data_18963 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 18963 _Entry.PDB_ID 2M3H 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 18963 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 SER HA H 2 4.480 4.480 4.505 -0.025 18963 2 1 1 . 1 1 3 3 MET HA H 3 4.100 4.100 4.351 -0.251 18963 3 1 1 . 1 1 3 3 MET H H 3 8.340 8.340 8.638 -0.298 18963 4 1 1 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.049 -0.089 18963 5 1 1 . 1 1 4 4 ASP H H 4 8.430 8.430 8.737 -0.307 18963 6 1 1 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.720 -0.310 18963 7 1 1 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.769 0.091 18963 8 1 1 . 1 1 6 6 ASN H H 6 8.660 8.660 8.405 0.255 18963 9 1 1 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.582 -0.532 18963 10 1 1 . 1 1 7 7 ALA H H 7 7.140 7.140 7.721 -0.581 18963 11 1 1 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.366 -0.486 18963 12 1 1 . 1 1 8 8 LEU H H 8 7.780 7.780 7.816 -0.036 18963 13 1 1 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.483 0.347 18963 14 1 1 . 1 1 9 9 TYR H H 9 7.800 7.800 8.384 -0.584 18963 15 1 1 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.118 -0.188 18963 16 1 1 . 1 1 10 10 CYS H H 10 7.760 7.760 8.238 -0.478 18963 17 1 1 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.940 0.500 18963 18 1 1 . 1 1 11 11 ILE H H 11 10.080 10.080 8.706 1.374 18963 19 1 1 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.564 0.076 18963 20 1 1 . 1 1 12 12 CYS H H 12 7.590 7.590 7.881 -0.291 18963 21 1 1 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.989 -0.099 18963 22 1 1 . 1 1 13 13 ARG H H 13 7.690 7.690 8.231 -0.541 18963 23 1 1 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.828 0.232 18963 24 1 1 . 1 1 14 14 GLN H H 14 8.110 8.110 8.260 -0.150 18963 25 1 1 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.886 0.364 18963 26 1 1 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.507 -0.037 18963 27 1 1 . 1 1 16 16 HIS H H 16 9.800 9.800 8.954 0.846 18963 28 1 1 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.339 -0.169 18963 29 1 1 . 1 1 17 17 ASN H H 17 8.450 8.450 8.514 -0.064 18963 30 1 1 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.841 -0.631 18963 31 1 1 . 1 1 18 18 ASN H H 18 9.010 9.010 8.041 0.969 18963 32 1 1 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.573 -0.143 18963 33 1 1 . 1 1 19 19 ARG H H 19 7.710 7.710 8.143 -0.433 18963 34 1 1 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.453 0.057 18963 35 1 1 . 1 1 20 20 PHE H H 20 8.680 8.680 8.648 0.032 18963 36 1 1 . 1 1 21 21 MET HA H 21 5.310 5.310 5.008 0.302 18963 37 1 1 . 1 1 21 21 MET H H 21 7.880 7.880 7.333 0.547 18963 38 1 1 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.466 -0.076 18963 39 1 1 . 1 1 22 22 ILE H H 22 9.180 9.180 9.151 0.029 18963 40 1 1 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.197 0.193 18963 41 1 1 . 1 1 23 23 CYS H H 23 8.000 8.000 8.037 -0.037 18963 42 1 1 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.021 -0.471 18963 43 1 1 . 1 1 24 24 CYS H H 24 8.750 8.750 8.962 -0.212 18963 44 1 1 . 1 1 25 25 ASP H H 25 9.390 9.390 8.411 0.979 18963 45 1 1 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.135 0.385 18963 46 1 1 . 1 1 26 26 ARG H H 26 9.390 9.390 8.254 1.136 18963 47 1 1 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.803 -0.033 18963 48 1 1 . 1 1 27 27 CYS H H 27 8.550 8.550 7.834 0.716 18963 49 1 1 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.965 0.215 18963 50 1 1 . 1 1 28 28 GLU H H 28 7.660 7.660 8.218 -0.558 18963 51 1 1 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.557 0.073 18963 52 1 1 . 1 1 29 29 GLU H H 29 8.220 8.220 7.820 0.400 18963 53 1 1 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.461 -0.621 18963 54 1 1 . 1 1 30 30 TRP H H 30 8.250 8.250 8.064 0.186 18963 55 1 1 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.796 -0.216 18963 56 1 1 . 1 1 31 31 PHE H H 31 9.210 9.210 9.346 -0.136 18963 57 1 1 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.165 0.005 18963 58 1 1 . 1 1 32 32 HIS H H 32 9.740 9.740 8.719 1.021 18963 59 1 1 . 1 1 33 33 GLY H H 33 9.090 9.090 8.760 0.330 18963 60 1 1 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.528 -0.128 18963 61 1 1 . 1 1 34 34 ASP H H 34 9.110 9.110 8.551 0.559 18963 62 1 1 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.380 -0.150 18963 63 1 1 . 1 1 35 35 CYS H H 35 7.660 7.660 8.186 -0.526 18963 64 1 1 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.214 0.416 18963 65 1 1 . 1 1 36 36 VAL H H 36 7.360 7.360 8.492 -1.132 18963 66 1 1 . 1 1 37 37 GLY H H 37 7.670 7.670 7.988 -0.318 18963 67 1 1 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.105 0.235 18963 68 1 1 . 1 1 38 38 ILE H H 38 8.510 8.510 8.093 0.417 18963 69 1 1 . 1 1 39 39 SER HA H 39 4.450 4.450 4.590 -0.140 18963 70 1 1 . 1 1 39 39 SER H H 39 8.010 8.010 8.205 -0.195 18963 71 1 1 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.952 -0.332 18963 72 1 1 . 1 1 40 40 GLU H H 40 8.660 8.660 8.965 -0.305 18963 73 1 1 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.140 -0.200 18963 74 1 1 . 1 1 41 41 ALA H H 41 8.120 8.120 8.237 -0.117 18963 75 1 1 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.078 0.022 18963 76 1 1 . 1 1 42 42 ARG H H 42 7.840 7.840 7.337 0.503 18963 77 1 1 . 1 1 43 43 GLY H H 43 8.840 8.840 8.704 0.136 18963 78 1 1 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.260 -0.020 18963 79 1 1 . 1 1 44 44 ARG H H 44 8.240 8.240 7.527 0.713 18963 80 1 1 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.129 0.011 18963 81 1 1 . 1 1 45 45 LEU H H 45 7.610 7.610 7.521 0.089 18963 82 1 1 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.914 0.196 18963 83 1 1 . 1 1 46 46 LEU H H 46 8.150 8.150 7.839 0.311 18963 84 1 1 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.149 0.041 18963 85 1 1 . 1 1 47 47 GLU H H 47 7.800 7.800 7.777 0.023 18963 86 1 1 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.299 -0.139 18963 87 1 1 . 1 1 48 48 ARG H H 48 8.250 8.250 7.706 0.544 18963 88 1 1 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.766 -0.026 18963 89 1 1 . 1 1 49 49 ASN H H 49 8.280 8.280 8.113 0.167 18963 90 1 1 . 1 1 50 50 GLY H H 50 8.060 8.060 7.949 0.111 18963 91 1 1 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.444 -0.084 18963 92 1 1 . 1 1 51 51 GLU H H 51 8.180 8.180 7.967 0.213 18963 93 1 1 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.326 0.324 18963 94 1 1 . 1 1 52 52 ASP H H 52 8.350 8.350 8.529 -0.179 18963 95 1 1 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.516 -0.026 18963 96 1 1 . 1 1 53 53 TYR H H 53 9.200 9.200 7.913 1.287 18963 97 1 1 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.096 0.554 18963 98 1 1 . 1 1 54 54 ILE H H 54 6.790 6.790 7.262 -0.472 18963 99 1 1 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.242 0.078 18963 100 1 1 . 1 1 55 55 CYS H H 55 9.070 9.070 8.101 0.969 18963 101 1 1 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.140 0.060 18963 102 1 1 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.614 -0.044 18963 103 1 1 . 1 1 57 57 ASN H H 57 8.370 8.370 7.834 0.536 18963 104 1 1 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.412 -0.382 18963 105 1 1 . 1 1 58 58 CYS H H 58 8.300 8.300 7.800 0.500 18963 106 1 1 . 1 1 59 59 THR HA H 59 3.860 3.860 3.955 -0.095 18963 107 1 1 . 1 1 59 59 THR H H 59 7.600 7.600 7.711 -0.111 18963 108 1 1 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.491 -0.281 18963 109 1 1 . 1 1 60 60 ILE H H 60 7.480 7.480 7.691 -0.211 18963 110 1 2 . 1 1 2 2 SER HA H 2 4.480 4.480 4.797 -0.317 18963 111 1 2 . 1 1 3 3 MET HA H 3 4.100 4.100 4.425 -0.325 18963 112 1 2 . 1 1 3 3 MET H H 3 8.340 8.340 8.534 -0.194 18963 113 1 2 . 1 1 4 4 ASP HA H 4 4.960 4.960 4.977 -0.017 18963 114 1 2 . 1 1 4 4 ASP H H 4 8.430 8.430 8.600 -0.170 18963 115 1 2 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.356 0.054 18963 116 1 2 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.702 0.158 18963 117 1 2 . 1 1 6 6 ASN H H 6 8.660 8.660 8.468 0.192 18963 118 1 2 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.589 -0.539 18963 119 1 2 . 1 1 7 7 ALA H H 7 7.140 7.140 7.292 -0.152 18963 120 1 2 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.364 -0.484 18963 121 1 2 . 1 1 8 8 LEU H H 8 7.780 7.780 7.928 -0.148 18963 122 1 2 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.494 0.336 18963 123 1 2 . 1 1 9 9 TYR H H 9 7.800 7.800 8.518 -0.718 18963 124 1 2 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.126 -0.196 18963 125 1 2 . 1 1 10 10 CYS H H 10 7.760 7.760 8.302 -0.542 18963 126 1 2 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.900 0.540 18963 127 1 2 . 1 1 11 11 ILE H H 11 10.080 10.080 8.775 1.305 18963 128 1 2 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.594 0.046 18963 129 1 2 . 1 1 12 12 CYS H H 12 7.590 7.590 8.373 -0.783 18963 130 1 2 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.962 -0.072 18963 131 1 2 . 1 1 13 13 ARG H H 13 7.690 7.690 8.243 -0.553 18963 132 1 2 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.888 0.172 18963 133 1 2 . 1 1 14 14 GLN H H 14 8.110 8.110 8.284 -0.174 18963 134 1 2 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.853 0.397 18963 135 1 2 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.525 -0.055 18963 136 1 2 . 1 1 16 16 HIS H H 16 9.800 9.800 8.949 0.851 18963 137 1 2 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.388 -0.218 18963 138 1 2 . 1 1 17 17 ASN H H 17 8.450 8.450 8.785 -0.335 18963 139 1 2 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.877 -0.667 18963 140 1 2 . 1 1 18 18 ASN H H 18 9.010 9.010 8.103 0.907 18963 141 1 2 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.577 -0.147 18963 142 1 2 . 1 1 19 19 ARG H H 19 7.710 7.710 8.041 -0.331 18963 143 1 2 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.397 0.113 18963 144 1 2 . 1 1 20 20 PHE H H 20 8.680 8.680 8.684 -0.004 18963 145 1 2 . 1 1 21 21 MET HA H 21 5.310 5.310 5.072 0.238 18963 146 1 2 . 1 1 21 21 MET H H 21 7.880 7.880 7.288 0.592 18963 147 1 2 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.459 -0.069 18963 148 1 2 . 1 1 22 22 ILE H H 22 9.180 9.180 9.190 -0.010 18963 149 1 2 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.238 0.152 18963 150 1 2 . 1 1 23 23 CYS H H 23 8.000 8.000 8.034 -0.034 18963 151 1 2 . 1 1 24 24 CYS HA H 24 4.550 4.550 4.999 -0.449 18963 152 1 2 . 1 1 24 24 CYS H H 24 8.750 8.750 8.975 -0.225 18963 153 1 2 . 1 1 25 25 ASP H H 25 9.390 9.390 8.429 0.961 18963 154 1 2 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.137 0.383 18963 155 1 2 . 1 1 26 26 ARG H H 26 9.390 9.390 8.253 1.137 18963 156 1 2 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.811 -0.041 18963 157 1 2 . 1 1 27 27 CYS H H 27 8.550 8.550 7.858 0.692 18963 158 1 2 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.972 0.208 18963 159 1 2 . 1 1 28 28 GLU H H 28 7.660 7.660 8.235 -0.575 18963 160 1 2 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.661 -0.031 18963 161 1 2 . 1 1 29 29 GLU H H 29 8.220 8.220 7.784 0.436 18963 162 1 2 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.485 -0.645 18963 163 1 2 . 1 1 30 30 TRP H H 30 8.250 8.250 8.081 0.169 18963 164 1 2 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.807 -0.227 18963 165 1 2 . 1 1 31 31 PHE H H 31 9.210 9.210 9.381 -0.171 18963 166 1 2 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.184 -0.014 18963 167 1 2 . 1 1 32 32 HIS H H 32 9.740 9.740 8.712 1.028 18963 168 1 2 . 1 1 33 33 GLY H H 33 9.090 9.090 8.887 0.203 18963 169 1 2 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.554 -0.154 18963 170 1 2 . 1 1 34 34 ASP H H 34 9.110 9.110 8.553 0.557 18963 171 1 2 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.373 -0.143 18963 172 1 2 . 1 1 35 35 CYS H H 35 7.660 7.660 8.258 -0.598 18963 173 1 2 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.224 0.406 18963 174 1 2 . 1 1 36 36 VAL H H 36 7.360 7.360 8.437 -1.077 18963 175 1 2 . 1 1 37 37 GLY H H 37 7.670 7.670 7.893 -0.223 18963 176 1 2 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.101 0.239 18963 177 1 2 . 1 1 38 38 ILE H H 38 8.510 8.510 7.993 0.517 18963 178 1 2 . 1 1 39 39 SER HA H 39 4.450 4.450 4.521 -0.071 18963 179 1 2 . 1 1 39 39 SER H H 39 8.010 8.010 8.243 -0.234 18963 180 1 2 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.880 -0.260 18963 181 1 2 . 1 1 40 40 GLU H H 40 8.660 8.660 8.957 -0.297 18963 182 1 2 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.191 -0.251 18963 183 1 2 . 1 1 41 41 ALA H H 41 8.120 8.120 8.008 0.112 18963 184 1 2 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.097 0.003 18963 185 1 2 . 1 1 42 42 ARG H H 42 7.840 7.840 8.105 -0.265 18963 186 1 2 . 1 1 43 43 GLY H H 43 8.840 8.840 8.658 0.182 18963 187 1 2 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.197 0.043 18963 188 1 2 . 1 1 44 44 ARG H H 44 8.240 8.240 7.580 0.660 18963 189 1 2 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.196 -0.056 18963 190 1 2 . 1 1 45 45 LEU H H 45 7.610 7.610 7.183 0.427 18963 191 1 2 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.038 0.072 18963 192 1 2 . 1 1 46 46 LEU H H 46 8.150 8.150 7.951 0.199 18963 193 1 2 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.175 0.015 18963 194 1 2 . 1 1 47 47 GLU H H 47 7.800 7.800 7.793 0.007 18963 195 1 2 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.319 -0.159 18963 196 1 2 . 1 1 48 48 ARG H H 48 8.250 8.250 7.620 0.630 18963 197 1 2 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.817 -0.077 18963 198 1 2 . 1 1 49 49 ASN H H 49 8.280 8.280 7.844 0.436 18963 199 1 2 . 1 1 50 50 GLY H H 50 8.060 8.060 8.060 -0.000 18963 200 1 2 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.484 -0.124 18963 201 1 2 . 1 1 51 51 GLU H H 51 8.180 8.180 8.069 0.111 18963 202 1 2 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.383 0.267 18963 203 1 2 . 1 1 52 52 ASP H H 52 8.350 8.350 8.578 -0.228 18963 204 1 2 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.599 -0.109 18963 205 1 2 . 1 1 53 53 TYR H H 53 9.200 9.200 8.007 1.193 18963 206 1 2 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.112 0.538 18963 207 1 2 . 1 1 54 54 ILE H H 54 6.790 6.790 7.328 -0.538 18963 208 1 2 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.243 0.077 18963 209 1 2 . 1 1 55 55 CYS H H 55 9.070 9.070 8.112 0.958 18963 210 1 2 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.137 0.063 18963 211 1 2 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.636 -0.066 18963 212 1 2 . 1 1 57 57 ASN H H 57 8.370 8.370 7.907 0.463 18963 213 1 2 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.375 -0.345 18963 214 1 2 . 1 1 58 58 CYS H H 58 8.300 8.300 7.604 0.696 18963 215 1 2 . 1 1 59 59 THR HA H 59 3.860 3.860 4.014 -0.154 18963 216 1 2 . 1 1 59 59 THR H H 59 7.600 7.600 7.778 -0.178 18963 217 1 2 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.423 -0.213 18963 218 1 2 . 1 1 60 60 ILE H H 60 7.480 7.480 7.546 -0.066 18963 219 1 3 . 1 1 2 2 SER HA H 2 4.480 4.480 4.851 -0.371 18963 220 1 3 . 1 1 3 3 MET HA H 3 4.100 4.100 4.789 -0.689 18963 221 1 3 . 1 1 3 3 MET H H 3 8.340 8.340 8.255 0.085 18963 222 1 3 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.035 -0.075 18963 223 1 3 . 1 1 4 4 ASP H H 4 8.430 8.430 8.640 -0.210 18963 224 1 3 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.351 0.059 18963 225 1 3 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.723 0.137 18963 226 1 3 . 1 1 6 6 ASN H H 6 8.660 8.660 8.590 0.070 18963 227 1 3 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.586 -0.536 18963 228 1 3 . 1 1 7 7 ALA H H 7 7.140 7.140 7.285 -0.145 18963 229 1 3 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.356 -0.476 18963 230 1 3 . 1 1 8 8 LEU H H 8 7.780 7.780 7.815 -0.035 18963 231 1 3 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.521 0.309 18963 232 1 3 . 1 1 9 9 TYR H H 9 7.800 7.800 8.392 -0.592 18963 233 1 3 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.112 -0.182 18963 234 1 3 . 1 1 10 10 CYS H H 10 7.760 7.760 8.230 -0.470 18963 235 1 3 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.912 0.528 18963 236 1 3 . 1 1 11 11 ILE H H 11 10.080 10.080 8.721 1.359 18963 237 1 3 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.548 0.092 18963 238 1 3 . 1 1 12 12 CYS H H 12 7.590 7.590 8.203 -0.613 18963 239 1 3 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.961 -0.071 18963 240 1 3 . 1 1 13 13 ARG H H 13 7.690 7.690 8.213 -0.523 18963 241 1 3 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.886 0.174 18963 242 1 3 . 1 1 14 14 GLN H H 14 8.110 8.110 8.298 -0.188 18963 243 1 3 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.863 0.387 18963 244 1 3 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.530 -0.060 18963 245 1 3 . 1 1 16 16 HIS H H 16 9.800 9.800 8.909 0.891 18963 246 1 3 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.389 -0.219 18963 247 1 3 . 1 1 17 17 ASN H H 17 8.450 8.450 8.777 -0.327 18963 248 1 3 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.862 -0.652 18963 249 1 3 . 1 1 18 18 ASN H H 18 9.010 9.010 8.089 0.921 18963 250 1 3 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.631 -0.201 18963 251 1 3 . 1 1 19 19 ARG H H 19 7.710 7.710 8.204 -0.494 18963 252 1 3 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.476 0.034 18963 253 1 3 . 1 1 20 20 PHE H H 20 8.680 8.680 8.468 0.212 18963 254 1 3 . 1 1 21 21 MET HA H 21 5.310 5.310 5.099 0.211 18963 255 1 3 . 1 1 21 21 MET H H 21 7.880 7.880 7.343 0.537 18963 256 1 3 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.495 -0.105 18963 257 1 3 . 1 1 22 22 ILE H H 22 9.180 9.180 9.062 0.118 18963 258 1 3 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.183 0.207 18963 259 1 3 . 1 1 23 23 CYS H H 23 8.000 8.000 8.024 -0.024 18963 260 1 3 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.017 -0.467 18963 261 1 3 . 1 1 24 24 CYS H H 24 8.750 8.750 8.982 -0.232 18963 262 1 3 . 1 1 25 25 ASP H H 25 9.390 9.390 8.370 1.020 18963 263 1 3 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.136 0.384 18963 264 1 3 . 1 1 26 26 ARG H H 26 9.390 9.390 8.281 1.109 18963 265 1 3 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.806 -0.036 18963 266 1 3 . 1 1 27 27 CYS H H 27 8.550 8.550 7.816 0.734 18963 267 1 3 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.977 0.203 18963 268 1 3 . 1 1 28 28 GLU H H 28 7.660 7.660 8.216 -0.556 18963 269 1 3 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.561 0.069 18963 270 1 3 . 1 1 29 29 GLU H H 29 8.220 8.220 7.841 0.379 18963 271 1 3 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.481 -0.641 18963 272 1 3 . 1 1 30 30 TRP H H 30 8.250 8.250 8.076 0.174 18963 273 1 3 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.805 -0.225 18963 274 1 3 . 1 1 31 31 PHE H H 31 9.210 9.210 9.377 -0.167 18963 275 1 3 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.181 -0.011 18963 276 1 3 . 1 1 32 32 HIS H H 32 9.740 9.740 8.701 1.039 18963 277 1 3 . 1 1 33 33 GLY H H 33 9.090 9.090 8.772 0.318 18963 278 1 3 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.564 -0.164 18963 279 1 3 . 1 1 34 34 ASP H H 34 9.110 9.110 8.520 0.590 18963 280 1 3 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.377 -0.147 18963 281 1 3 . 1 1 35 35 CYS H H 35 7.660 7.660 8.228 -0.568 18963 282 1 3 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.218 0.412 18963 283 1 3 . 1 1 36 36 VAL H H 36 7.360 7.360 8.402 -1.042 18963 284 1 3 . 1 1 37 37 GLY H H 37 7.670 7.670 7.851 -0.181 18963 285 1 3 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.102 0.238 18963 286 1 3 . 1 1 38 38 ILE H H 38 8.510 8.510 7.976 0.534 18963 287 1 3 . 1 1 39 39 SER HA H 39 4.450 4.450 4.518 -0.068 18963 288 1 3 . 1 1 39 39 SER H H 39 8.010 8.010 8.310 -0.300 18963 289 1 3 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.906 -0.286 18963 290 1 3 . 1 1 40 40 GLU H H 40 8.660 8.660 8.950 -0.290 18963 291 1 3 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.131 -0.191 18963 292 1 3 . 1 1 41 41 ALA H H 41 8.120 8.120 8.115 0.005 18963 293 1 3 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.102 -0.002 18963 294 1 3 . 