 20 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.742 -0.500 19638 3561 1 20 . 1 1 48 48 TYR H H 48 7.905 7.905 8.596 -0.691 19638 3562 1 20 . 1 1 49 49 THR HA H 49 4.124 4.124 4.295 -0.171 19638 3563 1 20 . 1 1 49 49 THR H H 49 9.712 9.712 8.472 1.240 19638 3564 1 20 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.344 -0.083 19638 3565 1 20 . 1 1 50 50 ASP H H 50 8.682 8.682 8.956 -0.274 19638 3566 1 20 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.930 0.252 19638 3567 1 20 . 1 1 51 51 ALA H H 51 7.802 7.802 8.098 -0.296 19638 3568 1 20 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.635 0.052 19638 3569 1 20 . 1 1 52 52 ASN H H 52 8.422 8.422 8.260 0.162 19638 3570 1 20 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.686 -0.006 19638 3571 1 20 . 1 1 53 53 ILE H H 53 7.686 7.686 8.095 -0.409 19638 3572 1 20 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.064 -0.135 19638 3573 1 20 . 1 1 54 54 LYS H H 54 9.101 9.101 8.072 1.029 19638 3574 1 20 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.407 -0.371 19638 3575 1 20 . 1 1 55 55 LYS H H 55 7.355 7.355 7.755 -0.400 19638 3576 1 20 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.767 -0.442 19638 3577 1 20 . 1 1 56 56 ASN H H 56 7.506 7.506 8.485 -0.979 19638 3578 1 20 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.283 -0.092 19638 3579 1 20 . 1 1 57 57 VAL H H 57 7.341 7.341 8.454 -1.113 19638 3580 1 20 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.280 -0.482 19638 3581 1 20 . 1 1 58 58 LEU H H 58 8.220 8.220 8.310 -0.090 19638 3582 1 20 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.657 0.458 19638 3583 1 20 . 1 1 59 59 TRP H H 59 7.973 7.973 8.975 -1.002 19638 3584 1 20 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.906 -0.169 19638 3585 1 20 . 1 1 60 60 ASP H H 60 10.093 10.093 8.300 1.793 19638 3586 1 20 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.245 -0.907 19638 3587 1 20 . 1 1 61 61 GLU H H 61 10.090 10.090 8.876 1.214 19638 3588 1 20 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.545 -0.089 19638 3589 1 20 . 1 1 62 62 ASN H H 62 8.211 8.211 8.360 -0.149 19638 3590 1 20 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.390 0.160 19638 3591 1 20 . 1 1 63 63 ASN H H 63 9.331 9.331 9.480 -0.149 19638 3592 1 20 . 1 1 64 64 MET HA H 64 4.321 4.321 4.345 -0.024 19638 3593 1 20 . 1 1 64 64 MET H H 64 8.702 8.702 8.512 0.190 19638 3594 1 20 . 1 1 65 65 SER HA H 65 3.445 3.445 4.219 -0.774 19638 3595 1 20 . 1 1 65 65 SER H H 65 7.442 7.442 7.826 -0.384 19638 3596 1 20 . 1 1 66 66 GLU HA H 66 3.857 3.857 3.926 -0.069 19638 3597 1 20 . 1 1 66 66 GLU H H 66 7.574 7.574 7.496 0.078 19638 3598 1 20 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.601 0.678 19638 3599 1 20 . 1 1 67 67 HIS H H 67 8.297 8.297 7.554 0.743 19638 3600 1 20 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.139 -0.783 19638 3601 1 20 . 1 1 68 68 LEU H H 68 8.060 8.060 7.667 0.393 19638 3602 1 20 . 1 1 69 69 THR HA H 69 3.792 3.792 4.375 -0.583 19638 3603 1 20 . 1 1 69 69 THR H H 69 7.327 7.327 7.643 -0.316 19638 3604 1 20 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.428 0.599 19638 3605 1 20 . 