1 1 42 42 ARG H H 42 7.840 7.840 7.322 0.518 18963 295 1 3 . 1 1 43 43 GLY H H 43 8.840 8.840 8.596 0.244 18963 296 1 3 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.219 0.021 18963 297 1 3 . 1 1 44 44 ARG H H 44 8.240 8.240 7.410 0.830 18963 298 1 3 . 1 1 45 45 LEU HA H 45 4.140 4.140 3.983 0.157 18963 299 1 3 . 1 1 45 45 LEU H H 45 7.610 7.610 7.556 0.054 18963 300 1 3 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.036 0.074 18963 301 1 3 . 1 1 46 46 LEU H H 46 8.150 8.150 7.657 0.493 18963 302 1 3 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.128 0.062 18963 303 1 3 . 1 1 47 47 GLU H H 47 7.800 7.800 7.574 0.226 18963 304 1 3 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.315 -0.155 18963 305 1 3 . 1 1 48 48 ARG H H 48 8.250 8.250 8.224 0.026 18963 306 1 3 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.744 -0.004 18963 307 1 3 . 1 1 49 49 ASN H H 49 8.280 8.280 8.374 -0.094 18963 308 1 3 . 1 1 50 50 GLY H H 50 8.060 8.060 7.883 0.177 18963 309 1 3 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.371 -0.011 18963 310 1 3 . 1 1 51 51 GLU H H 51 8.180 8.180 8.051 0.129 18963 311 1 3 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.445 0.205 18963 312 1 3 . 1 1 52 52 ASP H H 52 8.350 8.350 8.463 -0.113 18963 313 1 3 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.731 -0.241 18963 314 1 3 . 1 1 53 53 TYR H H 53 9.200 9.200 8.047 1.153 18963 315 1 3 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.140 0.510 18963 316 1 3 . 1 1 54 54 ILE H H 54 6.790 6.790 7.395 -0.605 18963 317 1 3 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.242 0.078 18963 318 1 3 . 1 1 55 55 CYS H H 55 9.070 9.070 8.123 0.947 18963 319 1 3 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.137 0.063 18963 320 1 3 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.607 -0.037 18963 321 1 3 . 1 1 57 57 ASN H H 57 8.370 8.370 7.836 0.534 18963 322 1 3 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.408 -0.378 18963 323 1 3 . 1 1 58 58 CYS H H 58 8.300 8.300 7.803 0.497 18963 324 1 3 . 1 1 59 59 THR HA H 59 3.860 3.860 4.033 -0.173 18963 325 1 3 . 1 1 59 59 THR H H 59 7.600 7.600 7.736 -0.136 18963 326 1 3 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.446 -0.236 18963 327 1 3 . 1 1 60 60 ILE H H 60 7.480 7.480 7.618 -0.138 18963 328 1 4 . 1 1 2 2 SER HA H 2 4.480 4.480 4.653 -0.173 18963 329 1 4 . 1 1 3 3 MET HA H 3 4.100 4.100 4.268 -0.168 18963 330 1 4 . 1 1 3 3 MET H H 3 8.340 8.340 8.640 -0.300 18963 331 1 4 . 1 1 4 4 ASP HA H 4 4.960 4.960 4.985 -0.025 18963 332 1 4 . 1 1 4 4 ASP H H 4 8.430 8.430 8.635 -0.205 18963 333 1 4 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.550 -0.140 18963 334 1 4 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.836 0.024 18963 335 1 4 . 1 1 6 6 ASN H H 6 8.660 8.660 8.552 0.108 18963 336 1 4 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.600 -0.550 18963 337 1 4 . 1 1 7 7 ALA H H 7 7.140 7.140 7.808 -0.668 18963 338 1 4 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.306 -0.426 18963 339 1 4 . 1 1 8 8 LEU H H 8 7.780 7.780 7.783 -0.003 18963 340 1 4 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.496 0.334 18963 341 1 4 . 1 1 9 9 TYR H H 9 7.800 7.800 8.362 -0.562 18963 342 1 4 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.118 -0.188 18963 343 1 4 . 1 1 10 10 CYS H H 10 7.760 7.760 8.227 -0.467 18963 344 1 4 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.936 0.504 18963 345 1 4 . 1 1 11 11 ILE H H 11 10.080 10.080 8.692 1.388 18963 346 1 4 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.540 0.100 18963 347 1 4 . 1 1 12 12 CYS H H 12 7.590 7.590 7.858 -0.268 18963 348 1 4 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.967 -0.077 18963 349 1 4 . 1 1 13 13 ARG H H 13 7.690 7.690 8.263 -0.573 18963 350 1 4 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.801 0.259 18963 351 1 4 . 1 1 14 14 GLN H H 14 8.110 8.110 8.235 -0.125 18963 352 1 4 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.800 0.450 18963 353 1 4 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.462 0.008 18963 354 1 4 . 1 1 16 16 HIS H H 16 9.800 9.800 9.074 0.726 18963 355 1 4 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.351 -0.181 18963 356 1 4 . 1 1 17 17 ASN H H 17 8.450 8.450 8.374 0.076 18963 357 1 4 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.869 -0.659 18963 358 1 4 . 1 1 18 18 ASN H H 18 9.010 9.010 8.070 0.940 18963 359 1 4 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.641 -0.211 18963 360 1 4 . 1 1 19 19 ARG H H 19 7.710 7.710 8.187 -0.477 18963 361 1 4 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.400 0.110 18963 362 1 4 . 1 1 20 20 PHE H H 20 8.680 8.680 8.445 0.235 18963 363 1 4 . 1 1 21 21 MET HA H 21 5.310 5.310 5.047 0.263 18963 364 1 4 . 1 1 21 21 MET H H 21 7.880 7.880 7.316 0.564 18963 365 1 4 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.461 -0.071 18963 366 1 4 . 1 1 22 22 ILE H H 22 9.180 9.180 9.047 0.133 18963 367 1 4 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.303 0.087 18963 368 1 4 . 1 1 23 23 CYS H H 23 8.000 8.000 8.084 -0.084 18963 369 1 4 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.013 -0.463 18963 370 1 4 . 1 1 24 24 CYS H H 24 8.750 8.750 8.983 -0.233 18963 371 1 4 . 1 1 25 25 ASP H H 25 9.390 9.390 8.444 0.946 18963 372 1 4 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.139 0.381 18963 373 1 4 . 1 1 26 26 ARG H H 26 9.390 9.390 8.299 1.091 18963 374 1 4 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.863 -0.093 18963 375 1 4 . 1 1 27 27 CYS H H 27 8.550 8.550 7.743 0.807 18963 376 1 4 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.950 0.230 18963 377 1 4 . 1 1 28 28 GLU H H 28 7.660 7.660 8.252 -0.592 18963 378 1 4 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.606 0.024 18963 379 1 4 . 1 1 29 29 GLU H H 29 8.220 8.220 7.857 0.363 18963 380 1 4 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.444 -0.604 18963 381 1 4 . 1 1 30 30 TRP H H 30 8.250 8.250 8.164 0.086 18963 382 1 4 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.803 -0.223 18963 383 1 4 . 1 1 31 31 PHE H H 31 9.210 9.210 9.353 -0.143 18963 384 1 4 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.176 -0.006 18963 385 1 4 . 1 1 32 32 HIS H H 32 9.740 9.740 8.714 1.026 18963 386 1 4 . 1 1 33 33 GLY H H 33 9.090 9.090 8.716 0.374 18963 387 1 4 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.578 -0.178 18963 388 1 4 . 1 1 34 34 ASP H H 34 9.110 9.110 8.527 0.583 18963 389 1 4 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.396 -0.166 18963 390 1 4 . 1 1 35 35 CYS H H 35 7.660 7.660 8.165 -0.505 18963 391 1 4 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.208 0.422 18963 392 1 4 . 1 1 36 36 VAL H H 36 7.360 7.360 8.436 -1.076 18963 393 1 4 . 1 1 37 37 GLY H H 37 7.670 7.670 7.835 -0.165 18963 394 1 4 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.104 0.236 18963 395 1 4 . 1 1 38 38 ILE H H 38 8.510 8.510 7.993 0.517 18963 396 1 4 . 1 1 39 39 SER HA H 39 4.450 4.450 4.597 -0.147 18963 397 1 4 . 1 1 39 39 SER H H 39 8.010 8.010 8.223 -0.213 18963 398 1 4 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.986 -0.366 18963 399 1 4 . 1 1 40 40 GLU H H 40 8.660 8.660 8.999 -0.339 18963 400 1 4 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.132 -0.192 18963 401 1 4 . 1 1 41 41 ALA H H 41 8.120 8.120 8.269 -0.149 18963 402 1 4 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.111 -0.011 18963 403 1 4 . 1 1 42 42 ARG H H 42 7.840 7.840 7.538 0.302 18963 404 1 4 . 1 1 43 43 GLY H H 43 8.840 8.840 8.715 0.125 18963 405 1 4 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.309 -0.069 18963 406 1 4 . 1 1 44 44 ARG H H 44 8.240 8.240 7.506 0.734 18963 407 1 4 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.183 -0.043 18963 408 1 4 . 1 1 45 45 LEU H H 45 7.610 7.610 7.593 0.017 18963 409 1 4 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.888 0.222 18963 410 1 4 . 1 1 46 46 LEU H H 46 8.150 8.150 7.856 0.294 18963 411 1 4 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.127 0.063 18963 412 1 4 . 1 1 47 47 GLU H H 47 7.800 7.800 7.844 -0.044 18963 413 1 4 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.291 -0.131 18963 414 1 4 . 1 1 48 48 ARG H H 48 8.250 8.250 7.636 0.614 18963 415 1 4 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.780 -0.040 18963 416 1 4 . 1 1 49 49 ASN H H 49 8.280 8.280 8.249 0.031 18963 417 1 4 . 1 1 50 50 GLY H H 50 8.060 8.060 7.955 0.105 18963 418 1 4 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.421 -0.061 18963 419 1 4 . 1 1 51 51 GLU H H 51 8.180 8.180 7.851 0.329 18963 420 1 4 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.294 0.356 18963 421 1 4 . 1 1 52 52 ASP H H 52 8.350 8.350 8.424 -0.074 18963 422 1 4 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.551 -0.061 18963 423 1 4 . 1 1 53 53 TYR H H 53 9.200 9.200 7.915 1.284 18963 424 1 4 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.107 0.543 18963 425 1 4 . 1 1 54 54 ILE H H 54 6.790 6.790 7.300 -0.510 18963 426 1 4 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.243 0.077 18963 427 1 4 . 1 1 55 55 CYS H H 55 9.070 9.070 8.107 0.963 18963 428 1 4 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.139 0.061 18963 429 1 4 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.613 -0.043 18963 430 1 4 . 1 1 57 57 ASN H H 57 8.370 8.370 7.837 0.533 18963 431 1 4 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.433 -0.403 18963 432 1 4 . 1 1 58 58 CYS H H 58 8.300 8.300 7.702 0.598 18963 433 1 4 . 1 1 59 59 THR HA H 59 3.860 3.860 3.978 -0.118 18963 434 1 4 . 1 1 59 59 THR H H 59 7.600 7.600 7.827 -0.227 18963 435 1 4 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.540 -0.330 18963 436 1 4 . 1 1 60 60 ILE H H 60 7.480 7.480 7.593 -0.113 18963 437 1 5 . 1 1 2 2 SER HA H 2 4.480 4.480 4.699 -0.219 18963 438 1 5 . 1 1 3 3 MET HA H 3 4.100 4.100 4.799 -0.699 18963 439 1 5 . 1 1 3 3 MET H H 3 8.340 8.340 8.273 0.067 18963 440 1 5 . 1 1 4 4 ASP HA H 4 4.960 4.960 4.975 -0.015 18963 441 1 5 . 1 1 4 4 ASP H H 4 8.430 8.430 8.689 -0.259 18963 442 1 5 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.335 0.075 18963 443 1 5 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.662 0.198 18963 444 1 5 . 1 1 6 6 ASN H H 6 8.660 8.660 8.590 0.070 18963 445 1 5 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.477 -0.427 18963 446 1 5 . 1 1 7 7 ALA H H 7 7.140 7.140 7.270 -0.130 18963 447 1 5 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.400 -0.520 18963 448 1 5 . 1 1 8 8 LEU H H 8 7.780 7.780 8.029 -0.249 18963 449 1 5 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.466 0.364 18963 450 1 5 . 1 1 9 9 TYR H H 9 7.800 7.800 8.473 -0.673 18963 451 1 5 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.177 -0.247 18963 452 1 5 . 1 1 10 10 CYS H H 10 7.760 7.760 8.256 -0.496 18963 453 1 5 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.924 0.516 18963 454 1 5 . 1 1 11 11 ILE H H 11 10.080 10.080 8.704 1.375 18963 455 1 5 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.589 0.051 18963 456 1 5 . 1 1 12 12 CYS H H 12 7.590 7.590 8.042 -0.452 18963 457 1 5 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.947 -0.057 18963 458 1 5 . 1 1 13 13 ARG H H 13 7.690 7.690 8.142 -0.452 18963 459 1 5 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.822 0.238 18963 460 1 5 . 1 1 14 14 GLN H H 14 8.110 8.110 8.294 -0.184 18963 461 1 5 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.688 0.562 18963 462 1 5 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.460 0.010 18963 463 1 5 . 1 1 16 16 HIS H H 16 9.800 9.800 9.075 0.725 18963 464 1 5 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.380 -0.210 18963 465 1 5 . 1 1 17 17 ASN H H 17 8.450 8.450 8.634 -0.184 18963 466 1 5 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.898 -0.688 18963 467 1 5 . 1 1 18 18 ASN H H 18 9.010 9.010 8.100 0.910 18963 468 1 5 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.581 -0.151 18963 469 1 5 . 1 1 19 19 ARG H H 19 7.710 7.710 7.972 -0.262 18963 470 1 5 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.404 0.106 18963 471 1 5 . 1 1 20 20 PHE H H 20 8.680 8.680 8.687 -0.007 18963 472 1 5 . 1 1 21 21 MET HA H 21 5.310 5.310 5.054 0.256 18963 473 1 5 . 1 1 21 21 MET H H 21 7.880 7.880 7.294 0.586 18963 474 1 5 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.466 -0.076 18963 475 1 5 . 1 1 22 22 ILE H H 22 9.180 9.180 9.182 -0.002 18963 476 1 5 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.225 0.165 18963 477 1 5 . 1 1 23 23 CYS H H 23 8.000 8.000 8.042 -0.042 18963 478 1 5 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.029 -0.479 18963 479 1 5 . 1 1 24 24 CYS H H 24 8.750 8.750 9.005 -0.255 18963 480 1 5 . 1 1 25 25 ASP H H 25 9.390 9.390 8.509 0.881 18963 481 1 5 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.144 0.376 18963 482 1 5 . 1 1 26 26 ARG H H 26 9.390 9.390 8.289 1.101 18963 483 1 5 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.836 -0.066 18963 484 1 5 . 1 1 27 27 CYS H H 27 8.550 8.550 7.760 0.790 18963 485 1 5 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.967 0.213 18963 486 1 5 . 1 1 28 28 GLU H H 28 7.660 7.660 8.238 -0.578 18963 487 1 5 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.684 -0.054 18963 488 1 5 . 1 1 29 29 GLU H H 29 8.220 8.220 7.821 0.399 18963 489 1 5 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.481 -0.641 18963 490 1 5 . 1 1 30 30 TRP H H 30 8.250 8.250 8.125 0.125 18963 491 1 5 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.760 -0.180 18963 492 1 5 . 1 1 31 31 PHE H H 31 9.210 9.210 9.385 -0.175 18963 493 1 5 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.174 -0.004 18963 494 1 5 . 1 1 32 32 HIS H H 32 9.740 9.740 8.694 1.046 18963 495 1 5 . 1 1 33 33 GLY H H 33 9.090 9.090 8.851 0.239 18963 496 1 5 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.561 -0.161 18963 497 1 5 . 1 1 34 34 ASP H H 34 9.110 9.110 8.495 0.615 18963 498 1 5 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.372 -0.142 18963 499 1 5 . 1 1 35 35 CYS H H 35 7.660 7.660 8.271 -0.611 18963 500 1 5 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.214 0.416 18963 501 1 5 . 1 1 36 36 VAL H H 36 7.360 7.360 8.439 -1.079 18963 502 1 5 . 1 1 37 37 GLY H H 37 7.670 7.670 7.905 -0.235 18963 503 1 5 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.081 0.259 18963 504 1 5 . 1 1 38 38 ILE H H 38 8.510 8.510 7.982 0.528 18963 505 1 5 . 1 1 39 39 SER HA H 39 4.450 4.450 4.581 -0.131 18963 506 1 5 . 1 1 39 39 SER H H 39 8.010 8.010 8.218 -0.208 18963 507 1 5 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.978 -0.358 18963 508 1 5 . 1 1 40 40 GLU H H 40 8.660 8.660 8.927 -0.267 18963 509 1 5 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.170 -0.230 18963 510 1 5 . 1 1 41 41 ALA H H 41 8.120 8.120 8.114 0.006 18963 511 1 5 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.032 0.068 18963 512 1 5 . 1 1 42 42 ARG H H 42 7.840 7.840 8.196 -0.356 18963 513 1 5 . 1 1 43 43 GLY H H 43 8.840 8.840 8.696 0.144 18963 514 1 5 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.162 0.078 18963 515 1 5 . 1 1 44 44 ARG H H 44 8.240 8.240 7.283 0.957 18963 516 1 5 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.024 0.116 18963 517 1 5 . 1 1 45 45 LEU H H 45 7.610 7.610 7.920 -0.310 18963 518 1 5 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.029 0.081 18963 519 1 5 . 1 1 46 46 LEU H H 46 8.150 8.150 7.703 0.447 18963 520 1 5 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.164 0.026 18963 521 1 5 . 1 1 47 47 GLU H H 47 7.800 7.800 7.566 0.234 18963 522 1 5 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.307 -0.147 18963 523 1 5 . 1 1 48 48 ARG H H 48 8.250 8.250 8.159 0.091 18963 524 1 5 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.753 -0.013 18963 525 1 5 . 1 1 49 49 ASN H H 49 8.280 8.280 8.358 -0.078 18963 526 1 5 . 1 1 50 50 GLY H H 50 8.060 8.060 7.866 0.194 18963 527 1 5 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.395 -0.035 18963 528 1 5 . 1 1 51 51 GLU H H 51 8.180 8.180 8.069 0.111 18963 529 1 5 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.495 0.155 18963 530 1 5 . 1 1 52 52 ASP H H 52 8.350 8.350 8.512 -0.162 18963 531 1 5 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.722 -0.232 18963 532 1 5 . 1 1 53 53 TYR H H 53 9.200 9.200 8.625 0.575 18963 533 1 5 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.136 0.514 18963 534 1 5 . 1 1 54 54 ILE H H 54 6.790 6.790 7.406 -0.616 18963 535 1 5 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.241 0.079 18963 536 1 5 . 1 1 55 55 CYS H H 55 9.070 9.070 8.112 0.958 18963 537 1 5 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.135 0.065 18963 538 1 5 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.626 -0.056 18963 539 1 5 . 1 1 57 57 ASN H H 57 8.370 8.370 7.916 0.454 18963 540 1 5 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.314 -0.284 18963 541 1 5 . 1 1 58 58 CYS H H 58 8.300 8.300 7.571 0.729 18963 542 1 5 . 1 1 59 59 THR HA H 59 3.860 3.860 3.974 -0.114 18963 543 1 5 . 1 1 59 59 THR H H 59 7.600 7.600 7.675 -0.075 18963 544 1 5 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.406 -0.196 18963 545 1 5 . 1 1 60 60 ILE H H 60 7.480 7.480 7.542 -0.062 18963 546 1 6 . 1 1 2 2 SER HA H 2 4.480 4.480 4.590 -0.110 18963 547 1 6 . 1 1 3 3 MET HA H 3 4.100 4.100 4.620 -0.520 18963 548 1 6 . 1 1 3 3 MET H H 3 8.340 8.340 8.402 -0.062 18963 549 1 6 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.130 -0.170 18963 550 1 6 . 1 1 4 4 ASP H H 4 8.430 8.430 8.908 -0.478 18963 551 1 6 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.646 -0.236 18963 552 1 6 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.768 0.092 18963 553 1 6 . 1 1 6 6 ASN H H 6 8.660 8.660 8.613 0.047 18963 554 1 6 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.576 -0.526 18963 555 1 6 . 1 1 7 7 ALA H H 7 7.140 7.140 7.521 -0.381 18963 556 1 6 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.385 -0.505 18963 557 1 6 . 1 1 8 8 LEU H H 8 7.780 7.780 7.778 0.002 18963 558 1 6 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.473 0.357 18963 559 1 6 . 1 1 9 9 TYR H H 9 7.800 7.800 8.399 -0.599 18963 560 1 6 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.250 -0.320 18963 561 1 6 . 1 1 10 10 CYS H H 10 7.760 7.760 8.231 -0.471 18963 562 1 6 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.941 0.499 18963 563 1 6 . 1 1 11 11 ILE H H 11 10.080 10.080 8.692 1.388 18963 564 1 6 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.584 0.056 18963 565 1 6 . 1 1 12 12 CYS H H 12 7.590 7.590 8.105 -0.515 18963 566 1 6 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.969 -0.079 18963 567 1 6 . 1 1 13 13 ARG H H 13 7.690 7.690 8.213 -0.523 18963 568 1 6 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.881 0.179 18963 569 1 6 . 1 1 14 14 GLN H H 14 8.110 8.110 8.298 -0.188 18963 570 1 6 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.801 0.449 18963 571 1 6 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.456 0.014 18963 572 1 6 . 1 1 16 16 HIS H H 16 9.800 9.800 8.982 0.818 18963 573 1 6 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.358 -0.188 18963 574 1 6 . 1 1 17 17 ASN H H 17 8.450 8.450 8.389 0.061 18963 575 1 6 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.874 -0.664 18963 576 1 6 . 1 1 18 18 ASN H H 18 9.010 9.010 8.083 0.927 18963 577 1 6 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.595 -0.165 18963 578 1 6 . 1 1 19 19 ARG H H 19 7.710 7.710 7.979 -0.269 18963 579 1 6 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.415 0.095 18963 580 1 6 . 1 1 20 20 PHE H H 20 8.680 8.680 8.696 -0.016 18963 581 1 6 . 1 1 21 21 MET HA H 21 5.310 5.310 5.041 0.269 18963 582 1 6 . 1 1 21 21 MET H H 21 7.880 7.880 7.318 0.562 18963 583 1 6 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.486 -0.096 18963 584 1 6 . 1 1 22 22 ILE H H 22 9.180 9.180 9.046 0.134 18963 585 1 6 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.162 0.228 18963 586 1 6 . 