1 1 70 70 ASN H H 70 6.715 6.715 8.855 -2.140 19638 3606 1 20 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.317 1.644 19638 3607 1 20 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.170 0.955 19638 3608 1 20 . 1 1 72 72 ALA H H 72 9.052 9.052 8.427 0.625 19638 3609 1 20 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.361 0.208 19638 3610 1 20 . 1 1 73 73 LYS H H 73 7.914 7.914 7.753 0.161 19638 3611 1 20 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.579 0.448 19638 3612 1 20 . 1 1 74 74 TYR H H 74 8.520 8.520 7.554 0.966 19638 3613 1 20 . 1 1 75 75 ILE HA H 75 4.661 4.661 3.785 0.876 19638 3614 1 20 . 1 1 75 75 ILE H H 75 9.542 9.542 8.412 1.130 19638 3615 1 20 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.536 0.591 19638 3616 1 20 . 1 1 77 77 GLY H H 77 9.573 9.573 8.804 0.769 19638 3617 1 20 . 1 1 78 78 THR HA H 78 5.058 5.058 4.543 0.515 19638 3618 1 20 . 1 1 78 78 THR H H 78 9.274 9.274 7.535 1.739 19638 3619 1 20 . 1 1 79 79 LYS H H 79 8.060 8.060 8.614 -0.554 19638 3620 1 20 . 1 1 80 80 MET H H 80 8.670 8.670 7.525 1.145 19638 3621 1 20 . 1 1 81 81 ALA H H 81 8.060 8.060 8.706 -0.646 19638 3622 1 20 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.629 -0.067 19638 3623 1 20 . 1 1 82 82 PHE H H 82 8.446 8.446 7.734 0.712 19638 3624 1 20 . 1 1 83 83 GLY H H 83 7.142 7.142 7.327 -0.185 19638 3625 1 20 . 1 1 84 84 GLY H H 84 8.211 8.211 8.310 -0.099 19638 3626 1 20 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.277 -0.022 19638 3627 1 20 . 1 1 85 85 LEU H H 85 8.160 8.160 7.414 0.746 19638 3628 1 20 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.211 -0.256 19638 3629 1 20 . 1 1 86 86 LYS H H 86 8.440 8.440 8.358 0.082 19638 3630 1 20 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.119 0.251 19638 3631 1 20 . 1 1 87 87 LYS H H 87 8.800 8.800 8.399 0.401 19638 3632 1 20 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.311 -0.885 19638 3633 1 20 . 1 1 88 88 GLU H H 88 8.971 8.971 7.988 0.983 19638 3634 1 20 . 1 1 89 89 LYS HA H 89 3.817 3.817 3.927 -0.110 19638 3635 1 20 . 1 1 89 89 LYS H H 89 8.679 8.679 8.728 -0.049 19638 3636 1 20 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.388 -0.347 19638 3637 1 20 . 1 1 90 90 ASP H H 90 6.295 6.295 8.682 -2.387 19638 3638 1 20 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.031 -0.750 19638 3639 1 20 . 1 1 91 91 ARG H H 91 7.285 7.285 7.862 -0.577 19638 3640 1 20 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.483 -0.678 19638 3641 1 20 . 1 1 92 92 ASN H H 92 8.541 8.541 7.660 0.881 19638 3642 1 20 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.458 -0.465 19638 3643 1 20 . 1 1 93 93 ASP H H 93 8.518 8.518 8.723 -0.205 19638 3644 1 20 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.175 -0.397 19638 3645 1 20 . 1 1 94 94 LEU H H 94 8.167 8.167 8.325 -0.158 19638 3646 1 20 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.826 -0.857 19638 3647 1 20 . 1 1 95 95 ILE H H 95 8.718 8.718 7.696 1.022 19638 3648 1 20 . 1 1 96 96 THR HA H 96 3.661 3.661 3.934 -0.273 19638 3649 1 20 . 