1 1 23 23 CYS H H 23 8.000 8.000 8.071 -0.071 18963 587 1 6 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.029 -0.479 18963 588 1 6 . 1 1 24 24 CYS H H 24 8.750 8.750 9.029 -0.279 18963 589 1 6 . 1 1 25 25 ASP H H 25 9.390 9.390 8.468 0.922 18963 590 1 6 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.136 0.384 18963 591 1 6 . 1 1 26 26 ARG H H 26 9.390 9.390 8.283 1.107 18963 592 1 6 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.808 -0.038 18963 593 1 6 . 1 1 27 27 CYS H H 27 8.550 8.550 7.746 0.804 18963 594 1 6 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.975 0.205 18963 595 1 6 . 1 1 28 28 GLU H H 28 7.660 7.660 8.204 -0.544 18963 596 1 6 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.615 0.015 18963 597 1 6 . 1 1 29 29 GLU H H 29 8.220 8.220 7.779 0.441 18963 598 1 6 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.435 -0.595 18963 599 1 6 . 1 1 30 30 TRP H H 30 8.250 8.250 8.051 0.199 18963 600 1 6 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.798 -0.218 18963 601 1 6 . 1 1 31 31 PHE H H 31 9.210 9.210 9.237 -0.027 18963 602 1 6 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.172 -0.002 18963 603 1 6 . 1 1 32 32 HIS H H 32 9.740 9.740 8.664 1.076 18963 604 1 6 . 1 1 33 33 GLY H H 33 9.090 9.090 8.824 0.266 18963 605 1 6 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.575 -0.175 18963 606 1 6 . 1 1 34 34 ASP H H 34 9.110 9.110 8.557 0.552 18963 607 1 6 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.398 -0.168 18963 608 1 6 . 1 1 35 35 CYS H H 35 7.660 7.660 8.192 -0.532 18963 609 1 6 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.269 0.361 18963 610 1 6 . 1 1 36 36 VAL H H 36 7.360 7.360 8.527 -1.167 18963 611 1 6 . 1 1 37 37 GLY H H 37 7.670 7.670 7.974 -0.304 18963 612 1 6 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.133 0.207 18963 613 1 6 . 1 1 38 38 ILE H H 38 8.510 8.510 7.995 0.515 18963 614 1 6 . 1 1 39 39 SER HA H 39 4.450 4.450 4.572 -0.122 18963 615 1 6 . 1 1 39 39 SER H H 39 8.010 8.010 8.294 -0.284 18963 616 1 6 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.971 -0.351 18963 617 1 6 . 1 1 40 40 GLU H H 40 8.660 8.660 8.952 -0.292 18963 618 1 6 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.122 -0.182 18963 619 1 6 . 1 1 41 41 ALA H H 41 8.120 8.120 8.125 -0.005 18963 620 1 6 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.059 0.041 18963 621 1 6 . 1 1 42 42 ARG H H 42 7.840 7.840 7.449 0.391 18963 622 1 6 . 1 1 43 43 GLY H H 43 8.840 8.840 8.747 0.093 18963 623 1 6 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.267 -0.027 18963 624 1 6 . 1 1 44 44 ARG H H 44 8.240 8.240 7.341 0.899 18963 625 1 6 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.029 0.111 18963 626 1 6 . 1 1 45 45 LEU H H 45 7.610 7.610 7.415 0.195 18963 627 1 6 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.026 0.084 18963 628 1 6 . 1 1 46 46 LEU H H 46 8.150 8.150 7.842 0.308 18963 629 1 6 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.133 0.057 18963 630 1 6 . 1 1 47 47 GLU H H 47 7.800 7.800 7.656 0.144 18963 631 1 6 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.278 -0.118 18963 632 1 6 . 1 1 48 48 ARG H H 48 8.250 8.250 8.161 0.089 18963 633 1 6 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.730 0.010 18963 634 1 6 . 1 1 49 49 ASN H H 49 8.280 8.280 8.318 -0.038 18963 635 1 6 . 1 1 50 50 GLY H H 50 8.060 8.060 7.902 0.158 18963 636 1 6 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.405 -0.045 18963 637 1 6 . 1 1 51 51 GLU H H 51 8.180 8.180 8.072 0.108 18963 638 1 6 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.365 0.285 18963 639 1 6 . 1 1 52 52 ASP H H 52 8.350 8.350 8.439 -0.089 18963 640 1 6 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.645 -0.155 18963 641 1 6 . 1 1 53 53 TYR H H 53 9.200 9.200 7.854 1.346 18963 642 1 6 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.110 0.540 18963 643 1 6 . 1 1 54 54 ILE H H 54 6.790 6.790 7.355 -0.565 18963 644 1 6 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.243 0.077 18963 645 1 6 . 1 1 55 55 CYS H H 55 9.070 9.070 8.102 0.968 18963 646 1 6 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.138 0.062 18963 647 1 6 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.630 -0.060 18963 648 1 6 . 1 1 57 57 ASN H H 57 8.370 8.370 7.897 0.473 18963 649 1 6 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.362 -0.332 18963 650 1 6 . 1 1 58 58 CYS H H 58 8.300 8.300 7.606 0.694 18963 651 1 6 . 1 1 59 59 THR HA H 59 3.860 3.860 3.953 -0.093 18963 652 1 6 . 1 1 59 59 THR H H 59 7.600 7.600 7.707 -0.107 18963 653 1 6 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.367 -0.157 18963 654 1 6 . 1 1 60 60 ILE H H 60 7.480 7.480 7.596 -0.116 18963 655 1 7 . 1 1 2 2 SER HA H 2 4.480 4.480 4.636 -0.156 18963 656 1 7 . 1 1 3 3 MET HA H 3 4.100 4.100 4.313 -0.213 18963 657 1 7 . 1 1 3 3 MET H H 3 8.340 8.340 8.594 -0.254 18963 658 1 7 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.088 -0.128 18963 659 1 7 . 1 1 4 4 ASP H H 4 8.430 8.430 8.829 -0.399 18963 660 1 7 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.547 -0.137 18963 661 1 7 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.763 0.097 18963 662 1 7 . 1 1 6 6 ASN H H 6 8.660 8.660 8.209 0.451 18963 663 1 7 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.594 -0.544 18963 664 1 7 . 1 1 7 7 ALA H H 7 7.140 7.140 7.787 -0.647 18963 665 1 7 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.303 -0.423 18963 666 1 7 . 1 1 8 8 LEU H H 8 7.780 7.780 7.780 0.000 18963 667 1 7 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.726 0.104 18963 668 1 7 . 1 1 9 9 TYR H H 9 7.800 7.800 8.372 -0.572 18963 669 1 7 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.128 -0.198 18963 670 1 7 . 1 1 10 10 CYS H H 10 7.760 7.760 8.260 -0.500 18963 671 1 7 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.940 0.500 18963 672 1 7 . 1 1 11 11 ILE H H 11 10.080 10.080 8.674 1.406 18963 673 1 7 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.583 0.057 18963 674 1 7 . 1 1 12 12 CYS H H 12 7.590 7.590 8.080 -0.490 18963 675 1 7 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.954 -0.064 18963 676 1 7 . 1 1 13 13 ARG H H 13 7.690 7.690 8.211 -0.521 18963 677 1 7 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.877 0.183 18963 678 1 7 . 1 1 14 14 GLN H H 14 8.110 8.110 8.287 -0.177 18963 679 1 7 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.860 0.390 18963 680 1 7 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.504 -0.034 18963 681 1 7 . 1 1 16 16 HIS H H 16 9.800 9.800 9.042 0.758 18963 682 1 7 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.306 -0.136 18963 683 1 7 . 1 1 17 17 ASN H H 17 8.450 8.450 8.486 -0.036 18963 684 1 7 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.851 -0.641 18963 685 1 7 . 1 1 18 18 ASN H H 18 9.010 9.010 8.088 0.922 18963 686 1 7 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.677 -0.247 18963 687 1 7 . 1 1 19 19 ARG H H 19 7.710 7.710 8.125 -0.415 18963 688 1 7 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.426 0.084 18963 689 1 7 . 1 1 20 20 PHE H H 20 8.680 8.680 8.516 0.164 18963 690 1 7 . 1 1 21 21 MET HA H 21 5.310 5.310 5.030 0.280 18963 691 1 7 . 1 1 21 21 MET H H 21 7.880 7.880 7.327 0.553 18963 692 1 7 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.454 -0.064 18963 693 1 7 . 1 1 22 22 ILE H H 22 9.180 9.180 9.084 0.096 18963 694 1 7 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.285 0.105 18963 695 1 7 . 1 1 23 23 CYS H H 23 8.000 8.000 8.172 -0.172 18963 696 1 7 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.045 -0.495 18963 697 1 7 . 1 1 24 24 CYS H H 24 8.750 8.750 8.983 -0.233 18963 698 1 7 . 1 1 25 25 ASP H H 25 9.390 9.390 8.419 0.971 18963 699 1 7 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.136 0.384 18963 700 1 7 . 1 1 26 26 ARG H H 26 9.390 9.390 8.289 1.101 18963 701 1 7 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.800 -0.030 18963 702 1 7 . 1 1 27 27 CYS H H 27 8.550 8.550 7.751 0.799 18963 703 1 7 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.951 0.229 18963 704 1 7 . 1 1 28 28 GLU H H 28 7.660 7.660 8.160 -0.500 18963 705 1 7 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.572 0.058 18963 706 1 7 . 1 1 29 29 GLU H H 29 8.220 8.220 7.818 0.402 18963 707 1 7 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.446 -0.606 18963 708 1 7 . 1 1 30 30 TRP H H 30 8.250 8.250 8.172 0.078 18963 709 1 7 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.804 -0.224 18963 710 1 7 . 1 1 31 31 PHE H H 31 9.210 9.210 9.376 -0.166 18963 711 1 7 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.176 -0.006 18963 712 1 7 . 1 1 32 32 HIS H H 32 9.740 9.740 8.723 1.017 18963 713 1 7 . 1 1 33 33 GLY H H 33 9.090 9.090 8.739 0.351 18963 714 1 7 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.559 -0.159 18963 715 1 7 . 1 1 34 34 ASP H H 34 9.110 9.110 8.550 0.560 18963 716 1 7 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.400 -0.170 18963 717 1 7 . 1 1 35 35 CYS H H 35 7.660 7.660 8.177 -0.517 18963 718 1 7 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.251 0.379 18963 719 1 7 . 1 1 36 36 VAL H H 36 7.360 7.360 8.467 -1.107 18963 720 1 7 . 1 1 37 37 GLY H H 37 7.670 7.670 7.855 -0.185 18963 721 1 7 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.032 0.308 18963 722 1 7 . 1 1 38 38 ILE H H 38 8.510 8.510 8.027 0.483 18963 723 1 7 . 1 1 39 39 SER HA H 39 4.450 4.450 4.424 0.026 18963 724 1 7 . 1 1 39 39 SER H H 39 8.010 8.010 8.143 -0.133 18963 725 1 7 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.797 -0.177 18963 726 1 7 . 1 1 40 40 GLU H H 40 8.660 8.660 8.900 -0.240 18963 727 1 7 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.112 -0.172 18963 728 1 7 . 1 1 41 41 ALA H H 41 8.120 8.120 8.028 0.092 18963 729 1 7 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.044 0.056 18963 730 1 7 . 1 1 42 42 ARG H H 42 7.840 7.840 8.269 -0.429 18963 731 1 7 . 1 1 43 43 GLY H H 43 8.840 8.840 8.662 0.178 18963 732 1 7 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.276 -0.036 18963 733 1 7 . 1 1 44 44 ARG H H 44 8.240 8.240 7.579 0.661 18963 734 1 7 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.082 0.058 18963 735 1 7 . 1 1 45 45 LEU H H 45 7.610 7.610 7.857 -0.247 18963 736 1 7 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.912 0.198 18963 737 1 7 . 1 1 46 46 LEU H H 46 8.150 8.150 7.663 0.487 18963 738 1 7 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.046 0.144 18963 739 1 7 . 1 1 47 47 GLU H H 47 7.800 7.800 7.821 -0.021 18963 740 1 7 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.203 -0.043 18963 741 1 7 . 1 1 48 48 ARG H H 48 8.250 8.250 7.915 0.335 18963 742 1 7 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.754 -0.014 18963 743 1 7 . 1 1 49 49 ASN H H 49 8.280 8.280 8.043 0.237 18963 744 1 7 . 1 1 50 50 GLY H H 50 8.060 8.060 7.883 0.177 18963 745 1 7 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.327 0.033 18963 746 1 7 . 1 1 51 51 GLU H H 51 8.180 8.180 8.143 0.037 18963 747 1 7 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.519 0.131 18963 748 1 7 . 1 1 52 52 ASP H H 52 8.350 8.350 8.537 -0.187 18963 749 1 7 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.492 -0.002 18963 750 1 7 . 1 1 53 53 TYR H H 53 9.200 9.200 7.914 1.286 18963 751 1 7 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.097 0.553 18963 752 1 7 . 1 1 54 54 ILE H H 54 6.790 6.790 7.250 -0.460 18963 753 1 7 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.245 0.075 18963 754 1 7 . 1 1 55 55 CYS H H 55 9.070 9.070 8.103 0.967 18963 755 1 7 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.138 0.062 18963 756 1 7 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.614 -0.044 18963 757 1 7 . 1 1 57 57 ASN H H 57 8.370 8.370 7.842 0.528 18963 758 1 7 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.431 -0.401 18963 759 1 7 . 1 1 58 58 CYS H H 58 8.300 8.300 7.706 0.594 18963 760 1 7 . 1 1 59 59 THR HA H 59 3.860 3.860 3.978 -0.118 18963 761 1 7 . 1 1 59 59 THR H H 59 7.600 7.600 7.827 -0.227 18963 762 1 7 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.543 -0.333 18963 763 1 7 . 1 1 60 60 ILE H H 60 7.480 7.480 7.594 -0.114 18963 764 1 8 . 1 1 2 2 SER HA H 2 4.480 4.480 4.601 -0.121 18963 765 1 8 . 1 1 3 3 MET HA H 3 4.100 4.100 4.355 -0.255 18963 766 1 8 . 1 1 3 3 MET H H 3 8.340 8.340 8.630 -0.290 18963 767 1 8 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.140 -0.180 18963 768 1 8 . 1 1 4 4 ASP H H 4 8.430 8.430 8.983 -0.553 18963 769 1 8 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.631 -0.221 18963 770 1 8 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.735 0.125 18963 771 1 8 . 1 1 6 6 ASN H H 6 8.660 8.660 8.634 0.026 18963 772 1 8 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.596 -0.546 18963 773 1 8 . 1 1 7 7 ALA H H 7 7.140 7.140 7.242 -0.102 18963 774 1 8 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.329 -0.449 18963 775 1 8 . 1 1 8 8 LEU H H 8 7.780 7.780 7.986 -0.206 18963 776 1 8 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.512 0.318 18963 777 1 8 . 1 1 9 9 TYR H H 9 7.800 7.800 8.481 -0.681 18963 778 1 8 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.257 -0.327 18963 779 1 8 . 1 1 10 10 CYS H H 10 7.760 7.760 8.284 -0.524 18963 780 1 8 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.918 0.522 18963 781 1 8 . 1 1 11 11 ILE H H 11 10.080 10.080 8.724 1.356 18963 782 1 8 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.526 0.114 18963 783 1 8 . 1 1 12 12 CYS H H 12 7.590 7.590 8.106 -0.516 18963 784 1 8 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.944 -0.054 18963 785 1 8 . 1 1 13 13 ARG H H 13 7.690 7.690 8.206 -0.516 18963 786 1 8 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.795 0.265 18963 787 1 8 . 1 1 14 14 GLN H H 14 8.110 8.110 8.255 -0.145 18963 788 1 8 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.708 0.542 18963 789 1 8 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.462 0.008 18963 790 1 8 . 1 1 16 16 HIS H H 16 9.800 9.800 8.948 0.852 18963 791 1 8 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.312 -0.142 18963 792 1 8 . 1 1 17 17 ASN H H 17 8.450 8.450 8.421 0.029 18963 793 1 8 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.909 -0.699 18963 794 1 8 . 1 1 18 18 ASN H H 18 9.010 9.010 8.075 0.935 18963 795 1 8 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.631 -0.201 18963 796 1 8 . 1 1 19 19 ARG H H 19 7.710 7.710 7.989 -0.279 18963 797 1 8 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.419 0.091 18963 798 1 8 . 1 1 20 20 PHE H H 20 8.680 8.680 8.704 -0.024 18963 799 1 8 . 1 1 21 21 MET HA H 21 5.310 5.310 4.836 0.474 18963 800 1 8 . 1 1 21 21 MET H H 21 7.880 7.880 7.339 0.541 18963 801 1 8 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.491 -0.101 18963 802 1 8 . 1 1 22 22 ILE H H 22 9.180 9.180 9.257 -0.077 18963 803 1 8 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.127 0.263 18963 804 1 8 . 1 1 23 23 CYS H H 23 8.000 8.000 8.058 -0.058 18963 805 1 8 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.047 -0.497 18963 806 1 8 . 1 1 24 24 CYS H H 24 8.750 8.750 8.975 -0.225 18963 807 1 8 . 1 1 25 25 ASP H H 25 9.390 9.390 8.327 1.063 18963 808 1 8 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.134 0.386 18963 809 1 8 . 1 1 26 26 ARG H H 26 9.390 9.390 8.278 1.112 18963 810 1 8 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.786 -0.016 18963 811 1 8 . 1 1 27 27 CYS H H 27 8.550 8.550 7.802 0.748 18963 812 1 8 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.992 0.188 18963 813 1 8 . 1 1 28 28 GLU H H 28 7.660 7.660 8.173 -0.513 18963 814 1 8 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.590 0.040 18963 815 1 8 . 1 1 29 29 GLU H H 29 8.220 8.220 7.794 0.426 18963 816 1 8 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.483 -0.643 18963 817 1 8 . 1 1 30 30 TRP H H 30 8.250 8.250 8.006 0.244 18963 818 1 8 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.835 -0.255 18963 819 1 8 . 1 1 31 31 PHE H H 31 9.210 9.210 9.355 -0.145 18963 820 1 8 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.808 0.362 18963 821 1 8 . 1 1 32 32 HIS H H 32 9.740 9.740 8.519 1.221 18963 822 1 8 . 1 1 33 33 GLY H H 33 9.090 9.090 8.748 0.342 18963 823 1 8 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.517 -0.117 18963 824 1 8 . 1 1 34 34 ASP H H 34 9.110 9.110 8.410 0.700 18963 825 1 8 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.355 -0.125 18963 826 1 8 . 1 1 35 35 CYS H H 35 7.660 7.660 8.255 -0.595 18963 827 1 8 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.236 0.394 18963 828 1 8 . 1 1 36 36 VAL H H 36 7.360 7.360 8.252 -0.892 18963 829 1 8 . 1 1 37 37 GLY H H 37 7.670 7.670 7.866 -0.196 18963 830 1 8 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.053 0.287 18963 831 1 8 . 1 1 38 38 ILE H H 38 8.510 8.510 7.983 0.527 18963 832 1 8 . 1 1 39 39 SER HA H 39 4.450 4.450 4.414 0.036 18963 833 1 8 . 1 1 39 39 SER H H 39 8.010 8.010 8.177 -0.167 18963 834 1 8 . 1 1 40 40 GLU HA H 40 2.620 2.620 3.110 -0.490 18963 835 1 8 . 1 1 40 40 GLU H H 40 8.660 8.660 8.866 -0.206 18963 836 1 8 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.180 -0.240 18963 837 1 8 . 1 1 41 41 ALA H H 41 8.120 8.120 8.112 0.008 18963 838 1 8 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.117 -0.017 18963 839 1 8 . 1 1 42 42 ARG H H 42 7.840 7.840 8.116 -0.276 18963 840 1 8 . 1 1 43 43 GLY H H 43 8.840 8.840 8.405 0.435 18963 841 1 8 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.258 -0.018 18963 842 1 8 . 1 1 44 44 ARG H H 44 8.240 8.240 7.590 0.650 18963 843 1 8 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.088 0.052 18963 844 1 8 . 1 1 45 45 LEU H H 45 7.610 7.610 7.329 0.281 18963 845 1 8 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.948 0.162 18963 846 1 8 . 1 1 46 46 LEU H H 46 8.150 8.150 7.667 0.483 18963 847 1 8 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.116 0.074 18963 848 1 8 . 1 1 47 47 GLU H H 47 7.800 7.800 7.596 0.204 18963 849 1 8 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.229 -0.069 18963 850 1 8 . 1 1 48 48 ARG H H 48 8.250 8.250 7.760 0.490 18963 851 1 8 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.791 -0.051 18963 852 1 8 . 1 1 49 49 ASN H H 49 8.280 8.280 7.979 0.301 18963 853 1 8 . 1 1 50 50 GLY H H 50 8.060 8.060 7.888 0.172 18963 854 1 8 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.396 -0.036 18963 855 1 8 . 1 1 51 51 GLU H H 51 8.180 8.180 8.109 0.071 18963 856 1 8 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.284 0.366 18963 857 1 8 . 1 1 52 52 ASP H H 52 8.350 8.350 8.414 -0.064 18963 858 1 8 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.490 -0.000 18963 859 1 8 . 1 1 53 53 TYR H H 53 9.200 9.200 7.954 1.246 18963 860 1 8 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.099 0.550 18963 861 1 8 . 1 1 54 54 ILE H H 54 6.790 6.790 7.255 -0.465 18963 862 1 8 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.258 0.062 18963 863 1 8 . 1 1 55 55 CYS H H 55 9.070 9.070 8.112 0.958 18963 864 1 8 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.138 0.062 18963 865 1 8 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.629 -0.059 18963 866 1 8 . 1 1 57 57 ASN H H 57 8.370 8.370 7.881 0.489 18963 867 1 8 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.551 -0.521 18963 868 1 8 . 1 1 58 58 CYS H H 58 8.300 8.300 7.592 0.708 18963 869 1 8 . 1 1 59 59 THR HA H 59 3.860 3.860 3.980 -0.120 18963 870 1 8 . 1 1 59 59 THR H H 59 7.600 7.600 7.611 -0.011 18963 871 1 8 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.364 -0.154 18963 872 1 8 . 1 1 60 60 ILE H H 60 7.480 7.480 7.575 -0.095 18963 873 1 9 . 1 1 2 2 SER HA H 2 4.480 4.480 4.618 -0.138 18963 874 1 9 . 1 1 3 3 MET HA H 3 4.100 4.100 4.441 -0.341 18963 875 1 9 . 1 1 3 3 MET H H 3 8.340 8.340 8.772 -0.432 18963 876 1 9 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.116 -0.156 18963 877 1 9 . 1 1 4 4 ASP H H 4 8.430 8.430 8.819 -0.389 18963 878 1 9 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.582 -0.172 18963 879 1 9 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.705 0.155 18963 880 1 9 . 1 1 6 6 ASN H H 6 8.660 8.660 8.342 0.318 18963 881 1 9 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.627 -0.577 18963 882 1 9 . 1 1 7 7 ALA H H 7 7.140 7.140 7.587 -0.447 18963 883 1 9 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.306 -0.426 18963 884 1 9 . 1 1 8 8 LEU H H 8 7.780 7.780 7.998 -0.218 18963 885 1 9 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.808 0.022 18963 886 1 9 . 1 1 9 9 TYR H H 9 7.800 7.800 8.467 -0.667 18963 887 1 9 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.254 -0.324 18963 888 1 9 . 1 1 10 10 CYS H H 10 7.760 7.760 8.283 -0.523 18963 889 1 9 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.906 0.534 18963 890 1 9 . 1 1 11 11 ILE H H 11 10.080 10.080 8.709 1.371 18963 891 1 9 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.521 0.119 18963 892 1 9 . 1 1 12 12 CYS H H 12 7.590 7.590 8.060 -0.470 18963 893 1 9 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.944 -0.054 18963 894 1 9 . 1 1 13 13 ARG H H 13 7.690 7.690 8.208 -0.518 18963 895 1 9 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.787 0.273 18963 896 1 9 . 1 1 14 14 GLN H H 14 8.110 8.110 8.252 -0.142 18963 897 1 9 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.641 0.609 18963 898 1 9 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.425 0.045 18963 899 1 9 . 1 1 16 16 HIS H H 16 9.800 9.800 8.987 0.813 18963 900 1 9 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.403 -0.233 18963 901 1 9 . 1 1 17 17 ASN H H 17 8.450 8.450 8.220 0.230 18963 902 1 9 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.872 -0.662 18963 903 1 9 . 1 1 18 18 ASN H H 18 9.010 9.010 8.084 0.926 18963 904 1 9 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.709 -0.279 18963 905 1 9 . 1 1 19 19 ARG H H 19 7.710 7.710 8.158 -0.448 18963 906 1 9 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.406 0.104 18963 907 1 9 . 1 1 20 20 PHE H H 20 8.680 8.680 8.528 0.152 18963 908 1 9 . 1 1 21 21 MET HA H 21 5.310 5.310 4.830 0.480 18963 909 1 9 . 1 1 21 21 MET H H 21 7.880 7.880 7.344 0.536 18963 910 1 9 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.496 -0.106 18963 911 1 9 . 1 1 22 22 ILE H H 22 9.180 9.180 9.254 -0.074 18963 912 1 9 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.129 0.261 18963 913 1 9 . 1 1 23 23 CYS H H 23 8.000 8.000 8.058 -0.058 18963 914 1 9 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.073 -0.523 18963 915 1 9 . 1 1 24 24 CYS H H 24 8.750 8.750 8.972 -0.222 18963 916 1 9 . 1 1 25 25 ASP H H 25 9.390 9.390 8.381 1.009 18963 917 1 9 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.140 0.380 18963 918 1 9 . 1 1 26 26 ARG H H 26 9.390 9.390 8.229 1.161 18963 919 1 9 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.831 -0.061 18963 920 1 9 . 1 1 27 27 CYS H H 27 8.550 8.550 7.810 0.740 18963 921 1 9 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.966 0.214 18963 922 1 9 . 1 1 28 28 GLU H H 28 7.660 7.660 8.312 -0.652 18963 923 1 9 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.590 0.040 18963 924 1 9 . 1 1 29 29 GLU H H 29 8.220 8.220 7.775 0.445 18963 925 1 9 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.460 -0.620 18963 926 1 9 . 1 1 30 30 TRP H H 30 8.250 8.250 8.120 0.130 18963 927 1 9 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.837 -0.257 18963 928 1 9 . 1 1 31 31 PHE H H 31 9.210 9.210 9.357 -0.147 18963 929 1 9 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.814 0.356 18963 930 1 9 . 1 1 32 32 HIS H H 32 9.740 9.740 8.519 1.221 18963 931 1 9 . 1 1 33 33 GLY H H 33 9.090 9.090 8.821 0.269 18963 932 1 9 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.528 -0.128 18963 933 1 9 . 1 1 34 34 ASP H H 34 9.110 9.110 8.455 0.655 18963 934 1 9 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.350 -0.120 18963 935 1 9 . 1 1 35 35 CYS H H 35 7.660 7.660 8.371 -0.711 18963 936 1 9 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.367 0.263 18963 937 1 9 . 1 1 36 36 VAL H H 36 7.360 7.360 8.230 -0.870 18963 938 1 9 . 1 1 37 37 GLY H H 37 7.670 7.670 7.909 -0.239 18963 939 1 9 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.025 0.315 18963 940 1 9 . 1 1 38 38 ILE H H 38 8.510 8.510 8.075 0.435 18963 941 1 9 . 1 1 39 39 SER HA H 39 4.450 4.450 4.429 0.021 18963 942 1 9 . 1 1 39 39 SER H H 39 8.010 8.010 8.296 -0.286 18963 943 1 9 . 1 1 40 40 GLU HA H 40 2.620 2.620 3.056 -0.436 18963 944 1 9 . 1 1 40 40 GLU H H 40 8.660 8.660 8.843 -0.183 18963 945 1 9 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.156 -0.216 18963 946 1 9 . 1 1 41 41 ALA H H 41 8.120 8.120 8.081 0.039 18963 947 1 9 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.051 0.049 18963 948 1 9 . 1 1 42 42 ARG H H 42 7.840 7.840 8.330 -0.490 18963 949 1 9 . 1 1 43 43 GLY H H 43 8.840 8.840 8.443 0.397 18963 950 1 9 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.199 0.041 18963 951 1 9 . 1 1 44 44 ARG H H 44 8.240 8.240 7.636 0.604 18963 952 1 9 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.101 0.039 18963 953 1 9 . 1 1 45 45 LEU H H 45 7.610 7.610 8.094 -0.484 18963 954 1 9 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.941 0.170 18963 955 1 9 . 1 1 46 46 LEU H H 46 8.150 8.150 7.785 0.365 18963 956 1 9 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.109 0.081 18963 957 1 9 . 1 1 47 47 GLU H H 47 7.800 7.800 7.623 0.177 18963 958 1 9 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.284 -0.124 18963 959 1 9 . 1 1 48 48 ARG H H 48 8.250 8.250 7.615 0.635 18963 960 1 9 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.770 -0.030 18963 961 1 9 . 1 1 49 49 ASN H H 49 8.280 8.280 8.107 0.173 18963 962 1 9 . 1 1 50 50 GLY H H 50 8.060 8.060 8.058 0.002 18963 963 1 9 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.254 0.106 18963 964 1 9 . 1 1 51 51 GLU H H 51 8.180 8.180 7.927 0.253 18963 965 1 9 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.365 0.285 18963 966 1 9 . 1 1 52 52 ASP H H 52 8.350 8.350 8.367 -0.017 18963 967 1 9 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.518 -0.028 18963 968 1 9 . 1 1 53 53 TYR H H 53 9.200 9.200 7.979 1.221 18963 969 1 9 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.109 0.541 18963 970 1 9 . 1 1 54 54 ILE H H 54 6.790 6.790 7.274 -0.484 18963 971 1 9 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.251 0.069 18963 972 1 9 . 1 1 55 55 CYS H H 55 9.070 9.070 8.117 0.953 18963 973 1 9 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.133 0.067 18963 974 1 9 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.619 -0.049 18963 975 1 9 . 1 1 57 57 ASN H H 57 8.370 8.370 7.890 0.480 18963 976 1 9 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.252 -0.222 18963 977 1 9 . 1 1 58 58 CYS H H 58 8.300 8.300 7.587 0.714 18963 978 1 9 . 1 1 59 59 THR HA H 59 3.860 3.860 3.956 -0.096 18963 979 1 9 . 1 1 59 59 THR H H 59 7.600 7.600 7.681 -0.081 18963 980 1 9 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.386 -0.176 18963 981 1 9 . 1 1 60 60 ILE H H 60 7.480 7.480 7.582 -0.102 18963 982 1 10 . 1 1 2 2 SER HA H 2 4.480 4.480 4.791 -0.311 18963 983 1 10 . 1 1 3 3 MET HA H 3 4.100 4.100 4.430 -0.330 18963 984 1 10 . 1 1 3 3 MET H H 3 8.340 8.340 8.609 -0.269 18963 985 1 10 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.098 -0.138 18963 986 1 10 . 1 1 4 4 ASP H H 4 8.430 8.430 8.618 -0.188 18963 987 1 10 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.657 -0.247 18963 988 1 10 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.639 0.221 18963 989 1 10 . 1 1 6 6 ASN H H 6 8.660 8.660 8.368 0.292 18963 990 1 10 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.583 -0.533 18963 991 1 10 . 1 1 7 7 ALA H H 7 7.140 7.140 7.336 -0.196 18963 992 1 10 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.374 -0.494 18963 993 1 10 . 1 1 8 8 LEU H H 8 7.780 7.780 7.911 -0.131 18963 994 1 10 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.533 0.297 18963 995 1 10 . 1 1 9 9 TYR H H 9 7.800 7.800 8.510 -0.710 18963 996 1 10 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.133 -0.203 18963 997 1 10 . 1 1 10 10 CYS H H 10 7.760 7.760 8.234 -0.474 18963 998 1 10 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.902 0.538 18963 999 1 10 . 1 1 11 11 ILE H H 11 10.080 10.080 8.741 1.339 18963 1000 1 10 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.526 0.114 18963 1001 1 10 . 1 1 12 12 CYS H H 12 7.590 7.590 7.990 -0.400 18963 1002 1 10 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.976 -0.086 18963 1003 1 10 . 1 1 13 13 ARG H H 13 7.690 7.690 8.177 -0.487 18963 1004 1 10 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.778 0.282 18963 1005 1 10 . 1 1 14 14 GLN H H 14 8.110 8.110 8.226 -0.116 18963 1006 1 10 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.780 0.470 18963 1007 1 10 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.461 0.009 18963 1008 1 10 . 1 1 16 16 HIS H H 16 9.800 9.800 9.026 0.774 18963 1009 1 10 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.368 -0.198 18963 1010 1 10 . 1 1 17 17 ASN H H 17 8.450 8.450 8.327 0.123 18963 1011 1 10 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.879 -0.669 18963 1012 1 10 . 1 1 18 18 ASN H H 18 9.010 9.010 8.150 0.860 18963 1013 1 10 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.674 -0.244 18963 1014 1 10 . 1 1 19 19 ARG H H 19 7.710 7.710 8.034 -0.324 18963 1015 1 10 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.466 0.044 18963 1016 1 10 . 1 1 20 20 PHE H H 20 8.680 8.680 8.433 0.247 18963 1017 1 10 . 1 1 21 21 MET HA H 21 5.310 5.310 5.032 0.278 18963 1018 1 10 . 1 1 21 21 MET H H 21 7.880 7.880 7.317 0.563 18963 1019 1 10 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.470 -0.080 18963 1020 1 10 . 1 1 22 22 ILE H H 22 9.180 9.180 9.015 0.165 18963 1021 1 10 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.198 0.192 18963 1022 1 10 . 1 1 23 23 CYS H H 23 8.000 8.000 8.121 -0.121 18963 1023 1 10 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.003 -0.453 18963 1024 1 10 . 1 1 24 24 CYS H H 24 8.750 8.750 8.971 -0.221 18963 1025 1 10 . 1 1 25 25 ASP H H 25 9.390 9.390 8.511 0.879 18963 1026 1 10 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.139 0.381 18963 1027 1 10 . 1 1 26 26 ARG H H 26 9.390 9.390 8.274 1.116 18963 1028 1 10 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.846 -0.076 18963 1029 1 10 . 1 1 27 27 CYS H H 27 8.550 8.550 7.772 0.778 18963 1030 1 10 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.954 0.226 18963 1031 1 10 . 1 1 28 28 GLU H H 28 7.660 7.660 8.252 -0.592 18963 1032 1 10 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.639 -0.009 18963 1033 1 10 . 1 1 29 29 GLU H H 29 8.220 8.220 7.784 0.436 18963 1034 1 10 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.454 -0.614 18963 1035 1 10 . 1 1 30 30 TRP H H 30 8.250 8.250 8.064 0.186 18963 1036 1 10 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.803 -0.223 18963 1037 1 10 . 1 1 31 31 PHE H H 31 9.210 9.210 9.376 -0.166 18963 1038 1 10 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.171 -0.001 18963 1039 1 10 . 1 1 32 32 HIS H H 32 9.740 9.740 8.671 1.069 18963 1040 1 10 . 1 1 33 33 GLY H H 33 9.090 9.090 8.728 0.362 18963 1041 1 10 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.636 -0.236 18963 1042 1 10 . 1 1 34 34 ASP H H 34 9.110 9.110 8.642 0.468 18963 1043 1 10 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.395 -0.165 18963 1044 1 10 . 1 1 35 35 CYS H H 35 7.660 7.660 7.654 0.006 18963 1045 1 10 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.224 0.406 18963 1046 1 10 . 1 1 36 36 VAL H H 36 7.360 7.360 8.433 -1.073 18963 1047 1 10 . 1 1 37 37 GLY H H 37 7.670 7.670 7.961 -0.291 18963 1048 1 10 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.045 0.295 18963 1049 1 10 . 1 1 38 38 ILE H H 38 8.510 8.510 8.151 0.359 18963 1050 1 10 . 1 1 39 39 SER HA H 39 4.450 4.450 4.515 -0.065 18963 1051 1 10 . 1 1 39 39 SER H H 39 8.010 8.010 8.136 -0.126 18963 1052 1 10 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.788 -0.168 18963 1053 1 10 . 1 1 40 40 GLU H H 40 8.660 8.660 8.953 -0.293 18963 1054 1 10 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.190 -0.250 18963 1055 1 10 . 1 1 41 41 ALA H H 41 8.120 8.120 8.255 -0.135 18963 1056 1 10 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.112 -0.012 18963 1057 1 10 . 1 1 42 42 ARG H H 42 7.840 7.840 7.554 0.286 18963 1058 1 10 . 1 1 43 43 GLY H H 43 8.840 8.840 8.554 0.286 18963 1059 1 10 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.164 0.076 18963 1060 1 10 . 1 1 44 44 ARG H H 44 8.240 8.240 7.641 0.599 18963 1061 1 10 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.218 -0.078 18963 1062 1 10 . 1 1 45 45 LEU H H 45 7.610 7.610 7.267 0.343 18963 1063 1 10 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.206 -0.096 18963 1064 1 10 . 1 1 46 46 LEU H H 46 8.150 8.150 7.264 0.886 18963 1065 1 10 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.066 0.124 18963 1066 1 10 . 1 1 47 47 GLU H H 47 7.800 7.800 7.831 -0.031 18963 1067 1 10 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.188 -0.028 18963 1068 1 10 . 1 1 48 48 ARG H H 48 8.250 8.250 8.075 0.175 18963 1069 1 10 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.641 0.099 18963 1070 1 10 . 1 1 49 49 ASN H H 49 8.280 8.280 7.814 0.466 18963 1071 1 10 . 1 1 50 50 GLY H H 50 8.060 8.060 7.998 0.062 18963 1072 1 10 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.327 0.033 18963 1073 1 10 . 1 1 51 51 GLU H H 51 8.180 8.180 8.748 -0.568 18963 1074 1 10 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.264 0.386 18963 1075 1 10 . 1 1 52 52 ASP H H 52 8.350 8.350 8.434 -0.084 18963 1076 1 10 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.522 -0.032 18963 1077 1 10 . 1 1 53 53 TYR H H 53 9.200 9.200 7.922 1.278 18963 1078 1 10 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.102 0.548 18963 1079 1 10 . 1 1 54 54 ILE H H 54 6.790 6.790 7.283 -0.493 18963 1080 1 10 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.235 0.085 18963 1081 1 10 . 1 1 55 55 CYS H H 55 9.070 9.070 8.096 0.974 18963 1082 1 10 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.137 0.063 18963 1083 1 10 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.597 -0.027 18963 1084 1 10 . 1 1 57 57 ASN H H 57 8.370 8.370 7.861 0.509 18963 1085 1 10 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.348 -0.318 18963 1086 1 10 . 1 1 58 58 CYS H H 58 8.300 8.300 7.573 0.727 18963 1087 1 10 . 1 1 59 59 THR HA H 59 3.860 3.860 3.980 -0.120 18963 1088 1 10 . 1 1 59 59 THR H H 59 7.600 7.600 7.806 -0.206 18963 1089 1 10 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.433 -0.223 18963 1090 1 10 . 1 1 60 60 ILE H H 60 7.480 7.480 7.410 0.070 18963 1091 1 11 . 1 1 2 2 SER HA H 2 4.480 4.480 4.445 0.035 18963 1092 1 11 . 1 1 3 3 MET HA H 3 4.100 4.100 4.431 -0.331 18963 1093 1 11 . 1 1 3 3 MET H H 3 8.340 8.340 8.369 -0.029 18963 1094 1 11 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.121 -0.161 18963 1095 1 11 . 1 1 4 4 ASP H H 4 8.430 8.430 8.777 -0.347 18963 1096 1 11 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.538 -0.128 18963 1097 1 11 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.716 0.144 18963 1098 1 11 . 1 1 6 6 ASN H H 6 8.660 8.660 8.402 0.258 18963 1099 1 11 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.676 -0.626 18963 1100 1 11 . 1 1 7 7 ALA H H 7 7.140 7.140 7.573 -0.433 18963 1101 1 11 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.314 -0.434 18963 1102 1 11 . 1 1 8 8 LEU H H 8 7.780 7.780 7.869 -0.089 18963 1103 1 11 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.497 0.333 18963 1104 1 11 . 1 1 9 9 TYR H H 9 7.800 7.800 8.364 -0.564 18963 1105 1 11 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.267 -0.337 18963 1106 1 11 . 1 1 10 10 CYS H H 10 7.760 7.760 8.293 -0.533 18963 1107 1 11 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.910 0.530 18963 1108 1 11 . 1 1 11 11 ILE H H 11 10.080 10.080 8.704 1.376 18963 1109 1 11 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.518 0.122 18963 1110 1 11 . 1 1 12 12 CYS H H 12 7.590 7.590 8.153 -0.563 18963 1111 1 11 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.980 -0.090 18963 1112 1 11 . 1 1 13 13 ARG H H 13 7.690 7.690 8.267 -0.577 18963 1113 1 11 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.857 0.203 18963 1114 1 11 . 1 1 14 14 GLN H H 14 8.110 8.110 8.265 -0.155 18963 1115 1 11 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.650 0.600 18963 1116 1 11 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.403 0.067 18963 1117 1 11 . 1 1 16 16 HIS H H 16 9.800 9.800 8.985 0.815 18963 1118 1 11 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.385 -0.215 18963 1119 1 11 . 1 1 17 17 ASN H H 17 8.450 8.450 8.264 0.186 18963 1120 1 11 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.842 -0.632 18963 1121 1 11 . 1 1 18 18 ASN H H 18 9.010 9.010 8.070 0.940 18963 1122 1 11 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.612 -0.182 18963 1123 1 11 . 1 1 19 19 ARG H H 19 7.710 7.710 8.110 -0.400 18963 1124 1 11 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.414 0.096 18963 1125 1 11 . 1 1 20 20 PHE H H 20 8.680 8.680 8.682 -0.002 18963 1126 1 11 . 1 1 21 21 MET HA H 21 5.310 5.310 4.801 0.509 18963 1127 1 11 . 1 1 21 21 MET H H 21 7.880 7.880 7.458 0.422 18963 1128 1 11 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.444 -0.054 18963 1129 1 11 . 1 1 22 22 ILE H H 22 9.180 9.180 9.211 -0.031 18963 1130 1 11 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.139 0.251 18963 1131 1 11 . 1 1 23 23 CYS H H 23 8.000 8.000 8.050 -0.050 18963 1132 1 11 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.042 -0.492 18963 1133 1 11 . 1 1 24 24 CYS H H 24 8.750 8.750 8.966 -0.216 18963 1134 1 11 . 1 1 25 25 ASP H H 25 9.390 9.390 8.428 0.962 18963 1135 1 11 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.133 0.387 18963 1136 1 11 . 1 1 26 26 ARG H H 26 9.390 9.390 8.214 1.176 18963 1137 1 11 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.815 -0.045 18963 1138 1 11 . 1 1 27 27 CYS H H 27 8.550 8.550 7.825 0.725 18963 1139 1 11 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.974 0.206 18963 1140 1 11 . 1 1 28 28 GLU H H 28 7.660 7.660 8.228 -0.568 18963 1141 1 11 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.503 0.127 18963 1142 1 11 . 1 1 29 29 GLU H H 29 8.220 8.220 7.828 0.392 18963 1143 1 11 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.499 -0.659 18963 1144 1 11 . 1 1 30 30 TRP H H 30 8.250 8.250 7.998 0.252 18963 1145 1 11 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.841 -0.261 18963 1146 1 11 . 1 1 31 31 PHE H H 31 9.210 9.210 9.330 -0.120 18963 1147 1 11 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.787 0.383 18963 1148 1 11 . 1 1 32 32 HIS H H 32 9.740 9.740 8.567 1.173 18963 1149 1 11 . 1 1 33 33 GLY H H 33 9.090 9.090 8.797 0.293 18963 1150 1 11 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.550 -0.150 18963 1151 1 11 . 1 1 34 34 ASP H H 34 9.110 9.110 8.468 0.642 18963 1152 1 11 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.362 -0.132 18963 1153 1 11 . 1 1 35 35 CYS H H 35 7.660 7.660 8.292 -0.632 18963 1154 1 11 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.253 0.377 18963 1155 1 11 . 1 1 36 36 VAL H H 36 7.360 7.360 8.262 -0.902 18963 1156 1 11 . 1 1 37 37 GLY H H 37 7.670 7.670 7.885 -0.215 18963 1157 1 11 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.070 0.270 18963 1158 1 11 . 1 1 38 38 ILE H H 38 8.510 8.510 7.986 0.524 18963 1159 1 11 . 1 1 39 39 SER HA H 39 4.450 4.450 4.493 -0.043 18963 1160 1 11 . 1 1 39 39 SER H H 39 8.010 8.010 8.167 -0.157 18963 1161 1 11 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.933 -0.313 18963 1162 1 11 . 1 1 40 40 GLU H H 40 8.660 8.660 8.867 -0.207 18963 1163 1 11 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.155 -0.215 18963 1164 1 11 . 1 1 41 41 ALA H H 41 8.120 8.120 8.055 0.065 18963 1165 1 11 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.033 0.067 18963 1166 1 11 . 1 1 42 42 ARG H H 42 7.840 7.840 8.356 -0.516 18963 1167 1 11 . 