1 1 96 96 THR H H 96 7.955 7.955 8.348 -0.393 19638 3650 1 20 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.071 -0.079 19638 3651 1 20 . 1 1 97 97 TYR H H 97 7.619 7.619 8.305 -0.686 19638 3652 1 20 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.714 -0.483 19638 3653 1 20 . 1 1 98 98 LEU H H 98 8.933 8.933 7.701 1.232 19638 3654 1 20 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.195 0.297 19638 3655 1 20 . 1 1 99 99 LYS H H 99 8.454 8.454 8.289 0.165 19638 3656 1 20 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.886 0.208 19638 3657 1 20 . 1 1 100 100 LYS H H 100 6.501 6.501 7.903 -1.402 19638 3658 1 20 . 1 1 101 101 ALA HA H 101 3.955 3.955 3.982 -0.027 19638 3659 1 20 . 1 1 101 101 ALA H H 101 8.296 8.296 7.495 0.801 19638 3660 1 20 . 1 1 102 102 THR H H 102 7.330 7.330 7.518 -0.188 19638 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 0 0.000 0.000 0.000 19638 2 1 1 "Average Difference" HA 86 0.806 -0.028 0.810 19638 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19638 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19638 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19638 6 1 1 "Average Difference" HN 97 0.926 -0.261 0.893 19638 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19638 8 1 2 "Average Difference" HA 86 0.820 -0.011 0.825 19638 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19638 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19638 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19638 12 1 2 "Average Difference" HN 97 0.966 -0.268 0.932 19638 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19638 14 1 3 "Average Difference" HA 86 0.823 -0.017 0.828 19638 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19638 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19638 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19638 18 1 3 "Average Difference" HN 97 0.916 -0.275 0.878 19638 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19638 20 1 4 "Average Difference" HA 86 0.804 -0.009 0.809 19638 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19638 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19638 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19638 24 1 4 "Average Difference" HN 97 0.931 -0.264 0.897 19638 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19638 26 1 5 "Average Difference" HA 86 0.832 -0.042 0.836 19638 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19638 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19638 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19638 30 1 5 "Average Difference" HN 97 0.961 -0.321 0.910 19638 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19638 32 1 6 "Average Difference" HA 86 0.821 -0.020 0.825 19638 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19638 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19638 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19638 36 1 6 "Average Difference" HN 97 0.933 -0.234 0.908 19638 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19638 38 1 7 "Average Difference" HA 86 0.812 -0.004 0.817 19638 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19638 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19638 