1 1 43 43 GLY H H 43 8.840 8.840 8.470 0.370 18963 1168 1 11 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.182 0.058 18963 1169 1 11 . 1 1 44 44 ARG H H 44 8.240 8.240 7.587 0.653 18963 1170 1 11 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.091 0.049 18963 1171 1 11 . 1 1 45 45 LEU H H 45 7.610 7.610 8.097 -0.487 18963 1172 1 11 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.911 0.199 18963 1173 1 11 . 1 1 46 46 LEU H H 46 8.150 8.150 7.790 0.360 18963 1174 1 11 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.119 0.071 18963 1175 1 11 . 1 1 47 47 GLU H H 47 7.800 7.800 7.756 0.044 18963 1176 1 11 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.267 -0.107 18963 1177 1 11 . 1 1 48 48 ARG H H 48 8.250 8.250 7.584 0.666 18963 1178 1 11 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.737 0.003 18963 1179 1 11 . 1 1 49 49 ASN H H 49 8.280 8.280 8.257 0.023 18963 1180 1 11 . 1 1 50 50 GLY H H 50 8.060 8.060 7.962 0.098 18963 1181 1 11 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.354 0.006 18963 1182 1 11 . 1 1 51 51 GLU H H 51 8.180 8.180 8.137 0.043 18963 1183 1 11 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.449 0.201 18963 1184 1 11 . 1 1 52 52 ASP H H 52 8.350 8.350 8.572 -0.222 18963 1185 1 11 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.478 0.012 18963 1186 1 11 . 1 1 53 53 TYR H H 53 9.200 9.200 7.907 1.293 18963 1187 1 11 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.097 0.553 18963 1188 1 11 . 1 1 54 54 ILE H H 54 6.790 6.790 7.247 -0.457 18963 1189 1 11 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.256 0.064 18963 1190 1 11 . 1 1 55 55 CYS H H 55 9.070 9.070 8.110 0.960 18963 1191 1 11 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.137 0.063 18963 1192 1 11 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.628 -0.058 18963 1193 1 11 . 1 1 57 57 ASN H H 57 8.370 8.370 7.881 0.489 18963 1194 1 11 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.306 -0.276 18963 1195 1 11 . 1 1 58 58 CYS H H 58 8.300 8.300 7.572 0.728 18963 1196 1 11 . 1 1 59 59 THR HA H 59 3.860 3.860 3.930 -0.070 18963 1197 1 11 . 1 1 59 59 THR H H 59 7.600 7.600 7.610 -0.010 18963 1198 1 11 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.362 -0.152 18963 1199 1 11 . 1 1 60 60 ILE H H 60 7.480 7.480 7.564 -0.084 18963 1200 1 12 . 1 1 2 2 SER HA H 2 4.480 4.480 4.715 -0.235 18963 1201 1 12 . 1 1 3 3 MET HA H 3 4.100 4.100 4.564 -0.464 18963 1202 1 12 . 1 1 3 3 MET H H 3 8.340 8.340 8.483 -0.143 18963 1203 1 12 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.131 -0.171 18963 1204 1 12 . 1 1 4 4 ASP H H 4 8.430 8.430 8.916 -0.486 18963 1205 1 12 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.530 -0.120 18963 1206 1 12 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.671 0.189 18963 1207 1 12 . 1 1 6 6 ASN H H 6 8.660 8.660 8.622 0.038 18963 1208 1 12 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.512 -0.462 18963 1209 1 12 . 1 1 7 7 ALA H H 7 7.140 7.140 7.295 -0.155 18963 1210 1 12 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.345 -0.465 18963 1211 1 12 . 1 1 8 8 LEU H H 8 7.780 7.780 7.877 -0.097 18963 1212 1 12 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.488 0.342 18963 1213 1 12 . 1 1 9 9 TYR H H 9 7.800 7.800 8.346 -0.546 18963 1214 1 12 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.246 -0.316 18963 1215 1 12 . 1 1 10 10 CYS H H 10 7.760 7.760 8.287 -0.527 18963 1216 1 12 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.888 0.552 18963 1217 1 12 . 1 1 11 11 ILE H H 11 10.080 10.080 8.656 1.424 18963 1218 1 12 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.508 0.132 18963 1219 1 12 . 1 1 12 12 CYS H H 12 7.590 7.590 7.947 -0.357 18963 1220 1 12 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.959 -0.069 18963 1221 1 12 . 1 1 13 13 ARG H H 13 7.690 7.690 8.213 -0.523 18963 1222 1 12 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.791 0.269 18963 1223 1 12 . 1 1 14 14 GLN H H 14 8.110 8.110 8.251 -0.141 18963 1224 1 12 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.630 0.620 18963 1225 1 12 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.421 0.049 18963 1226 1 12 . 1 1 16 16 HIS H H 16 9.800 9.800 8.948 0.852 18963 1227 1 12 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.398 -0.228 18963 1228 1 12 . 1 1 17 17 ASN H H 17 8.450 8.450 8.192 0.258 18963 1229 1 12 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.899 -0.689 18963 1230 1 12 . 1 1 18 18 ASN H H 18 9.010 9.010 8.068 0.942 18963 1231 1 12 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.629 -0.199 18963 1232 1 12 . 1 1 19 19 ARG H H 19 7.710 7.710 8.164 -0.454 18963 1233 1 12 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.403 0.107 18963 1234 1 12 . 1 1 20 20 PHE H H 20 8.680 8.680 8.685 -0.005 18963 1235 1 12 . 1 1 21 21 MET HA H 21 5.310 5.310 4.786 0.524 18963 1236 1 12 . 1 1 21 21 MET H H 21 7.880 7.880 7.326 0.554 18963 1237 1 12 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.455 -0.065 18963 1238 1 12 . 1 1 22 22 ILE H H 22 9.180 9.180 9.211 -0.031 18963 1239 1 12 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.155 0.235 18963 1240 1 12 . 1 1 23 23 CYS H H 23 8.000 8.000 8.056 -0.056 18963 1241 1 12 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.062 -0.512 18963 1242 1 12 . 1 1 24 24 CYS H H 24 8.750 8.750 8.968 -0.218 18963 1243 1 12 . 1 1 25 25 ASP H H 25 9.390 9.390 8.387 1.003 18963 1244 1 12 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.138 0.382 18963 1245 1 12 . 1 1 26 26 ARG H H 26 9.390 9.390 8.242 1.148 18963 1246 1 12 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.827 -0.057 18963 1247 1 12 . 1 1 27 27 CYS H H 27 8.550 8.550 7.830 0.720 18963 1248 1 12 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.970 0.210 18963 1249 1 12 . 1 1 28 28 GLU H H 28 7.660 7.660 8.225 -0.565 18963 1250 1 12 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.605 0.025 18963 1251 1 12 . 1 1 29 29 GLU H H 29 8.220 8.220 7.787 0.433 18963 1252 1 12 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.494 -0.654 18963 1253 1 12 . 1 1 30 30 TRP H H 30 8.250 8.250 8.021 0.229 18963 1254 1 12 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.823 -0.243 18963 1255 1 12 . 1 1 31 31 PHE H H 31 9.210 9.210 9.330 -0.120 18963 1256 1 12 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.819 0.351 18963 1257 1 12 . 1 1 32 32 HIS H H 32 9.740 9.740 8.492 1.248 18963 1258 1 12 . 1 1 33 33 GLY H H 33 9.090 9.090 8.818 0.272 18963 1259 1 12 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.581 -0.181 18963 1260 1 12 . 1 1 34 34 ASP H H 34 9.110 9.110 8.476 0.634 18963 1261 1 12 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.374 -0.144 18963 1262 1 12 . 1 1 35 35 CYS H H 35 7.660 7.660 8.286 -0.626 18963 1263 1 12 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.267 0.363 18963 1264 1 12 . 1 1 36 36 VAL H H 36 7.360 7.360 8.335 -0.975 18963 1265 1 12 . 1 1 37 37 GLY H H 37 7.670 7.670 7.804 -0.134 18963 1266 1 12 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.022 0.318 18963 1267 1 12 . 1 1 38 38 ILE H H 38 8.510 8.510 8.006 0.504 18963 1268 1 12 . 1 1 39 39 SER HA H 39 4.450 4.450 4.411 0.039 18963 1269 1 12 . 1 1 39 39 SER H H 39 8.010 8.010 8.106 -0.096 18963 1270 1 12 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.863 -0.243 18963 1271 1 12 . 1 1 40 40 GLU H H 40 8.660 8.660 8.917 -0.257 18963 1272 1 12 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.236 -0.296 18963 1273 1 12 . 1 1 41 41 ALA H H 41 8.120 8.120 8.138 -0.018 18963 1274 1 12 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.118 -0.018 18963 1275 1 12 . 1 1 42 42 ARG H H 42 7.840 7.840 7.384 0.456 18963 1276 1 12 . 1 1 43 43 GLY H H 43 8.840 8.840 8.566 0.274 18963 1277 1 12 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.273 -0.033 18963 1278 1 12 . 1 1 44 44 ARG H H 44 8.240 8.240 7.539 0.701 18963 1279 1 12 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.112 0.028 18963 1280 1 12 . 1 1 45 45 LEU H H 45 7.610 7.610 7.639 -0.029 18963 1281 1 12 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.021 0.089 18963 1282 1 12 . 1 1 46 46 LEU H H 46 8.150 8.150 7.727 0.423 18963 1283 1 12 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.113 0.077 18963 1284 1 12 . 1 1 47 47 GLU H H 47 7.800 7.800 7.677 0.123 18963 1285 1 12 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.293 -0.133 18963 1286 1 12 . 1 1 48 48 ARG H H 48 8.250 8.250 7.586 0.664 18963 1287 1 12 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.789 -0.049 18963 1288 1 12 . 1 1 49 49 ASN H H 49 8.280 8.280 7.723 0.557 18963 1289 1 12 . 1 1 50 50 GLY H H 50 8.060 8.060 7.948 0.112 18963 1290 1 12 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.466 -0.106 18963 1291 1 12 . 1 1 51 51 GLU H H 51 8.180 8.180 7.891 0.289 18963 1292 1 12 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.425 0.225 18963 1293 1 12 . 1 1 52 52 ASP H H 52 8.350 8.350 8.561 -0.211 18963 1294 1 12 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.485 0.005 18963 1295 1 12 . 1 1 53 53 TYR H H 53 9.200 9.200 7.905 1.295 18963 1296 1 12 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.100 0.550 18963 1297 1 12 . 1 1 54 54 ILE H H 54 6.790 6.790 7.244 -0.454 18963 1298 1 12 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.251 0.069 18963 1299 1 12 . 1 1 55 55 CYS H H 55 9.070 9.070 8.111 0.959 18963 1300 1 12 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.136 0.064 18963 1301 1 12 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.600 -0.030 18963 1302 1 12 . 1 1 57 57 ASN H H 57 8.370 8.370 7.815 0.555 18963 1303 1 12 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.403 -0.373 18963 1304 1 12 . 1 1 58 58 CYS H H 58 8.300 8.300 7.748 0.552 18963 1305 1 12 . 1 1 59 59 THR HA H 59 3.860 3.860 3.999 -0.139 18963 1306 1 12 . 1 1 59 59 THR H H 59 7.600 7.600 7.721 -0.121 18963 1307 1 12 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.508 -0.298 18963 1308 1 12 . 1 1 60 60 ILE H H 60 7.480 7.480 7.575 -0.095 18963 1309 1 13 . 1 1 2 2 SER HA H 2 4.480 4.480 4.743 -0.263 18963 1310 1 13 . 1 1 3 3 MET HA H 3 4.100 4.100 4.499 -0.399 18963 1311 1 13 . 1 1 3 3 MET H H 3 8.340 8.340 8.512 -0.172 18963 1312 1 13 . 1 1 4 4 ASP HA H 4 4.960 4.960 4.980 -0.020 18963 1313 1 13 . 1 1 4 4 ASP H H 4 8.430 8.430 8.482 -0.052 18963 1314 1 13 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.365 0.045 18963 1315 1 13 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.660 0.200 18963 1316 1 13 . 1 1 6 6 ASN H H 6 8.660 8.660 8.588 0.072 18963 1317 1 13 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.527 -0.477 18963 1318 1 13 . 1 1 7 7 ALA H H 7 7.140 7.140 7.263 -0.123 18963 1319 1 13 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.370 -0.490 18963 1320 1 13 . 1 1 8 8 LEU H H 8 7.780 7.780 7.802 -0.022 18963 1321 1 13 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.444 0.386 18963 1322 1 13 . 1 1 9 9 TYR H H 9 7.800 7.800 8.296 -0.496 18963 1323 1 13 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.185 -0.255 18963 1324 1 13 . 1 1 10 10 CYS H H 10 7.760 7.760 8.283 -0.523 18963 1325 1 13 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.907 0.533 18963 1326 1 13 . 1 1 11 11 ILE H H 11 10.080 10.080 8.784 1.296 18963 1327 1 13 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.603 0.037 18963 1328 1 13 . 1 1 12 12 CYS H H 12 7.590 7.590 8.364 -0.774 18963 1329 1 13 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.958 -0.068 18963 1330 1 13 . 1 1 13 13 ARG H H 13 7.690 7.690 8.212 -0.522 18963 1331 1 13 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.888 0.172 18963 1332 1 13 . 1 1 14 14 GLN H H 14 8.110 8.110 8.293 -0.183 18963 1333 1 13 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.806 0.444 18963 1334 1 13 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.467 0.003 18963 1335 1 13 . 1 1 16 16 HIS H H 16 9.800 9.800 9.039 0.761 18963 1336 1 13 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.371 -0.201 18963 1337 1 13 . 1 1 17 17 ASN H H 17 8.450 8.450 8.682 -0.232 18963 1338 1 13 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.871 -0.661 18963 1339 1 13 . 1 1 18 18 ASN H H 18 9.010 9.010 8.091 0.919 18963 1340 1 13 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.611 -0.181 18963 1341 1 13 . 1 1 19 19 ARG H H 19 7.710 7.710 8.167 -0.457 18963 1342 1 13 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.388 0.122 18963 1343 1 13 . 1 1 20 20 PHE H H 20 8.680 8.680 8.673 0.007 18963 1344 1 13 . 1 1 21 21 MET HA H 21 5.310 5.310 5.035 0.275 18963 1345 1 13 . 1 1 21 21 MET H H 21 7.880 7.880 7.310 0.570 18963 1346 1 13 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.443 -0.053 18963 1347 1 13 . 1 1 22 22 ILE H H 22 9.180 9.180 9.164 0.016 18963 1348 1 13 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.221 0.169 18963 1349 1 13 . 1 1 23 23 CYS H H 23 8.000 8.000 8.027 -0.026 18963 1350 1 13 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.017 -0.467 18963 1351 1 13 . 1 1 24 24 CYS H H 24 8.750 8.750 8.974 -0.224 18963 1352 1 13 . 1 1 25 25 ASP H H 25 9.390 9.390 8.471 0.919 18963 1353 1 13 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.135 0.385 18963 1354 1 13 . 1 1 26 26 ARG H H 26 9.390 9.390 8.238 1.152 18963 1355 1 13 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.762 0.008 18963 1356 1 13 . 1 1 27 27 CYS H H 27 8.550 8.550 7.787 0.763 18963 1357 1 13 . 1 1 28 28 GLU HA H 28 4.180 4.180 4.007 0.173 18963 1358 1 13 . 1 1 28 28 GLU H H 28 7.660 7.660 8.175 -0.515 18963 1359 1 13 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.650 -0.020 18963 1360 1 13 . 1 1 29 29 GLU H H 29 8.220 8.220 7.804 0.416 18963 1361 1 13 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.482 -0.642 18963 1362 1 13 . 1 1 30 30 TRP H H 30 8.250 8.250 8.076 0.174 18963 1363 1 13 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.755 -0.175 18963 1364 1 13 . 1 1 31 31 PHE H H 31 9.210 9.210 9.373 -0.163 18963 1365 1 13 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.170 0.000 18963 1366 1 13 . 1 1 32 32 HIS H H 32 9.740 9.740 8.687 1.053 18963 1367 1 13 . 1 1 33 33 GLY H H 33 9.090 9.090 8.759 0.331 18963 1368 1 13 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.557 -0.157 18963 1369 1 13 . 1 1 34 34 ASP H H 34 9.110 9.110 8.553 0.557 18963 1370 1 13 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.383 -0.153 18963 1371 1 13 . 1 1 35 35 CYS H H 35 7.660 7.660 8.207 -0.547 18963 1372 1 13 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.329 0.301 18963 1373 1 13 . 1 1 36 36 VAL H H 36 7.360 7.360 8.448 -1.088 18963 1374 1 13 . 1 1 37 37 GLY H H 37 7.670 7.670 7.937 -0.267 18963 1375 1 13 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.107 0.233 18963 1376 1 13 . 1 1 38 38 ILE H H 38 8.510 8.510 8.098 0.412 18963 1377 1 13 . 1 1 39 39 SER HA H 39 4.450 4.450 4.494 -0.044 18963 1378 1 13 . 1 1 39 39 SER H H 39 8.010 8.010 8.224 -0.214 18963 1379 1 13 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.883 -0.263 18963 1380 1 13 . 1 1 40 40 GLU H H 40 8.660 8.660 8.963 -0.303 18963 1381 1 13 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.237 -0.297 18963 1382 1 13 . 1 1 41 41 ALA H H 41 8.120 8.120 8.156 -0.036 18963 1383 1 13 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.144 -0.044 18963 1384 1 13 . 1 1 42 42 ARG H H 42 7.840 7.840 7.481 0.359 18963 1385 1 13 . 1 1 43 43 GLY H H 43 8.840 8.840 8.563 0.277 18963 1386 1 13 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.148 0.092 18963 1387 1 13 . 1 1 44 44 ARG H H 44 8.240 8.240 7.538 0.702 18963 1388 1 13 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.259 -0.119 18963 1389 1 13 . 1 1 45 45 LEU H H 45 7.610 7.610 7.699 -0.089 18963 1390 1 13 . 1 1 46 46 LEU HA H 46 4.110 4.110 4.061 0.049 18963 1391 1 13 . 1 1 46 46 LEU H H 46 8.150 8.150 7.623 0.527 18963 1392 1 13 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.161 0.029 18963 1393 1 13 . 1 1 47 47 GLU H H 47 7.800 7.800 7.781 0.019 18963 1394 1 13 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.259 -0.099 18963 1395 1 13 . 1 1 48 48 ARG H H 48 8.250 8.250 7.492 0.758 18963 1396 1 13 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.761 -0.021 18963 1397 1 13 . 1 1 49 49 ASN H H 49 8.280 8.280 8.268 0.012 18963 1398 1 13 . 1 1 50 50 GLY H H 50 8.060 8.060 7.823 0.237 18963 1399 1 13 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.061 0.299 18963 1400 1 13 . 1 1 51 51 GLU H H 51 8.180 8.180 7.913 0.267 18963 1401 1 13 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.359 0.291 18963 1402 1 13 . 1 1 52 52 ASP H H 52 8.350 8.350 8.438 -0.088 18963 1403 1 13 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.562 -0.072 18963 1404 1 13 . 1 1 53 53 TYR H H 53 9.200 9.200 7.992 1.208 18963 1405 1 13 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.112 0.538 18963 1406 1 13 . 1 1 54 54 ILE H H 54 6.790 6.790 7.292 -0.502 18963 1407 1 13 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.251 0.069 18963 1408 1 13 . 1 1 55 55 CYS H H 55 9.070 9.070 8.115 0.955 18963 1409 1 13 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.138 0.062 18963 1410 1 13 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.606 -0.036 18963 1411 1 13 . 1 1 57 57 ASN H H 57 8.370 8.370 7.834 0.536 18963 1412 1 13 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.408 -0.378 18963 1413 1 13 . 1 1 58 58 CYS H H 58 8.300 8.300 7.785 0.514 18963 1414 1 13 . 1 1 59 59 THR HA H 59 3.860 3.860 4.005 -0.145 18963 1415 1 13 . 1 1 59 59 THR H H 59 7.600 7.600 7.732 -0.132 18963 1416 1 13 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.527 -0.317 18963 1417 1 13 . 1 1 60 60 ILE H H 60 7.480 7.480 7.586 -0.106 18963 1418 1 14 . 1 1 2 2 SER HA H 2 4.480 4.480 4.597 -0.117 18963 1419 1 14 . 1 1 3 3 MET HA H 3 4.100 4.100 4.118 -0.018 18963 1420 1 14 . 1 1 3 3 MET H H 3 8.340 8.340 8.321 0.019 18963 1421 1 14 . 1 1 4 4 ASP HA H 4 4.960 4.960 4.966 -0.006 18963 1422 1 14 . 1 1 4 4 ASP H H 4 8.430 8.430 8.093 0.337 18963 1423 1 14 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.666 -0.256 18963 1424 1 14 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.709 0.151 18963 1425 1 14 . 1 1 6 6 ASN H H 6 8.660 8.660 8.520 0.140 18963 1426 1 14 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.574 -0.524 18963 1427 1 14 . 1 1 7 7 ALA H H 7 7.140 7.140 7.439 -0.299 18963 1428 1 14 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.377 -0.497 18963 1429 1 14 . 1 1 8 8 LEU H H 8 7.780 7.780 7.863 -0.083 18963 1430 1 14 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.527 0.303 18963 1431 1 14 . 1 1 9 9 TYR H H 9 7.800 7.800 8.521 -0.721 18963 1432 1 14 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.163 -0.233 18963 1433 1 14 . 1 1 10 10 CYS H H 10 7.760 7.760 8.248 -0.488 18963 1434 1 14 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.914 0.526 18963 1435 1 14 . 1 1 11 11 ILE H H 11 10.080 10.080 8.787 1.293 18963 1436 1 14 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.594 0.046 18963 1437 1 14 . 1 1 12 12 CYS H H 12 7.590 7.590 8.112 -0.522 18963 1438 1 14 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.981 -0.091 18963 1439 1 14 . 1 1 13 13 ARG H H 13 7.690 7.690 8.225 -0.535 18963 1440 1 14 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.830 0.230 18963 1441 1 14 . 1 1 14 14 GLN H H 14 8.110 8.110 8.265 -0.155 18963 1442 1 14 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.864 0.386 18963 1443 1 14 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.534 -0.064 18963 1444 1 14 . 1 1 16 16 HIS H H 16 9.800 9.800 8.983 0.817 18963 1445 1 14 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.306 -0.136 18963 1446 1 14 . 1 1 17 17 ASN H H 17 8.450 8.450 8.516 -0.066 18963 1447 1 14 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.869 -0.659 18963 1448 1 14 . 1 1 18 18 ASN H H 18 9.010 9.010 8.117 0.893 18963 1449 1 14 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.591 -0.161 18963 1450 1 14 . 1 1 19 19 ARG H H 19 7.710 7.710 8.124 -0.414 18963 1451 1 14 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.421 0.089 18963 1452 1 14 . 1 1 20 20 PHE H H 20 8.680 8.680 8.673 0.007 18963 1453 1 14 . 