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19638 42 1 7 "Average Difference" HN 97 0.921 -0.206 0.903 19638 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19638 44 1 8 "Average Difference" HA 86 0.829 -0.024 0.834 19638 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19638 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19638 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19638 48 1 8 "Average Difference" HN 97 0.986 -0.270 0.953 19638 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19638 50 1 9 "Average Difference" HA 86 0.814 -0.029 0.819 19638 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19638 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19638 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19638 54 1 9 "Average Difference" HN 97 0.952 -0.284 0.913 19638 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19638 56 1 10 "Average Difference" HA 86 0.829 -0.019 0.834 19638 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19638 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19638 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19638 60 1 10 "Average Difference" HN 97 0.936 -0.264 0.903 19638 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19638 62 1 11 "Average Difference" HA 86 0.826 -0.033 0.831 19638 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19638 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19638 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19638 66 1 11 "Average Difference" HN 97 1.007 -0.287 0.970 19638 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19638 68 1 12 "Average Difference" HA 86 0.811 -0.011 0.816 19638 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19638 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19638 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19638 72 1 12 "Average Difference" HN 97 0.924 -0.269 0.889 19638 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19638 74 1 13 "Average Difference" HA 86 0.805 -0.018 0.810 19638 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19638 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19638 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19638 78 1 13 "Average Difference" HN 97 0.922 -0.281 0.883 19638 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19638 80 1 14 "Average Difference" HA 86 0.815 -0.017 0.820 19638 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19638 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19638 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19638 84 1 14 "Average Difference" HN 97 0.932 -0.247 0.903 19638 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19638 86 1 15 "Average Difference" HA 86 0.817 -0.012 0.821 19638 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19638 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19638 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19638 90 1 15 "Average Difference" HN 97 0.916 -0.278 0.877 19638 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19638 92 1 16 "Average Difference" HA 86 0.819 -0.030 0.824 19638 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19638 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19638 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19638 96 1 16 "Average Difference" HN 97 0.936 -0.262 0.904 19638 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19638 98 1 17 "Average Difference" HA 86 0.825 -0.018 0.829 19638 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19638 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19638 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19638 102 1 17 "Average Difference" HN 97 0.981 -0.266 0.949 19638 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19638 104 1 18 "Average Difference" HA 86 0.809 0.008 0.813 19638 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19638 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19638 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19638 108 1 18 "Average Difference" HN 97 0.926 -0.247 0.898 19638 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19638 110 1 19 "Average Difference" HA 86 0.811 0.026 0.816 19638 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19638 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19638 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19638 114 1 19 "Average Difference" HN 97 0.937 -0.274 0.901 19638 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19638 116 1 20 "Average Difference" HA 86 0.825 -0.040 0.829 19638 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19638 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19638 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19638 120 1 20 "Average Difference" HN 97 0.962 -0.236 0.937 19638 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 19638 _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 -3 -3 PHE HA H -3 4.259 4.259 4.652 -0.393 19638 2 1 . 1 1 -3 -3 PHE H H -3 8.608 8.608 8.073 0.535 19638 3 1 . 1 1 -2 -2 LYS HA H -2 3.793 3.793 4.314 -0.521 19638 4 1 . 1 1 -2 -2 LYS H H -2 6.577 6.577 7.889 -1.312 19638 5 1 . 1 1 2 2 SER H H 2 9.424 9.424 8.525 0.899 19638 6 1 . 1 1 3 3 ALA HA H 3 3.980 3.980 4.406 -0.426 19638 7 1 . 1 1 3 3 ALA H H 3 9.092 9.092 8.415 0.677 19638 8 1 . 1 1 4 4 LYS HA H 4 4.273 4.273 4.026 0.247 19638 9 1 . 1 1 4 4 LYS H H 4 8.086 8.086 8.300 -0.214 19638 10 1 . 1 1 5 5 LYS HA H 5 4.050 4.050 4.091 -0.041 19638 11 1 . 1 1 5 5 LYS H H 5 7.755 7.755 8.051 -0.296 19638 12 1 . 1 1 6 6 GLY H H 6 8.694 8.694 8.151 0.543 19638 13 1 . 1 1 7 7 ALA HA H 7 2.346 2.346 3.206 -0.860 19638 14 1 . 1 1 7 7 ALA H H 7 7.999 7.999 8.113 -0.114 19638 15 1 . 1 1 8 8 THR HA H 8 3.898 3.898 4.001 -0.103 19638 16 1 . 1 1 8 8 THR H H 8 7.203 7.203 7.577 -0.374 19638 17 1 . 1 1 9 9 LEU HA H 9 3.844 3.844 4.107 -0.263 19638 18 1 . 1 1 9 9 LEU H H 9 7.846 7.846 7.977 -0.131 19638 19 1 . 1 1 10 10 PHE HA H 10 3.503 3.503 4.043 -0.540 19638 20 1 . 1 1 10 10 PHE H H 10 8.651 8.651 8.430 0.221 19638 21 1 . 1 1 11 11 LYS HA H 11 4.223 4.223 3.955 0.268 19638 22 1 . 1 1 11 11 LYS H H 11 8.365 8.365 7.965 0.400 19638 23 1 . 1 1 12 12 THR HA H 12 4.361 4.361 4.174 0.187 19638 24 1 . 1 1 12 12 THR H H 12 7.959 7.959 8.211 -0.252 19638 25 1 . 1 1 13 13 ARG HA H 13 4.586 4.586 4.577 0.009 19638 26 1 . 