1 1 21 21 MET HA H 21 5.310 5.310 5.077 0.233 18963 1454 1 14 . 1 1 21 21 MET H H 21 7.880 7.880 7.330 0.550 18963 1455 1 14 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.423 -0.033 18963 1456 1 14 . 1 1 22 22 ILE H H 22 9.180 9.180 9.160 0.020 18963 1457 1 14 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.217 0.173 18963 1458 1 14 . 1 1 23 23 CYS H H 23 8.000 8.000 8.016 -0.016 18963 1459 1 14 . 1 1 24 24 CYS HA H 24 4.550 4.550 4.975 -0.425 18963 1460 1 14 . 1 1 24 24 CYS H H 24 8.750 8.750 8.986 -0.236 18963 1461 1 14 . 1 1 25 25 ASP H H 25 9.390 9.390 8.377 1.013 18963 1462 1 14 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.136 0.384 18963 1463 1 14 . 1 1 26 26 ARG H H 26 9.390 9.390 8.276 1.114 18963 1464 1 14 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.804 -0.034 18963 1465 1 14 . 1 1 27 27 CYS H H 27 8.550 8.550 7.830 0.720 18963 1466 1 14 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.949 0.231 18963 1467 1 14 . 1 1 28 28 GLU H H 28 7.660 7.660 8.193 -0.533 18963 1468 1 14 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.696 -0.066 18963 1469 1 14 . 1 1 29 29 GLU H H 29 8.220 8.220 7.784 0.436 18963 1470 1 14 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.483 -0.643 18963 1471 1 14 . 1 1 30 30 TRP H H 30 8.250 8.250 8.105 0.145 18963 1472 1 14 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.752 -0.172 18963 1473 1 14 . 1 1 31 31 PHE H H 31 9.210 9.210 9.360 -0.150 18963 1474 1 14 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.179 -0.009 18963 1475 1 14 . 1 1 32 32 HIS H H 32 9.740 9.740 8.676 1.064 18963 1476 1 14 . 1 1 33 33 GLY H H 33 9.090 9.090 8.697 0.393 18963 1477 1 14 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.560 -0.160 18963 1478 1 14 . 1 1 34 34 ASP H H 34 9.110 9.110 8.462 0.648 18963 1479 1 14 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.378 -0.148 18963 1480 1 14 . 1 1 35 35 CYS H H 35 7.660 7.660 8.266 -0.606 18963 1481 1 14 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.259 0.371 18963 1482 1 14 . 1 1 36 36 VAL H H 36 7.360 7.360 8.452 -1.092 18963 1483 1 14 . 1 1 37 37 GLY H H 37 7.670 7.670 7.853 -0.183 18963 1484 1 14 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.073 0.267 18963 1485 1 14 . 1 1 38 38 ILE H H 38 8.510 8.510 7.990 0.520 18963 1486 1 14 . 1 1 39 39 SER HA H 39 4.450 4.450 4.574 -0.124 18963 1487 1 14 . 1 1 39 39 SER H H 39 8.010 8.010 8.252 -0.242 18963 1488 1 14 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.958 -0.338 18963 1489 1 14 . 1 1 40 40 GLU H H 40 8.660 8.660 8.949 -0.289 18963 1490 1 14 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.149 -0.209 18963 1491 1 14 . 1 1 41 41 ALA H H 41 8.120 8.120 8.138 -0.018 18963 1492 1 14 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.117 -0.017 18963 1493 1 14 . 1 1 42 42 ARG H H 42 7.840 7.840 7.333 0.507 18963 1494 1 14 . 1 1 43 43 GLY H H 43 8.840 8.840 8.576 0.264 18963 1495 1 14 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.279 -0.039 18963 1496 1 14 . 1 1 44 44 ARG H H 44 8.240 8.240 7.529 0.711 18963 1497 1 14 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.170 -0.030 18963 1498 1 14 . 1 1 45 45 LEU H H 45 7.610 7.610 7.550 0.060 18963 1499 1 14 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.907 0.203 18963 1500 1 14 . 1 1 46 46 LEU H H 46 8.150 8.150 7.750 0.400 18963 1501 1 14 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.068 0.122 18963 1502 1 14 . 1 1 47 47 GLU H H 47 7.800 7.800 7.769 0.031 18963 1503 1 14 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.211 -0.051 18963 1504 1 14 . 1 1 48 48 ARG H H 48 8.250 8.250 7.532 0.718 18963 1505 1 14 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.733 0.007 18963 1506 1 14 . 1 1 49 49 ASN H H 49 8.280 8.280 8.178 0.102 18963 1507 1 14 . 1 1 50 50 GLY H H 50 8.060 8.060 7.957 0.103 18963 1508 1 14 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.280 0.080 18963 1509 1 14 . 1 1 51 51 GLU H H 51 8.180 8.180 7.803 0.377 18963 1510 1 14 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.448 0.202 18963 1511 1 14 . 1 1 52 52 ASP H H 52 8.350 8.350 8.560 -0.210 18963 1512 1 14 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.411 0.079 18963 1513 1 14 . 1 1 53 53 TYR H H 53 9.200 9.200 8.199 1.001 18963 1514 1 14 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.120 0.530 18963 1515 1 14 . 1 1 54 54 ILE H H 54 6.790 6.790 7.516 -0.726 18963 1516 1 14 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.245 0.075 18963 1517 1 14 . 1 1 55 55 CYS H H 55 9.070 9.070 8.102 0.968 18963 1518 1 14 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.138 0.062 18963 1519 1 14 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.630 -0.060 18963 1520 1 14 . 1 1 57 57 ASN H H 57 8.370 8.370 7.901 0.469 18963 1521 1 14 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.365 -0.335 18963 1522 1 14 . 1 1 58 58 CYS H H 58 8.300 8.300 7.614 0.686 18963 1523 1 14 . 1 1 59 59 THR HA H 59 3.860 3.860 4.050 -0.190 18963 1524 1 14 . 1 1 59 59 THR H H 59 7.600 7.600 7.811 -0.211 18963 1525 1 14 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.324 -0.114 18963 1526 1 14 . 1 1 60 60 ILE H H 60 7.480 7.480 7.462 0.018 18963 1527 1 15 . 1 1 2 2 SER HA H 2 4.480 4.480 4.693 -0.213 18963 1528 1 15 . 1 1 3 3 MET HA H 3 4.100 4.100 4.725 -0.625 18963 1529 1 15 . 1 1 3 3 MET H H 3 8.340 8.340 8.402 -0.062 18963 1530 1 15 . 1 1 4 4 ASP HA H 4 4.960 4.960 4.992 -0.032 18963 1531 1 15 . 1 1 4 4 ASP H H 4 8.430 8.430 8.595 -0.165 18963 1532 1 15 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.446 -0.036 18963 1533 1 15 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.648 0.212 18963 1534 1 15 . 1 1 6 6 ASN H H 6 8.660 8.660 8.343 0.317 18963 1535 1 15 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.466 -0.416 18963 1536 1 15 . 1 1 7 7 ALA H H 7 7.140 7.140 7.289 -0.149 18963 1537 1 15 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.410 -0.530 18963 1538 1 15 . 1 1 8 8 LEU H H 8 7.780 7.780 8.033 -0.253 18963 1539 1 15 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.531 0.299 18963 1540 1 15 . 1 1 9 9 TYR H H 9 7.800 7.800 8.483 -0.683 18963 1541 1 15 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.177 -0.247 18963 1542 1 15 . 1 1 10 10 CYS H H 10 7.760 7.760 8.261 -0.501 18963 1543 1 15 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.918 0.522 18963 1544 1 15 . 1 1 11 11 ILE H H 11 10.080 10.080 8.694 1.386 18963 1545 1 15 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.581 0.059 18963 1546 1 15 . 1 1 12 12 CYS H H 12 7.590 7.590 8.035 -0.445 18963 1547 1 15 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.955 -0.065 18963 1548 1 15 . 1 1 13 13 ARG H H 13 7.690 7.690 8.109 -0.419 18963 1549 1 15 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.825 0.235 18963 1550 1 15 . 1 1 14 14 GLN H H 14 8.110 8.110 8.246 -0.136 18963 1551 1 15 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.738 0.512 18963 1552 1 15 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.502 -0.032 18963 1553 1 15 . 1 1 16 16 HIS H H 16 9.800 9.800 9.003 0.797 18963 1554 1 15 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.382 -0.212 18963 1555 1 15 . 1 1 17 17 ASN H H 17 8.450 8.450 8.646 -0.196 18963 1556 1 15 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.891 -0.681 18963 1557 1 15 . 1 1 18 18 ASN H H 18 9.010 9.010 8.092 0.918 18963 1558 1 15 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.680 -0.250 18963 1559 1 15 . 1 1 19 19 ARG H H 19 7.710 7.710 8.119 -0.409 18963 1560 1 15 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.407 0.103 18963 1561 1 15 . 1 1 20 20 PHE H H 20 8.680 8.680 8.512 0.168 18963 1562 1 15 . 1 1 21 21 MET HA H 21 5.310 5.310 5.095 0.215 18963 1563 1 15 . 1 1 21 21 MET H H 21 7.880 7.880 7.288 0.592 18963 1564 1 15 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.460 -0.070 18963 1565 1 15 . 1 1 22 22 ILE H H 22 9.180 9.180 9.104 0.076 18963 1566 1 15 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.227 0.163 18963 1567 1 15 . 1 1 23 23 CYS H H 23 8.000 8.000 8.041 -0.041 18963 1568 1 15 . 1 1 24 24 CYS HA H 24 4.550 4.550 4.994 -0.444 18963 1569 1 15 . 1 1 24 24 CYS H H 24 8.750 8.750 8.992 -0.242 18963 1570 1 15 . 1 1 25 25 ASP H H 25 9.390 9.390 8.389 1.001 18963 1571 1 15 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.135 0.385 18963 1572 1 15 . 1 1 26 26 ARG H H 26 9.390 9.390 8.268 1.122 18963 1573 1 15 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.820 -0.050 18963 1574 1 15 . 1 1 27 27 CYS H H 27 8.550 8.550 7.846 0.704 18963 1575 1 15 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.989 0.191 18963 1576 1 15 . 1 1 28 28 GLU H H 28 7.660 7.660 8.350 -0.690 18963 1577 1 15 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.719 -0.089 18963 1578 1 15 . 1 1 29 29 GLU H H 29 8.220 8.220 7.757 0.463 18963 1579 1 15 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.498 -0.658 18963 1580 1 15 . 1 1 30 30 TRP H H 30 8.250 8.250 8.121 0.129 18963 1581 1 15 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.766 -0.186 18963 1582 1 15 . 1 1 31 31 PHE H H 31 9.210 9.210 9.370 -0.160 18963 1583 1 15 . 1 1 32 32 HIS HA H 32 5.170 5.170 5.190 -0.020 18963 1584 1 15 . 1 1 32 32 HIS H H 32 9.740 9.740 8.683 1.057 18963 1585 1 15 . 1 1 33 33 GLY H H 33 9.090 9.090 8.799 0.291 18963 1586 1 15 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.523 -0.123 18963 1587 1 15 . 1 1 34 34 ASP H H 34 9.110 9.110 8.526 0.584 18963 1588 1 15 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.370 -0.140 18963 1589 1 15 . 1 1 35 35 CYS H H 35 7.660 7.660 8.193 -0.533 18963 1590 1 15 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.208 0.422 18963 1591 1 15 . 1 1 36 36 VAL H H 36 7.360 7.360 8.434 -1.074 18963 1592 1 15 . 1 1 37 37 GLY H H 37 7.670 7.670 7.880 -0.210 18963 1593 1 15 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.089 0.251 18963 1594 1 15 . 1 1 38 38 ILE H H 38 8.510 8.510 7.956 0.554 18963 1595 1 15 . 1 1 39 39 SER HA H 39 4.450 4.450 4.448 0.002 18963 1596 1 15 . 1 1 39 39 SER H H 39 8.010 8.010 8.073 -0.063 18963 1597 1 15 . 1 1 40 40 GLU HA H 40 2.620 2.620 3.346 -0.726 18963 1598 1 15 . 1 1 40 40 GLU H H 40 8.660 8.660 8.774 -0.114 18963 1599 1 15 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.118 -0.178 18963 1600 1 15 . 1 1 41 41 ALA H H 41 8.120 8.120 8.344 -0.224 18963 1601 1 15 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.041 0.059 18963 1602 1 15 . 1 1 42 42 ARG H H 42 7.840 7.840 7.574 0.266 18963 1603 1 15 . 1 1 43 43 GLY H H 43 8.840 8.840 8.320 0.520 18963 1604 1 15 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.328 -0.088 18963 1605 1 15 . 1 1 44 44 ARG H H 44 8.240 8.240 7.358 0.882 18963 1606 1 15 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.012 0.128 18963 1607 1 15 . 1 1 45 45 LEU H H 45 7.610 7.610 7.710 -0.100 18963 1608 1 15 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.984 0.126 18963 1609 1 15 . 1 1 46 46 LEU H H 46 8.150 8.150 8.151 -0.001 18963 1610 1 15 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.125 0.065 18963 1611 1 15 . 1 1 47 47 GLU H H 47 7.800 7.800 7.675 0.125 18963 1612 1 15 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.307 -0.147 18963 1613 1 15 . 1 1 48 48 ARG H H 48 8.250 8.250 8.189 0.061 18963 1614 1 15 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.770 -0.030 18963 1615 1 15 . 1 1 49 49 ASN H H 49 8.280 8.280 8.341 -0.061 18963 1616 1 15 . 1 1 50 50 GLY H H 50 8.060 8.060 7.878 0.182 18963 1617 1 15 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.416 -0.056 18963 1618 1 15 . 1 1 51 51 GLU H H 51 8.180 8.180 8.074 0.106 18963 1619 1 15 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.294 0.356 18963 1620 1 15 . 1 1 52 52 ASP H H 52 8.350 8.350 8.439 -0.089 18963 1621 1 15 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.640 -0.150 18963 1622 1 15 . 1 1 53 53 TYR H H 53 9.200 9.200 7.818 1.382 18963 1623 1 15 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.117 0.533 18963 1624 1 15 . 1 1 54 54 ILE H H 54 6.790 6.790 7.334 -0.544 18963 1625 1 15 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.249 0.071 18963 1626 1 15 . 1 1 55 55 CYS H H 55 9.070 9.070 8.105 0.965 18963 1627 1 15 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.140 0.060 18963 1628 1 15 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.636 -0.066 18963 1629 1 15 . 1 1 57 57 ASN H H 57 8.370 8.370 7.906 0.464 18963 1630 1 15 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.362 -0.332 18963 1631 1 15 . 1 1 58 58 CYS H H 58 8.300 8.300 7.617 0.683 18963 1632 1 15 . 1 1 59 59 THR HA H 59 3.860 3.860 3.955 -0.095 18963 1633 1 15 . 1 1 59 59 THR H H 59 7.600 7.600 7.709 -0.109 18963 1634 1 15 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.364 -0.154 18963 1635 1 15 . 1 1 60 60 ILE H H 60 7.480 7.480 7.581 -0.101 18963 1636 1 16 . 1 1 2 2 SER HA H 2 4.480 4.480 4.743 -0.263 18963 1637 1 16 . 1 1 3 3 MET HA H 3 4.100 4.100 4.576 -0.476 18963 1638 1 16 . 1 1 3 3 MET H H 3 8.340 8.340 8.320 0.020 18963 1639 1 16 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.056 -0.096 18963 1640 1 16 . 1 1 4 4 ASP H H 4 8.430 8.430 8.429 0.001 18963 1641 1 16 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.638 -0.228 18963 1642 1 16 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.755 0.105 18963 1643 1 16 . 1 1 6 6 ASN H H 6 8.660 8.660 8.571 0.089 18963 1644 1 16 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.551 -0.501 18963 1645 1 16 . 1 1 7 7 ALA H H 7 7.140 7.140 7.529 -0.389 18963 1646 1 16 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.261 -0.381 18963 1647 1 16 . 1 1 8 8 LEU H H 8 7.780 7.780 7.909 -0.129 18963 1648 1 16 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.508 0.322 18963 1649 1 16 . 1 1 9 9 TYR H H 9 7.800 7.800 8.456 -0.656 18963 1650 1 16 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.232 -0.302 18963 1651 1 16 . 1 1 10 10 CYS H H 10 7.760 7.760 8.259 -0.499 18963 1652 1 16 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.908 0.532 18963 1653 1 16 . 1 1 11 11 ILE H H 11 10.080 10.080 8.766 1.314 18963 1654 1 16 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.577 0.063 18963 1655 1 16 . 1 1 12 12 CYS H H 12 7.590 7.590 8.178 -0.588 18963 1656 1 16 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.939 -0.049 18963 1657 1 16 . 1 1 13 13 ARG H H 13 7.690 7.690 8.206 -0.516 18963 1658 1 16 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.785 0.275 18963 1659 1 16 . 1 1 14 14 GLN H H 14 8.110 8.110 8.275 -0.165 18963 1660 1 16 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.638 0.612 18963 1661 1 16 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.339 0.131 18963 1662 1 16 . 1 1 16 16 HIS H H 16 9.800 9.800 9.019 0.781 18963 1663 1 16 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.173 -0.003 18963 1664 1 16 . 1 1 17 17 ASN H H 17 8.450 8.450 8.164 0.286 18963 1665 1 16 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.631 -0.421 18963 1666 1 16 . 1 1 18 18 ASN H H 18 9.010 9.010 7.760 1.250 18963 1667 1 16 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.612 -0.182 18963 1668 1 16 . 1 1 19 19 ARG H H 19 7.710 7.710 8.008 -0.298 18963 1669 1 16 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.471 0.039 18963 1670 1 16 . 1 1 20 20 PHE H H 20 8.680 8.680 8.493 0.187 18963 1671 1 16 . 1 1 21 21 MET HA H 21 5.310 5.310 4.705 0.605 18963 1672 1 16 . 1 1 21 21 MET H H 21 7.880 7.880 7.357 0.523 18963 1673 1 16 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.421 -0.031 18963 1674 1 16 . 1 1 22 22 ILE H H 22 9.180 9.180 9.030 0.150 18963 1675 1 16 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.187 0.203 18963 1676 1 16 . 1 1 23 23 CYS H H 23 8.000 8.000 8.045 -0.045 18963 1677 1 16 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.045 -0.495 18963 1678 1 16 . 1 1 24 24 CYS H H 24 8.750 8.750 8.961 -0.211 18963 1679 1 16 . 1 1 25 25 ASP H H 25 9.390 9.390 8.412 0.978 18963 1680 1 16 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.131 0.389 18963 1681 1 16 . 1 1 26 26 ARG H H 26 9.390 9.390 8.192 1.198 18963 1682 1 16 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.824 -0.054 18963 1683 1 16 . 1 1 27 27 CYS H H 27 8.550 8.550 7.827 0.723 18963 1684 1 16 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.973 0.207 18963 1685 1 16 . 1 1 28 28 GLU H H 28 7.660 7.660 8.333 -0.673 18963 1686 1 16 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.635 -0.005 18963 1687 1 16 . 1 1 29 29 GLU H H 29 8.220 8.220 7.747 0.473 18963 1688 1 16 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.460 -0.620 18963 1689 1 16 . 1 1 30 30 TRP H H 30 8.250 8.250 8.022 0.228 18963 1690 1 16 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.846 -0.266 18963 1691 1 16 . 1 1 31 31 PHE H H 31 9.210 9.210 9.361 -0.151 18963 1692 1 16 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.689 0.481 18963 1693 1 16 . 1 1 32 32 HIS H H 32 9.740 9.740 8.565 1.175 18963 1694 1 16 . 1 1 33 33 GLY H H 33 9.090 9.090 8.629 0.461 18963 1695 1 16 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.538 -0.138 18963 1696 1 16 . 1 1 34 34 ASP H H 34 9.110 9.110 8.430 0.680 18963 1697 1 16 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.332 -0.102 18963 1698 1 16 . 1 1 35 35 CYS H H 35 7.660 7.660 8.386 -0.726 18963 1699 1 16 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.271 0.359 18963 1700 1 16 . 1 1 36 36 VAL H H 36 7.360 7.360 8.169 -0.809 18963 1701 1 16 . 1 1 37 37 GLY H H 37 7.670 7.670 7.849 -0.179 18963 1702 1 16 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.055 0.285 18963 1703 1 16 . 1 1 38 38 ILE H H 38 8.510 8.510 7.988 0.522 18963 1704 1 16 . 1 1 39 39 SER HA H 39 4.450 4.450 4.531 -0.081 18963 1705 1 16 . 1 1 39 39 SER H H 39 8.010 8.010 8.330 -0.320 18963 1706 1 16 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.980 -0.360 18963 1707 1 16 . 1 1 40 40 GLU H H 40 8.660 8.660 8.988 -0.328 18963 1708 1 16 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.143 -0.203 18963 1709 1 16 . 1 1 41 41 ALA H H 41 8.120 8.120 8.209 -0.089 18963 1710 1 16 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.133 -0.033 18963 1711 1 16 . 1 1 42 42 ARG H H 42 7.840 7.840 7.638 0.202 18963 1712 1 16 . 1 1 43 43 GLY H H 43 8.840 8.840 8.577 0.263 18963 1713 1 16 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.268 -0.028 18963 1714 1 16 . 1 1 44 44 ARG H H 44 8.240 8.240 7.529 0.711 18963 1715 1 16 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.098 0.042 18963 1716 1 16 . 1 1 45 45 LEU H H 45 7.610 7.610 7.757 -0.147 18963 1717 1 16 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.970 0.140 18963 1718 1 16 . 1 1 46 46 LEU H H 46 8.150 8.150 7.909 0.241 18963 1719 1 16 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.124 0.066 18963 1720 1 16 . 1 1 47 47 GLU H H 47 7.800 7.800 7.851 -0.051 18963 1721 1 16 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.313 -0.153 18963 1722 1 16 . 1 1 48 48 ARG H H 48 8.250 8.250 7.660 0.590 18963 1723 1 16 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.793 -0.053 18963 1724 1 16 . 1 1 49 49 ASN H H 49 8.280 8.280 8.415 -0.135 18963 1725 1 16 . 1 1 50 50 GLY H H 50 8.060 8.060 7.992 0.068 18963 1726 1 16 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.296 0.064 18963 1727 1 16 . 1 1 51 51 GLU H H 51 8.180 8.180 7.916 0.264 18963 1728 1 16 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.437 0.213 18963 1729 1 16 . 1 1 52 52 ASP H H 52 8.350 8.350 8.461 -0.111 18963 1730 1 16 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.619 -0.129 18963 1731 1 16 . 1 1 53 53 TYR H H 53 9.200 9.200 8.129 1.071 18963 1732 1 16 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.113 0.537 18963 1733 1 16 . 1 1 54 54 ILE H H 54 6.790 6.790 7.330 -0.540 18963 1734 1 16 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.250 0.070 18963 1735 1 16 . 1 1 55 55 CYS H H 55 9.070 9.070 8.109 0.961 18963 1736 1 16 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.136 0.064 18963 1737 1 16 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.611 -0.041 18963 1738 1 16 . 1 1 57 57 ASN H H 57 8.370 8.370 7.822 0.548 18963 1739 1 16 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.337 -0.307 18963 1740 1 16 . 