1 1 13 13 ARG H H 13 8.338 8.338 7.852 0.487 19638 27 1 . 1 1 14 14 CYS HA H 14 0.914 0.914 4.344 -3.430 19638 28 1 . 1 1 14 14 CYS H H 14 8.047 8.047 8.225 -0.178 19638 29 1 . 1 1 15 15 LEU HA H 15 6.118 6.118 4.332 1.786 19638 30 1 . 1 1 15 15 LEU H H 15 8.070 8.070 7.710 0.360 19638 31 1 . 1 1 16 16 GLN HA H 16 4.658 4.658 3.985 0.673 19638 32 1 . 1 1 16 16 GLN H H 16 10.022 10.022 8.393 1.629 19638 33 1 . 1 1 17 17 CYS HA H 17 6.188 6.188 4.457 1.731 19638 34 1 . 1 1 17 17 CYS H H 17 9.730 9.730 7.441 2.289 19638 35 1 . 1 1 18 18 HIS HA H 18 8.844 8.844 4.905 3.939 19638 36 1 . 1 1 18 18 HIS H H 18 11.098 11.098 8.632 2.466 19638 37 1 . 1 1 19 19 THR HA H 19 6.298 6.298 4.374 1.924 19638 38 1 . 1 1 19 19 THR H H 19 10.180 10.180 8.767 1.413 19638 39 1 . 1 1 20 20 VAL HA H 20 5.004 5.004 3.922 1.082 19638 40 1 . 1 1 20 20 VAL H H 20 8.927 8.927 8.168 0.759 19638 41 1 . 1 1 21 21 GLU HA H 21 4.619 4.619 4.422 0.197 19638 42 1 . 1 1 21 21 GLU H H 21 9.460 9.460 7.487 1.973 19638 43 1 . 1 1 22 22 LYS HA H 22 3.626 3.626 3.902 -0.277 19638 44 1 . 1 1 22 22 LYS H H 22 9.064 9.064 8.441 0.623 19638 45 1 . 1 1 23 23 GLY H H 23 9.543 9.543 8.157 1.386 19638 46 1 . 1 1 24 24 GLY H H 24 8.296 8.296 7.631 0.665 19638 47 1 . 1 1 25 25 PRO HA H 25 4.497 4.497 4.296 0.201 19638 48 1 . 1 1 26 26 HIS HA H 26 5.275 5.275 4.592 0.683 19638 49 1 . 1 1 26 26 HIS H H 26 8.931 8.931 8.310 0.621 19638 50 1 . 1 1 27 27 LYS HA H 27 4.670 4.670 4.361 0.309 19638 51 1 . 1 1 27 27 LYS H H 27 8.362 8.362 8.139 0.223 19638 52 1 . 1 1 28 28 VAL HA H 28 3.136 3.136 3.842 -0.706 19638 53 1 . 1 1 28 28 VAL H H 28 7.720 7.720 8.248 -0.528 19638 54 1 . 1 1 29 29 GLY H H 29 7.705 7.705 7.464 0.241 19638 55 1 . 1 1 30 30 PRO HA H 30 4.118 4.118 4.228 -0.110 19638 56 1 . 1 1 31 31 ASN HA H 31 5.917 5.917 4.749 1.168 19638 57 1 . 1 1 31 31 ASN H H 31 11.993 11.993 8.302 3.691 19638 58 1 . 1 1 32 32 LEU HA H 32 4.460 4.460 4.490 -0.030 19638 59 1 . 1 1 32 32 LEU H H 32 9.445 9.445 8.438 1.007 19638 60 1 . 1 1 33 33 HIS HA H 33 4.106 4.106 4.636 -0.530 19638 61 1 . 1 1 33 33 HIS H H 33 8.051 8.051 8.561 -0.510 19638 62 1 . 1 1 34 34 GLY H H 34 9.066 9.066 8.537 0.529 19638 63 1 . 1 1 35 35 ILE HA H 35 3.561 3.561 3.844 -0.283 19638 64 1 . 1 1 35 35 ILE H H 35 7.068 7.068 7.884 -0.816 19638 65 1 . 1 1 36 36 PHE HA H 36 3.912 3.912 4.364 -0.452 19638 66 1 . 1 1 36 36 PHE H H 36 7.901 7.901 7.693 0.208 19638 67 1 . 1 1 37 37 GLY H H 37 8.766 8.766 9.192 -0.426 19638 68 1 . 1 1 38 38 ARG HA H 38 4.615 4.615 4.611 0.004 19638 69 1 . 1 1 38 38 ARG H H 38 7.962 7.962 7.555 0.407 19638 70 1 . 1 1 39 39 HIS HA H 39 5.062 5.062 4.959 0.103 19638 71 1 . 1 1 39 39 HIS H H 39 8.064 8.064 8.708 -0.644 19638 72 1 . 1 1 40 40 SER HA H 40 4.601 4.601 4.345 0.256 19638 73 1 . 1 1 40 40 SER H H 40 8.588 8.588 8.385 0.203 19638 74 1 . 1 1 41 41 GLY H H 41 8.930 8.930 8.339 0.591 19638 75 1 . 1 1 42 42 GLN H H 42 7.865 7.865 8.012 -0.147 19638 76 1 . 1 1 43 43 ALA HA H 43 4.336 4.336 4.288 0.048 19638 77 1 . 1 1 43 43 ALA H H 43 8.062 8.062 8.201 -0.139 19638 78 1 . 1 1 44 44 GLU HA H 44 4.175 4.175 4.193 -0.018 19638 79 1 . 1 1 44 44 GLU H H 44 8.924 8.924 8.450 0.474 19638 80 1 . 1 1 46 46 TYR HA H 46 3.845 3.845 4.448 -0.603 19638 81 1 . 1 1 46 46 TYR H H 46 7.033 7.033 7.508 -0.475 19638 82 1 . 1 1 47 47 SER HA H 47 4.283 4.283 4.303 -0.020 19638 83 1 . 1 1 48 48 TYR HA H 48 4.242 4.242 4.756 -0.514 19638 84 1 . 1 1 48 48 TYR H H 48 7.905 7.905 8.429 -0.524 19638 85 1 . 1 1 49 49 THR HA H 49 4.124 4.124 4.394 -0.270 19638 86 1 . 1 1 49 49 THR H H 49 9.712 9.712 8.489 1.223 19638 87 1 . 1 1 50 50 ASP HA H 50 4.261 4.261 4.307 -0.046 19638 88 1 . 1 1 50 50 ASP H H 50 8.682 8.682 8.985 -0.303 19638 89 1 . 1 1 51 51 ALA HA H 51 4.182 4.182 3.936 0.246 19638 90 1 . 1 1 51 51 ALA H H 51 7.802 7.802 8.218 -0.416 19638 91 1 . 1 1 52 52 ASN HA H 52 4.687 4.687 4.598 0.089 19638 92 1 . 1 1 52 52 ASN H H 52 8.422 8.422 8.014 0.408 19638 93 1 . 1 1 53 53 ILE HA H 53 3.680 3.680 3.703 -0.023 19638 94 1 . 1 1 53 53 ILE H H 53 7.686 7.686 7.851 -0.165 19638 95 1 . 1 1 54 54 LYS HA H 54 3.929 3.929 4.072 -0.143 19638 96 1 . 1 1 54 54 LYS H H 54 9.101 9.101 8.275 0.826 19638 97 1 . 1 1 55 55 LYS HA H 55 4.036 4.036 4.344 -0.308 19638 98 1 . 1 1 55 55 LYS H H 55 7.355 7.355 7.887 -0.532 19638 99 1 . 1 1 56 56 ASN HA H 56 4.325 4.325 4.640 -0.315 19638 100 1 . 1 1 56 56 ASN H H 56 7.506 7.506 8.368 -0.862 19638 101 1 . 1 1 57 57 VAL HA H 57 4.191 4.191 4.200 -0.009 19638 102 1 . 1 1 57 57 VAL H H 57 7.341 7.341 8.188 -0.847 19638 103 1 . 1 1 58 58 LEU HA H 58 3.798 3.798 4.101 -0.303 19638 104 1 . 1 1 58 58 LEU H H 58 8.220 8.220 8.205 0.015 19638 105 1 . 1 1 59 59 TRP HA H 59 5.115 5.115 4.589 0.526 19638 106 1 . 1 1 59 59 TRP H H 59 7.973 7.973 8.906 -0.933 19638 107 1 . 1 1 60 60 ASP HA H 60 4.737 4.737 4.919 -0.182 19638 108 1 . 1 1 60 60 ASP H H 60 10.093 10.093 8.322 1.772 19638 109 1 . 1 1 61 61 GLU HA H 61 3.338 3.338 4.153 -0.815 19638 110 1 . 1 1 61 61 GLU H H 61 10.090 10.090 8.867 1.223 19638 111 1 . 1 1 62 62 ASN HA H 62 4.456 4.456 4.577 -0.121 19638 112 1 . 1 1 62 62 ASN H H 62 8.211 8.211 8.465 -0.254 19638 113 1 . 1 1 63 63 ASN HA H 63 4.550 4.550 4.497 0.053 19638 114 1 . 1 1 63 63 ASN H H 63 9.331 9.331 8.723 0.608 19638 115 1 . 1 1 64 64 MET HA H 64 4.321 4.321 4.272 0.049 19638 116 1 . 1 1 64 64 MET H H 64 8.702 8.702 8.721 -0.020 19638 117 1 . 1 1 65 65 SER HA H 65 3.445 3.445 4.197 -0.752 19638 118 1 . 1 1 65 65 SER H H 65 7.442 7.442 7.866 -0.424 19638 119 1 . 1 1 66 66 GLU HA H 66 3.857 3.857 4.096 -0.239 19638 120 1 . 1 1 66 66 GLU H H 66 7.574 7.574 7.637 -0.063 19638 121 1 . 1 1 67 67 HIS HA H 67 4.279 4.279 3.839 0.440 19638 122 1 . 1 1 67 67 HIS H H 67 8.297 8.297 7.750 0.547 19638 123 1 . 1 1 68 68 LEU HA H 68 3.356 3.356 4.063 -0.707 19638 124 1 . 1 1 68 68 LEU H H 68 8.060 8.060 7.784 0.276 19638 125 1 . 1 1 69 69 THR HA H 69 3.792 3.792 4.218 -0.426 19638 126 1 . 1 1 69 69 THR H H 69 7.327 7.327 7.563 -0.236 19638 127 1 . 1 1 70 70 ASN HA H 70 5.027 5.027 4.821 0.206 19638 128 1 . 1 1 70 70 ASN H H 70 6.715 6.715 8.232 -1.517 19638 129 1 . 1 1 71 71 PRO HA H 71 5.961 5.961 4.169 1.792 19638 130 1 . 1 1 72 72 ALA HA H 72 5.125 5.125 4.110 1.015 19638 131 1 . 1 1 72 72 ALA H H 72 9.052 9.052 8.302 0.750 19638 132 1 . 