1 1 58 58 CYS H H 58 8.300 8.300 7.539 0.761 18963 1741 1 16 . 1 1 59 59 THR HA H 59 3.860 3.860 3.973 -0.113 18963 1742 1 16 . 1 1 59 59 THR H H 59 7.600 7.600 7.796 -0.196 18963 1743 1 16 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.457 -0.247 18963 1744 1 16 . 1 1 60 60 ILE H H 60 7.480 7.480 7.531 -0.051 18963 1745 1 17 . 1 1 2 2 SER HA H 2 4.480 4.480 4.714 -0.234 18963 1746 1 17 . 1 1 3 3 MET HA H 3 4.100 4.100 4.461 -0.361 18963 1747 1 17 . 1 1 3 3 MET H H 3 8.340 8.340 8.825 -0.485 18963 1748 1 17 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.113 -0.153 18963 1749 1 17 . 1 1 4 4 ASP H H 4 8.430 8.430 8.779 -0.349 18963 1750 1 17 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.547 -0.137 18963 1751 1 17 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.813 0.047 18963 1752 1 17 . 1 1 6 6 ASN H H 6 8.660 8.660 8.358 0.302 18963 1753 1 17 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.630 -0.580 18963 1754 1 17 . 1 1 7 7 ALA H H 7 7.140 7.140 7.552 -0.412 18963 1755 1 17 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.275 -0.395 18963 1756 1 17 . 1 1 8 8 LEU H H 8 7.780 7.780 7.791 -0.011 18963 1757 1 17 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.451 0.379 18963 1758 1 17 . 1 1 9 9 TYR H H 9 7.800 7.800 8.301 -0.501 18963 1759 1 17 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.238 -0.308 18963 1760 1 17 . 1 1 10 10 CYS H H 10 7.760 7.760 8.270 -0.510 18963 1761 1 17 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.926 0.514 18963 1762 1 17 . 1 1 11 11 ILE H H 11 10.080 10.080 8.688 1.392 18963 1763 1 17 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.558 0.082 18963 1764 1 17 . 1 1 12 12 CYS H H 12 7.590 7.590 8.059 -0.469 18963 1765 1 17 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.959 -0.069 18963 1766 1 17 . 1 1 13 13 ARG H H 13 7.690 7.690 8.282 -0.592 18963 1767 1 17 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.848 0.212 18963 1768 1 17 . 1 1 14 14 GLN H H 14 8.110 8.110 8.274 -0.164 18963 1769 1 17 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.615 0.635 18963 1770 1 17 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.326 0.144 18963 1771 1 17 . 1 1 16 16 HIS H H 16 9.800 9.800 8.949 0.851 18963 1772 1 17 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.178 -0.008 18963 1773 1 17 . 1 1 17 17 ASN H H 17 8.450 8.450 7.987 0.463 18963 1774 1 17 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.601 -0.391 18963 1775 1 17 . 1 1 18 18 ASN H H 18 9.010 9.010 7.783 1.227 18963 1776 1 17 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.524 -0.094 18963 1777 1 17 . 1 1 19 19 ARG H H 19 7.710 7.710 8.026 -0.316 18963 1778 1 17 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.459 0.051 18963 1779 1 17 . 1 1 20 20 PHE H H 20 8.680 8.680 8.665 0.015 18963 1780 1 17 . 1 1 21 21 MET HA H 21 5.310 5.310 4.712 0.598 18963 1781 1 17 . 1 1 21 21 MET H H 21 7.880 7.880 7.342 0.538 18963 1782 1 17 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.435 -0.045 18963 1783 1 17 . 1 1 22 22 ILE H H 22 9.180 9.180 9.148 0.032 18963 1784 1 17 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.126 0.264 18963 1785 1 17 . 1 1 23 23 CYS H H 23 8.000 8.000 8.032 -0.032 18963 1786 1 17 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.051 -0.501 18963 1787 1 17 . 1 1 24 24 CYS H H 24 8.750 8.750 8.959 -0.209 18963 1788 1 17 . 1 1 25 25 ASP H H 25 9.390 9.390 8.367 1.023 18963 1789 1 17 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.129 0.391 18963 1790 1 17 . 1 1 26 26 ARG H H 26 9.390 9.390 8.265 1.125 18963 1791 1 17 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.828 -0.058 18963 1792 1 17 . 1 1 27 27 CYS H H 27 8.550 8.550 7.869 0.681 18963 1793 1 17 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.997 0.183 18963 1794 1 17 . 1 1 28 28 GLU H H 28 7.660 7.660 8.223 -0.563 18963 1795 1 17 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.558 0.072 18963 1796 1 17 . 1 1 29 29 GLU H H 29 8.220 8.220 7.886 0.334 18963 1797 1 17 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.466 -0.626 18963 1798 1 17 . 1 1 30 30 TRP H H 30 8.250 8.250 8.018 0.232 18963 1799 1 17 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.846 -0.266 18963 1800 1 17 . 1 1 31 31 PHE H H 31 9.210 9.210 9.351 -0.141 18963 1801 1 17 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.694 0.476 18963 1802 1 17 . 1 1 32 32 HIS H H 32 9.740 9.740 8.568 1.172 18963 1803 1 17 . 1 1 33 33 GLY H H 33 9.090 9.090 8.721 0.369 18963 1804 1 17 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.560 -0.160 18963 1805 1 17 . 1 1 34 34 ASP H H 34 9.110 9.110 8.445 0.665 18963 1806 1 17 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.327 -0.097 18963 1807 1 17 . 1 1 35 35 CYS H H 35 7.660 7.660 8.399 -0.739 18963 1808 1 17 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.381 0.249 18963 1809 1 17 . 1 1 36 36 VAL H H 36 7.360 7.360 8.196 -0.836 18963 1810 1 17 . 1 1 37 37 GLY H H 37 7.670 7.670 7.884 -0.214 18963 1811 1 17 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.056 0.284 18963 1812 1 17 . 1 1 38 38 ILE H H 38 8.510 8.510 7.974 0.536 18963 1813 1 17 . 1 1 39 39 SER HA H 39 4.450 4.450 4.571 -0.121 18963 1814 1 17 . 1 1 39 39 SER H H 39 8.010 8.010 8.248 -0.238 18963 1815 1 17 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.972 -0.352 18963 1816 1 17 . 1 1 40 40 GLU H H 40 8.660 8.660 8.982 -0.322 18963 1817 1 17 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.170 -0.230 18963 1818 1 17 . 1 1 41 41 ALA H H 41 8.120 8.120 8.213 -0.093 18963 1819 1 17 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.137 -0.037 18963 1820 1 17 . 1 1 42 42 ARG H H 42 7.840 7.840 7.419 0.421 18963 1821 1 17 . 1 1 43 43 GLY H H 43 8.840 8.840 8.626 0.214 18963 1822 1 17 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.223 0.017 18963 1823 1 17 . 1 1 44 44 ARG H H 44 8.240 8.240 7.546 0.694 18963 1824 1 17 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.093 0.047 18963 1825 1 17 . 1 1 45 45 LEU H H 45 7.610 7.610 7.560 0.050 18963 1826 1 17 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.935 0.175 18963 1827 1 17 . 1 1 46 46 LEU H H 46 8.150 8.150 7.883 0.267 18963 1828 1 17 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.106 0.084 18963 1829 1 17 . 1 1 47 47 GLU H H 47 7.800 7.800 7.670 0.130 18963 1830 1 17 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.284 -0.124 18963 1831 1 17 . 1 1 48 48 ARG H H 48 8.250 8.250 7.511 0.739 18963 1832 1 17 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.760 -0.020 18963 1833 1 17 . 1 1 49 49 ASN H H 49 8.280 8.280 8.200 0.080 18963 1834 1 17 . 1 1 50 50 GLY H H 50 8.060 8.060 7.957 0.103 18963 1835 1 17 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.261 0.099 18963 1836 1 17 . 1 1 51 51 GLU H H 51 8.180 8.180 8.002 0.178 18963 1837 1 17 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.479 0.171 18963 1838 1 17 . 1 1 52 52 ASP H H 52 8.350 8.350 8.511 -0.161 18963 1839 1 17 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.450 0.040 18963 1840 1 17 . 1 1 53 53 TYR H H 53 9.200 9.200 7.872 1.328 18963 1841 1 17 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.091 0.559 18963 1842 1 17 . 1 1 54 54 ILE H H 54 6.790 6.790 7.232 -0.442 18963 1843 1 17 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.256 0.064 18963 1844 1 17 . 1 1 55 55 CYS H H 55 9.070 9.070 8.105 0.965 18963 1845 1 17 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.136 0.064 18963 1846 1 17 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.628 -0.058 18963 1847 1 17 . 1 1 57 57 ASN H H 57 8.370 8.370 7.883 0.487 18963 1848 1 17 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.227 -0.197 18963 1849 1 17 . 1 1 58 58 CYS H H 58 8.300 8.300 7.589 0.711 18963 1850 1 17 . 1 1 59 59 THR HA H 59 3.860 3.860 3.986 -0.126 18963 1851 1 17 . 1 1 59 59 THR H H 59 7.600 7.600 7.595 0.005 18963 1852 1 17 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.397 -0.187 18963 1853 1 17 . 1 1 60 60 ILE H H 60 7.480 7.480 7.560 -0.080 18963 1854 1 18 . 1 1 2 2 SER HA H 2 4.480 4.480 4.664 -0.184 18963 1855 1 18 . 1 1 3 3 MET HA H 3 4.100 4.100 4.462 -0.362 18963 1856 1 18 . 1 1 3 3 MET H H 3 8.340 8.340 8.557 -0.217 18963 1857 1 18 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.088 -0.128 18963 1858 1 18 . 1 1 4 4 ASP H H 4 8.430 8.430 8.666 -0.236 18963 1859 1 18 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.546 -0.136 18963 1860 1 18 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.727 0.133 18963 1861 1 18 . 1 1 6 6 ASN H H 6 8.660 8.660 8.447 0.213 18963 1862 1 18 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.535 -0.485 18963 1863 1 18 . 1 1 7 7 ALA H H 7 7.140 7.140 7.373 -0.233 18963 1864 1 18 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.209 -0.329 18963 1865 1 18 . 1 1 8 8 LEU H H 8 7.780 7.780 7.904 -0.124 18963 1866 1 18 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.723 0.107 18963 1867 1 18 . 1 1 9 9 TYR H H 9 7.800 7.800 8.452 -0.652 18963 1868 1 18 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.225 -0.295 18963 1869 1 18 . 1 1 10 10 CYS H H 10 7.760 7.760 8.252 -0.492 18963 1870 1 18 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.896 0.544 18963 1871 1 18 . 1 1 11 11 ILE H H 11 10.080 10.080 8.719 1.361 18963 1872 1 18 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.525 0.115 18963 1873 1 18 . 1 1 12 12 CYS H H 12 7.590 7.590 8.075 -0.485 18963 1874 1 18 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.933 -0.043 18963 1875 1 18 . 1 1 13 13 ARG H H 13 7.690 7.690 8.203 -0.513 18963 1876 1 18 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.778 0.282 18963 1877 1 18 . 1 1 14 14 GLN H H 14 8.110 8.110 8.265 -0.155 18963 1878 1 18 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.665 0.585 18963 1879 1 18 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.364 0.106 18963 1880 1 18 . 1 1 16 16 HIS H H 16 9.800 9.800 8.917 0.883 18963 1881 1 18 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.104 0.066 18963 1882 1 18 . 1 1 17 17 ASN H H 17 8.450 8.450 8.322 0.128 18963 1883 1 18 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.681 -0.471 18963 1884 1 18 . 1 1 18 18 ASN H H 18 9.010 9.010 7.766 1.244 18963 1885 1 18 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.582 -0.152 18963 1886 1 18 . 1 1 19 19 ARG H H 19 7.710 7.710 8.155 -0.445 18963 1887 1 18 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.450 0.060 18963 1888 1 18 . 1 1 20 20 PHE H H 20 8.680 8.680 8.414 0.266 18963 1889 1 18 . 1 1 21 21 MET HA H 21 5.310 5.310 4.718 0.592 18963 1890 1 18 . 1 1 21 21 MET H H 21 7.880 7.880 7.353 0.527 18963 1891 1 18 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.413 -0.023 18963 1892 1 18 . 1 1 22 22 ILE H H 22 9.180 9.180 9.094 0.086 18963 1893 1 18 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.168 0.222 18963 1894 1 18 . 1 1 23 23 CYS H H 23 8.000 8.000 8.218 -0.218 18963 1895 1 18 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.055 -0.505 18963 1896 1 18 . 1 1 24 24 CYS H H 24 8.750 8.750 8.969 -0.219 18963 1897 1 18 . 1 1 25 25 ASP H H 25 9.390 9.390 8.411 0.979 18963 1898 1 18 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.127 0.393 18963 1899 1 18 . 1 1 26 26 ARG H H 26 9.390 9.390 8.200 1.190 18963 1900 1 18 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.824 -0.054 18963 1901 1 18 . 1 1 27 27 CYS H H 27 8.550 8.550 7.845 0.705 18963 1902 1 18 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.966 0.214 18963 1903 1 18 . 1 1 28 28 GLU H H 28 7.660 7.660 8.299 -0.639 18963 1904 1 18 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.578 0.052 18963 1905 1 18 . 1 1 29 29 GLU H H 29 8.220 8.220 7.765 0.455 18963 1906 1 18 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.440 -0.600 18963 1907 1 18 . 1 1 30 30 TRP H H 30 8.250 8.250 8.132 0.118 18963 1908 1 18 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.847 -0.267 18963 1909 1 18 . 1 1 31 31 PHE H H 31 9.210 9.210 9.369 -0.159 18963 1910 1 18 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.694 0.476 18963 1911 1 18 . 1 1 32 32 HIS H H 32 9.740 9.740 8.563 1.177 18963 1912 1 18 . 1 1 33 33 GLY H H 33 9.090 9.090 8.633 0.457 18963 1913 1 18 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.557 -0.157 18963 1914 1 18 . 1 1 34 34 ASP H H 34 9.110 9.110 8.427 0.683 18963 1915 1 18 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.338 -0.108 18963 1916 1 18 . 1 1 35 35 CYS H H 35 7.660 7.660 8.366 -0.706 18963 1917 1 18 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.275 0.355 18963 1918 1 18 . 1 1 36 36 VAL H H 36 7.360 7.360 8.176 -0.816 18963 1919 1 18 . 1 1 37 37 GLY H H 37 7.670 7.670 7.820 -0.150 18963 1920 1 18 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.062 0.278 18963 1921 1 18 . 1 1 38 38 ILE H H 38 8.510 8.510 8.002 0.508 18963 1922 1 18 . 1 1 39 39 SER HA H 39 4.450 4.450 4.550 -0.100 18963 1923 1 18 . 1 1 39 39 SER H H 39 8.010 8.010 8.190 -0.180 18963 1924 1 18 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.913 -0.293 18963 1925 1 18 . 1 1 40 40 GLU H H 40 8.660 8.660 8.986 -0.326 18963 1926 1 18 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.199 -0.259 18963 1927 1 18 . 1 1 41 41 ALA H H 41 8.120 8.120 8.241 -0.121 18963 1928 1 18 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.101 -0.001 18963 1929 1 18 . 1 1 42 42 ARG H H 42 7.840 7.840 7.545 0.295 18963 1930 1 18 . 1 1 43 43 GLY H H 43 8.840 8.840 8.636 0.204 18963 1931 1 18 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.245 -0.005 18963 1932 1 18 . 1 1 44 44 ARG H H 44 8.240 8.240 7.513 0.727 18963 1933 1 18 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.074 0.066 18963 1934 1 18 . 1 1 45 45 LEU H H 45 7.610 7.610 7.457 0.153 18963 1935 1 18 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.897 0.213 18963 1936 1 18 . 1 1 46 46 LEU H H 46 8.150 8.150 7.867 0.283 18963 1937 1 18 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.150 0.040 18963 1938 1 18 . 1 1 47 47 GLU H H 47 7.800 7.800 7.754 0.046 18963 1939 1 18 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.291 -0.131 18963 1940 1 18 . 1 1 48 48 ARG H H 48 8.250 8.250 7.577 0.673 18963 1941 1 18 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.767 -0.027 18963 1942 1 18 . 1 1 49 49 ASN H H 49 8.280 8.280 8.364 -0.084 18963 1943 1 18 . 1 1 50 50 GLY H H 50 8.060 8.060 8.040 0.020 18963 1944 1 18 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.251 0.109 18963 1945 1 18 . 1 1 51 51 GLU H H 51 8.180 8.180 7.887 0.293 18963 1946 1 18 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.380 0.270 18963 1947 1 18 . 1 1 52 52 ASP H H 52 8.350 8.350 8.494 -0.144 18963 1948 1 18 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.469 0.021 18963 1949 1 18 . 1 1 53 53 TYR H H 53 9.200 9.200 7.935 1.265 18963 1950 1 18 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.092 0.558 18963 1951 1 18 . 1 1 54 54 ILE H H 54 6.790 6.790 7.233 -0.443 18963 1952 1 18 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.255 0.065 18963 1953 1 18 . 1 1 55 55 CYS H H 55 9.070 9.070 8.104 0.966 18963 1954 1 18 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.136 0.064 18963 1955 1 18 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.629 -0.059 18963 1956 1 18 . 1 1 57 57 ASN H H 57 8.370 8.370 7.882 0.488 18963 1957 1 18 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.301 -0.271 18963 1958 1 18 . 1 1 58 58 CYS H H 58 8.300 8.300 7.587 0.713 18963 1959 1 18 . 1 1 59 59 THR HA H 59 3.860 3.860 3.987 -0.127 18963 1960 1 18 . 1 1 59 59 THR H H 59 7.600 7.600 7.609 -0.009 18963 1961 1 18 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.374 -0.164 18963 1962 1 18 . 1 1 60 60 ILE H H 60 7.480 7.480 7.579 -0.099 18963 1963 1 19 . 1 1 2 2 SER HA H 2 4.480 4.480 4.713 -0.233 18963 1964 1 19 . 1 1 3 3 MET HA H 3 4.100 4.100 4.660 -0.560 18963 1965 1 19 . 1 1 3 3 MET H H 3 8.340 8.340 8.216 0.124 18963 1966 1 19 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.076 -0.116 18963 1967 1 19 . 1 1 4 4 ASP H H 4 8.430 8.430 8.480 -0.050 18963 1968 1 19 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.617 -0.207 18963 1969 1 19 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.775 0.085 18963 1970 1 19 . 1 1 6 6 ASN H H 6 8.660 8.660 8.702 -0.042 18963 1971 1 19 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.610 -0.560 18963 1972 1 19 . 1 1 7 7 ALA H H 7 7.140 7.140 7.500 -0.360 18963 1973 1 19 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.262 -0.382 18963 1974 1 19 . 1 1 8 8 LEU H H 8 7.780 7.780 7.907 -0.127 18963 1975 1 19 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.506 0.324 18963 1976 1 19 . 1 1 9 9 TYR H H 9 7.800 7.800 8.453 -0.653 18963 1977 1 19 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.226 -0.296 18963 1978 1 19 . 1 1 10 10 CYS H H 10 7.760 7.760 8.255 -0.495 18963 1979 1 19 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.898 0.542 18963 1980 1 19 . 1 1 11 11 ILE H H 11 10.080 10.080 8.721 1.359 18963 1981 1 19 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.522 0.118 18963 1982 1 19 . 1 1 12 12 CYS H H 12 7.590 7.590 8.093 -0.503 18963 1983 1 19 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.937 -0.047 18963 1984 1 19 . 1 1 13 13 ARG H H 13 7.690 7.690 8.208 -0.518 18963 1985 1 19 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.787 0.273 18963 1986 1 19 . 1 1 14 14 GLN H H 14 8.110 8.110 8.274 -0.164 18963 1987 1 19 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.641 0.609 18963 1988 1 19 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.347 0.123 18963 1989 1 19 . 1 1 16 16 HIS H H 16 9.800 9.800 9.027 0.773 18963 1990 1 19 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.154 0.016 18963 1991 1 19 . 1 1 17 17 ASN H H 17 8.450 8.450 8.246 0.204 18963 1992 1 19 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.646 -0.436 18963 1993 1 19 . 1 1 18 18 ASN H H 18 9.010 9.010 7.734 1.276 18963 1994 1 19 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.587 -0.157 18963 1995 1 19 . 1 1 19 19 ARG H H 19 7.710 7.710 8.048 -0.338 18963 1996 1 19 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.568 -0.058 18963 1997 1 19 . 1 1 20 20 PHE H H 20 8.680 8.680 8.380 0.300 18963 1998 1 19 . 1 1 21 21 MET HA H 21 5.310 5.310 4.693 0.617 18963 1999 1 19 . 1 1 21 21 MET H H 21 7.880 7.880 7.396 0.484 18963 2000 1 19 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.446 -0.056 18963 2001 1 19 . 1 1 22 22 ILE H H 22 9.180 9.180 9.022 0.158 18963 2002 1 19 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.191 0.199 18963 2003 1 19 . 1 1 23 23 CYS H H 23 8.000 8.000 8.047 -0.047 18963 2004 1 19 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.039 -0.489 18963 2005 1 19 . 1 1 24 24 CYS H H 24 8.750 8.750 8.961 -0.211 18963 2006 1 19 . 1 1 25 25 ASP H H 25 9.390 9.390 8.458 0.932 18963 2007 1 19 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.128 0.392 18963 2008 1 19 . 1 1 26 26 ARG H H 26 9.390 9.390 8.194 1.196 18963 2009 1 19 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.827 -0.057 18963 2010 1 19 . 1 1 27 27 CYS H H 27 8.550 8.550 7.842 0.708 18963 2011 1 19 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.975 0.205 18963 2012 1 19 . 1 1 28 28 GLU H H 28 7.660 7.660 8.331 -0.671 18963 2013 1 19 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.633 -0.003 18963 2014 1 19 . 1 1 29 29 GLU H H 29 8.220 8.220 7.746 0.474 18963 2015 1 19 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.460 -0.620 18963 2016 1 19 . 1 1 30 30 TRP H H 30 8.250 8.250 8.024 0.226 18963 2017 1 19 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.844 -0.264 18963 2018 1 19 . 1 1 31 31 PHE H H 31 9.210 9.210 9.364 -0.154 18963 2019 1 19 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.688 0.482 18963 2020 1 19 . 1 1 32 32 HIS H H 32 9.740 9.740 8.558 1.182 18963 2021 1 19 . 1 1 33 33 GLY H H 33 9.090 9.090 8.638 0.452 18963 2022 1 19 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.518 -0.118 18963 2023 1 19 . 