1 1 73 73 LYS HA H 73 4.569 4.569 4.101 0.468 19638 133 1 . 1 1 73 73 LYS H H 73 7.914 7.914 8.041 -0.127 19638 134 1 . 1 1 74 74 TYR HA H 74 5.027 5.027 4.292 0.735 19638 135 1 . 1 1 74 74 TYR H H 74 8.520 8.520 7.677 0.843 19638 136 1 . 1 1 75 75 ILE HA H 75 4.661 4.661 4.521 0.140 19638 137 1 . 1 1 75 75 ILE H H 75 9.542 9.542 7.888 1.654 19638 138 1 . 1 1 76 76 PRO HA H 76 5.127 5.127 4.600 0.527 19638 139 1 . 1 1 77 77 GLY H H 77 9.573 9.573 8.607 0.966 19638 140 1 . 1 1 78 78 THR HA H 78 5.058 5.058 4.603 0.455 19638 141 1 . 1 1 78 78 THR H H 78 9.274 9.274 7.680 1.594 19638 142 1 . 1 1 79 79 LYS H H 79 8.060 8.060 8.604 -0.544 19638 143 1 . 1 1 80 80 MET H H 80 8.670 8.670 7.710 0.960 19638 144 1 . 1 1 81 81 ALA H H 81 8.060 8.060 8.555 -0.495 19638 145 1 . 1 1 82 82 PHE HA H 82 4.562 4.562 4.581 -0.019 19638 146 1 . 1 1 82 82 PHE H H 82 8.446 8.446 8.012 0.434 19638 147 1 . 1 1 83 83 GLY H H 83 7.142 7.142 7.708 -0.566 19638 148 1 . 1 1 84 84 GLY H H 84 8.211 8.211 8.083 0.128 19638 149 1 . 1 1 85 85 LEU HA H 85 4.255 4.255 4.513 -0.258 19638 150 1 . 1 1 85 85 LEU H H 85 8.160 8.160 8.045 0.115 19638 151 1 . 1 1 86 86 LYS HA H 86 3.955 3.955 4.163 -0.208 19638 152 1 . 1 1 86 86 LYS H H 86 8.440 8.440 8.629 -0.189 19638 153 1 . 1 1 87 87 LYS HA H 87 4.370 4.370 4.403 -0.033 19638 154 1 . 1 1 87 87 LYS H H 87 8.800 8.800 7.975 0.825 19638 155 1 . 1 1 88 88 GLU HA H 88 3.426 3.426 4.066 -0.640 19638 156 1 . 1 1 88 88 GLU H H 88 8.971 8.971 8.950 0.021 19638 157 1 . 1 1 89 89 LYS HA H 89 3.817 3.817 4.010 -0.193 19638 158 1 . 1 1 89 89 LYS H H 89 8.679 8.679 8.384 0.295 19638 159 1 . 1 1 90 90 ASP HA H 90 4.041 4.041 4.435 -0.394 19638 160 1 . 1 1 90 90 ASP H H 90 6.295 6.295 8.498 -2.203 19638 161 1 . 1 1 91 91 ARG HA H 91 3.281 3.281 4.015 -0.734 19638 162 1 . 1 1 91 91 ARG H H 91 7.285 7.285 7.629 -0.344 19638 163 1 . 1 1 92 92 ASN HA H 92 3.805 3.805 4.438 -0.633 19638 164 1 . 1 1 92 92 ASN H H 92 8.541 8.541 8.124 0.417 19638 165 1 . 1 1 93 93 ASP HA H 93 3.993 3.993 4.512 -0.519 19638 166 1 . 1 1 93 93 ASP H H 93 8.518 8.518 7.747 0.771 19638 167 1 . 1 1 94 94 LEU HA H 94 3.778 3.778 4.174 -0.396 19638 168 1 . 1 1 94 94 LEU H H 94 8.167 8.167 7.791 0.376 19638 169 1 . 1 1 95 95 ILE HA H 95 2.969 2.969 3.791 -0.823 19638 170 1 . 1 1 95 95 ILE H H 95 8.718 8.718 7.853 0.865 19638 171 1 . 1 1 96 96 THR HA H 96 3.661 3.661 3.951 -0.289 19638 172 1 . 1 1 96 96 THR H H 96 7.955 7.955 8.114 -0.159 19638 173 1 . 1 1 97 97 TYR HA H 97 3.992 3.992 4.089 -0.097 19638 174 1 . 1 1 97 97 TYR H H 97 7.619 7.619 8.104 -0.485 19638 175 1 . 1 1 98 98 LEU HA H 98 3.231 3.231 3.696 -0.465 19638 176 1 . 1 1 98 98 LEU H H 98 8.933 8.933 7.718 1.215 19638 177 1 . 1 1 99 99 LYS HA H 99 3.492 3.492 3.203 0.289 19638 178 1 . 1 1 99 99 LYS H H 99 8.454 8.454 8.164 0.290 19638 179 1 . 1 1 100 100 LYS HA H 100 4.094 4.094 3.886 0.208 19638 180 1 . 1 1 100 100 LYS H H 100 6.501 6.501 7.718 -1.217 19638 181 1 . 1 1 101 101 ALA HA H 101 3.955 3.955 4.025 -0.070 19638 182 1 . 1 1 101 101 ALA H H 101 8.296 8.296 7.367 0.929 19638 183 1 . 1 1 102 102 THR H H 102 7.330 7.330 7.549 -0.219 19638 stop_ save_