1 1 34 34 ASP H H 34 9.110 9.110 8.444 0.666 18963 2024 1 19 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.329 -0.099 18963 2025 1 19 . 1 1 35 35 CYS H H 35 7.660 7.660 8.327 -0.667 18963 2026 1 19 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.257 0.373 18963 2027 1 19 . 1 1 36 36 VAL H H 36 7.360 7.360 8.208 -0.848 18963 2028 1 19 . 1 1 37 37 GLY H H 37 7.670 7.670 7.858 -0.188 18963 2029 1 19 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.077 0.263 18963 2030 1 19 . 1 1 38 38 ILE H H 38 8.510 8.510 8.025 0.485 18963 2031 1 19 . 1 1 39 39 SER HA H 39 4.450 4.450 4.561 -0.111 18963 2032 1 19 . 1 1 39 39 SER H H 39 8.010 8.010 8.211 -0.201 18963 2033 1 19 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.961 -0.341 18963 2034 1 19 . 1 1 40 40 GLU H H 40 8.660 8.660 9.031 -0.371 18963 2035 1 19 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.147 -0.207 18963 2036 1 19 . 1 1 41 41 ALA H H 41 8.120 8.120 8.233 -0.113 18963 2037 1 19 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.124 -0.024 18963 2038 1 19 . 1 1 42 42 ARG H H 42 7.840 7.840 7.398 0.442 18963 2039 1 19 . 1 1 43 43 GLY H H 43 8.840 8.840 8.666 0.174 18963 2040 1 19 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.169 0.071 18963 2041 1 19 . 1 1 44 44 ARG H H 44 8.240 8.240 7.590 0.650 18963 2042 1 19 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.165 -0.025 18963 2043 1 19 . 1 1 45 45 LEU H H 45 7.610 7.610 7.217 0.393 18963 2044 1 19 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.850 0.260 18963 2045 1 19 . 1 1 46 46 LEU H H 46 8.150 8.150 7.890 0.260 18963 2046 1 19 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.069 0.121 18963 2047 1 19 . 1 1 47 47 GLU H H 47 7.800 7.800 7.904 -0.104 18963 2048 1 19 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.282 -0.122 18963 2049 1 19 . 1 1 48 48 ARG H H 48 8.250 8.250 7.530 0.720 18963 2050 1 19 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.769 -0.029 18963 2051 1 19 . 1 1 49 49 ASN H H 49 8.280 8.280 8.311 -0.031 18963 2052 1 19 . 1 1 50 50 GLY H H 50 8.060 8.060 8.038 0.022 18963 2053 1 19 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.283 0.077 18963 2054 1 19 . 1 1 51 51 GLU H H 51 8.180 8.180 7.935 0.245 18963 2055 1 19 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.495 0.155 18963 2056 1 19 . 1 1 52 52 ASP H H 52 8.350 8.350 8.528 -0.178 18963 2057 1 19 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.534 -0.044 18963 2058 1 19 . 1 1 53 53 TYR H H 53 9.200 9.200 7.920 1.280 18963 2059 1 19 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.101 0.549 18963 2060 1 19 . 1 1 54 54 ILE H H 54 6.790 6.790 7.294 -0.504 18963 2061 1 19 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.253 0.067 18963 2062 1 19 . 1 1 55 55 CYS H H 55 9.070 9.070 8.105 0.965 18963 2063 1 19 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.135 0.065 18963 2064 1 19 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.628 -0.058 18963 2065 1 19 . 1 1 57 57 ASN H H 57 8.370 8.370 7.879 0.491 18963 2066 1 19 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.310 -0.280 18963 2067 1 19 . 1 1 58 58 CYS H H 58 8.300 8.300 7.574 0.726 18963 2068 1 19 . 1 1 59 59 THR HA H 59 3.860 3.860 3.984 -0.124 18963 2069 1 19 . 1 1 59 59 THR H H 59 7.600 7.600 7.614 -0.014 18963 2070 1 19 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.337 -0.127 18963 2071 1 19 . 1 1 60 60 ILE H H 60 7.480 7.480 7.487 -0.007 18963 2072 1 20 . 1 1 2 2 SER HA H 2 4.480 4.480 4.814 -0.334 18963 2073 1 20 . 1 1 3 3 MET HA H 3 4.100 4.100 4.644 -0.544 18963 2074 1 20 . 1 1 3 3 MET H H 3 8.340 8.340 8.257 0.083 18963 2075 1 20 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.061 -0.101 18963 2076 1 20 . 1 1 4 4 ASP H H 4 8.430 8.430 8.455 -0.025 18963 2077 1 20 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.599 -0.189 18963 2078 1 20 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.780 0.080 18963 2079 1 20 . 1 1 6 6 ASN H H 6 8.660 8.660 8.719 -0.059 18963 2080 1 20 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.602 -0.552 18963 2081 1 20 . 1 1 7 7 ALA H H 7 7.140 7.140 7.474 -0.334 18963 2082 1 20 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.256 -0.376 18963 2083 1 20 . 1 1 8 8 LEU H H 8 7.780 7.780 7.902 -0.122 18963 2084 1 20 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.506 0.324 18963 2085 1 20 . 1 1 9 9 TYR H H 9 7.800 7.800 8.453 -0.653 18963 2086 1 20 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.230 -0.300 18963 2087 1 20 . 1 1 10 10 CYS H H 10 7.760 7.760 8.257 -0.496 18963 2088 1 20 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.896 0.544 18963 2089 1 20 . 1 1 11 11 ILE H H 11 10.080 10.080 8.721 1.359 18963 2090 1 20 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.521 0.119 18963 2091 1 20 . 1 1 12 12 CYS H H 12 7.590 7.590 8.092 -0.502 18963 2092 1 20 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.938 -0.048 18963 2093 1 20 . 1 1 13 13 ARG H H 13 7.690 7.690 8.207 -0.517 18963 2094 1 20 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.786 0.274 18963 2095 1 20 . 1 1 14 14 GLN H H 14 8.110 8.110 8.272 -0.162 18963 2096 1 20 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.686 0.564 18963 2097 1 20 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.366 0.104 18963 2098 1 20 . 1 1 16 16 HIS H H 16 9.800 9.800 8.907 0.893 18963 2099 1 20 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.142 0.028 18963 2100 1 20 . 1 1 17 17 ASN H H 17 8.450 8.450 8.324 0.126 18963 2101 1 20 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.681 -0.471 18963 2102 1 20 . 1 1 18 18 ASN H H 18 9.010 9.010 7.829 1.181 18963 2103 1 20 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.600 -0.170 18963 2104 1 20 . 1 1 19 19 ARG H H 19 7.710 7.710 8.176 -0.466 18963 2105 1 20 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.449 0.061 18963 2106 1 20 . 1 1 20 20 PHE H H 20 8.680 8.680 8.610 0.070 18963 2107 1 20 . 1 1 21 21 MET HA H 21 5.310 5.310 4.709 0.601 18963 2108 1 20 . 1 1 21 21 MET H H 21 7.880 7.880 7.358 0.522 18963 2109 1 20 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.437 -0.047 18963 2110 1 20 . 1 1 22 22 ILE H H 22 9.180 9.180 9.017 0.163 18963 2111 1 20 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.195 0.195 18963 2112 1 20 . 1 1 23 23 CYS H H 23 8.000 8.000 8.058 -0.058 18963 2113 1 20 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.029 -0.479 18963 2114 1 20 . 1 1 24 24 CYS H H 24 8.750 8.750 8.956 -0.206 18963 2115 1 20 . 1 1 25 25 ASP H H 25 9.390 9.390 8.422 0.968 18963 2116 1 20 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.129 0.391 18963 2117 1 20 . 1 1 26 26 ARG H H 26 9.390 9.390 8.215 1.175 18963 2118 1 20 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.811 -0.041 18963 2119 1 20 . 1 1 27 27 CYS H H 27 8.550 8.550 7.835 0.715 18963 2120 1 20 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.969 0.211 18963 2121 1 20 . 1 1 28 28 GLU H H 28 7.660 7.660 8.218 -0.558 18963 2122 1 20 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.507 0.123 18963 2123 1 20 . 1 1 29 29 GLU H H 29 8.220 8.220 7.834 0.386 18963 2124 1 20 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.465 -0.625 18963 2125 1 20 . 1 1 30 30 TRP H H 30 8.250 8.250 8.023 0.227 18963 2126 1 20 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.846 -0.266 18963 2127 1 20 . 1 1 31 31 PHE H H 31 9.210 9.210 9.360 -0.150 18963 2128 1 20 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.691 0.479 18963 2129 1 20 . 1 1 32 32 HIS H H 32 9.740 9.740 8.565 1.175 18963 2130 1 20 . 1 1 33 33 GLY H H 33 9.090 9.090 8.602 0.488 18963 2131 1 20 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.554 -0.154 18963 2132 1 20 . 1 1 34 34 ASP H H 34 9.110 9.110 8.409 0.701 18963 2133 1 20 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.344 -0.114 18963 2134 1 20 . 1 1 35 35 CYS H H 35 7.660 7.660 8.284 -0.624 18963 2135 1 20 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.327 0.303 18963 2136 1 20 . 1 1 36 36 VAL H H 36 7.360 7.360 8.274 -0.914 18963 2137 1 20 . 1 1 37 37 GLY H H 37 7.670 7.670 7.914 -0.244 18963 2138 1 20 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.052 0.288 18963 2139 1 20 . 1 1 38 38 ILE H H 38 8.510 8.510 7.999 0.511 18963 2140 1 20 . 1 1 39 39 SER HA H 39 4.450 4.450 4.612 -0.162 18963 2141 1 20 . 1 1 39 39 SER H H 39 8.010 8.010 8.208 -0.198 18963 2142 1 20 . 1 1 40 40 GLU HA H 40 2.620 2.620 3.024 -0.404 18963 2143 1 20 . 1 1 40 40 GLU H H 40 8.660 8.660 8.986 -0.326 18963 2144 1 20 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.154 -0.214 18963 2145 1 20 . 1 1 41 41 ALA H H 41 8.120 8.120 8.258 -0.138 18963 2146 1 20 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.126 -0.026 18963 2147 1 20 . 1 1 42 42 ARG H H 42 7.840 7.840 7.493 0.347 18963 2148 1 20 . 1 1 43 43 GLY H H 43 8.840 8.840 8.723 0.117 18963 2149 1 20 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.296 -0.056 18963 2150 1 20 . 1 1 44 44 ARG H H 44 8.240 8.240 7.484 0.756 18963 2151 1 20 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.147 -0.007 18963 2152 1 20 . 1 1 45 45 LEU H H 45 7.610 7.610 7.663 -0.053 18963 2153 1 20 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.895 0.215 18963 2154 1 20 . 1 1 46 46 LEU H H 46 8.150 8.150 8.037 0.113 18963 2155 1 20 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.084 0.106 18963 2156 1 20 . 1 1 47 47 GLU H H 47 7.800 7.800 7.790 0.010 18963 2157 1 20 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.251 -0.091 18963 2158 1 20 . 1 1 48 48 ARG H H 48 8.250 8.250 7.557 0.693 18963 2159 1 20 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.762 -0.022 18963 2160 1 20 . 1 1 49 49 ASN H H 49 8.280 8.280 8.211 0.069 18963 2161 1 20 . 1 1 50 50 GLY H H 50 8.060 8.060 7.865 0.195 18963 2162 1 20 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.362 -0.002 18963 2163 1 20 . 1 1 51 51 GLU H H 51 8.180 8.180 7.793 0.387 18963 2164 1 20 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.301 0.349 18963 2165 1 20 . 1 1 52 52 ASP H H 52 8.350 8.350 8.273 0.077 18963 2166 1 20 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.518 -0.028 18963 2167 1 20 . 1 1 53 53 TYR H H 53 9.200 9.200 7.925 1.275 18963 2168 1 20 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.097 0.553 18963 2169 1 20 . 1 1 54 54 ILE H H 54 6.790 6.790 7.267 -0.477 18963 2170 1 20 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.254 0.066 18963 2171 1 20 . 1 1 55 55 CYS H H 55 9.070 9.070 8.104 0.966 18963 2172 1 20 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.137 0.063 18963 2173 1 20 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.602 -0.032 18963 2174 1 20 . 1 1 57 57 ASN H H 57 8.370 8.370 7.838 0.532 18963 2175 1 20 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.373 -0.343 18963 2176 1 20 . 1 1 58 58 CYS H H 58 8.300 8.300 7.588 0.713 18963 2177 1 20 . 1 1 59 59 THR HA H 59 3.860 3.860 3.941 -0.081 18963 2178 1 20 . 1 1 59 59 THR H H 59 7.600 7.600 7.721 -0.121 18963 2179 1 20 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.469 -0.259 18963 2180 1 20 . 1 1 60 60 ILE H H 60 7.480 7.480 7.581 -0.101 18963 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 18963 2 1 1 "Average Difference" HA 62 0.266 0.003 0.269 18963 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 18963 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 18963 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 18963 6 1 1 "Average Difference" HN 55 0.557 -0.139 0.545 18963 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 18963 8 1 2 "Average Difference" HA 62 0.267 0.010 0.269 18963 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 18963 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 18963 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 18963 12 1 2 "Average Difference" HN 55 0.560 -0.124 0.551 18963 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 18963 14 1 3 "Average Difference" HA 62 0.278 0.017 0.279 18963 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 18963 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 18963 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 18963 18 1 3 "Average Difference" HN 55 0.554 -0.143 0.540 18963 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 18963 20 1 4 "Average Difference" HA 62 0.269 0.007 0.271 18963 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 18963 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 18963 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 18963 24 1 4 "Average Difference" HN 55 0.556 -0.141 0.543 18963 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 18963 26 1 5 "Average Difference" HA 62 0.280 0.007 0.282 18963 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 18963 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 18963 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 18963 30 1 5 "Average Difference" HN 55 0.533 -0.107 0.526 18963 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 18963 32 1 6 "Average Difference" HA 62 0.271 0.013 0.273 18963 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 18963 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 18963 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 18963 36 1 6 "Average Difference" HN 55 0.563 -0.141 0.550 18963 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 18963 38 1 7 "Average Difference" HA 62 0.257 -0.000 0.259 18963 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 18963 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 18963 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 18963 42 1 7 "Average Difference" HN 55 0.559 -0.123 0.551 18963 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 18963 44 1 8 "Average Difference" HA 62 0.293 -0.007 0.295 18963 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 18963 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 18963 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 18963 48 1 8 "Average Difference" HN 55 0.565 -0.160 0.547 18963 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 18963 50 1 9 "Average Difference" HA 62 0.287 -0.012 0.289 18963 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 18963 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 18963 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 18963 54 1 9 "Average Difference" HN 55 0.575 -0.129 0.565 18963 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 18963 56 1 10 "Average Difference" HA 62 0.279 0.001 0.281 18963 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 18963 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 18963 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 18963 60 1 10 "Average Difference" HN 55 0.556 -0.163 0.536 18963 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 18963 62 1 11 "Average Difference" HA 62 0.285 -0.021 0.286 18963 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 18963 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 18963 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 18963 66 1 11 "Average Difference" HN 55 0.567 -0.134 0.556 18963 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 18963 68 1 12 "Average Difference" HA 62 0.295 -0.006 0.297 18963 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 18963 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 18963 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 18963 72 1 12 "Average Difference" HN 55 0.572 -0.178 0.549 18963 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 18963 74 1 13 "Average Difference" HA 62 0.272 0.001 0.275 18963 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 18963 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 18963 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 18963 78 1 13 "Average Difference" HN 55 0.552 -0.144 0.538 18963 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 18963 80 1 14 "Average Difference" HA 62 0.261 -0.006 0.263 18963 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 18963 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 18963 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 18963 84 1 14 "Average Difference" HN 55 0.559 -0.159 0.541 18963 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 18963 86 1 15 "Average Difference" HA 62 0.289 0.011 0.291 18963 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 18963 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 18963 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 18963 90 1 15 "Average Difference" HN 55 0.561 -0.146 0.547 18963 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 18963 92 1 16 "Average Difference" HA 62 0.282 -0.014 0.284 18963 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 18963 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 18963 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 18963 96 1 16 "Average Difference" HN 55 0.569 -0.159 0.551 18963 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 18963 98 1 17 "Average Difference" HA 62 0.281 -0.027 0.282 18963 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 18963 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 18963 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 18963 102 1 17 "Average Difference" HN 55 0.581 -0.172 0.560 18963 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 18963 104 1 18 "Average Difference" HA 62 0.274 -0.026 0.275 18963 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 18963 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 18963 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 18963 108 1 18 "Average Difference" HN 55 0.576 -0.168 0.556 18963 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 18963 110 1 19 "Average Difference" HA 62 0.286 -0.019 0.288 18963 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 18963 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 18963 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 18963 114 1 19 "Average Difference" HN 55 0.577 -0.178 0.554 18963 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 18963 116 1 20 "Average Difference" HA 62 0.293 -0.017 0.295 18963 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 18963 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 18963 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 18963 120 1 20 "Average Difference" HN 55 0.575 -0.173 0.553 18963 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 18963 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 SER HA H 2 4.480 4.480 4.679 -0.199 18963 2 1 . 1 1 3 3 MET HA H 3 4.100 4.100 4.497 -0.397 18963 3 1 . 1 1 3 3 MET H H 3 8.340 8.340 8.480 -0.140 18963 4 1 . 1 1 4 4 ASP HA H 4 4.960 4.960 5.059 -0.099 18963 5 1 . 1 1 4 4 ASP H H 4 8.430 8.430 8.656 -0.226 18963 6 1 . 1 1 5 5 PRO HA H 5 4.410 4.410 4.543 -0.133 18963 7 1 . 1 1 6 6 ASN HA H 6 4.860 4.860 4.728 0.132 18963 8 1 . 1 1 6 6 ASN H H 6 8.660 8.660 8.502 0.158 18963 9 1 . 1 1 7 7 ALA HA H 7 4.050 4.050 4.575 -0.525 18963 10 1 . 1 1 7 7 ALA H H 7 7.140 7.140 7.457 -0.317 18963 11 1 . 1 1 8 8 LEU HA H 8 3.880 3.880 4.328 -0.448 18963 12 1 . 1 1 8 8 LEU H H 8 7.780 7.780 7.884 -0.104 18963 13 1 . 1 1 9 9 TYR HA H 9 4.830 4.830 4.535 0.295 18963 14 1 . 1 1 9 9 TYR H H 9 7.800 7.800 8.424 -0.624 18963 15 1 . 1 1 10 10 CYS HA H 10 3.930 3.930 4.193 -0.263 18963 16 1 . 1 1 10 10 CYS H H 10 7.760 7.760 8.261 -0.500 18963 17 1 . 1 1 11 11 ILE HA H 11 4.440 4.440 3.914 0.526 18963 18 1 . 1 1 11 11 ILE H H 11 10.080 10.080 8.719 1.361 18963 19 1 . 1 1 12 12 CYS HA H 12 4.640 4.640 4.554 0.086 18963 20 1 . 1 1 12 12 CYS H H 12 7.590 7.590 8.090 -0.500 18963 21 1 . 1 1 13 13 ARG HA H 13 3.890 3.890 3.958 -0.068 18963 22 1 . 1 1 13 13 ARG H H 13 7.690 7.690 8.212 -0.522 18963 23 1 . 1 1 14 14 GLN HA H 14 5.060 5.060 4.826 0.234 18963 24 1 . 1 1 14 14 GLN H H 14 8.110 8.110 8.268 -0.158 18963 25 1 . 1 1 15 15 PRO HA H 15 5.250 5.250 4.741 0.509 18963 26 1 . 1 1 16 16 HIS HA H 16 4.470 4.470 4.443 0.027 18963 27 1 . 1 1 16 16 HIS H H 16 9.800 9.800 8.986 0.814 18963 28 1 . 1 1 17 17 ASN HA H 17 4.170 4.170 4.309 -0.139 18963 29 1 . 1 1 17 17 ASN H H 17 8.450 8.450 8.414 0.036 18963 30 1 . 1 1 18 18 ASN HA H 18 4.210 4.210 4.817 -0.607 18963 31 1 . 1 1 18 18 ASN H H 18 9.010 9.010 8.010 1.000 18963 32 1 . 1 1 19 19 ARG HA H 19 4.430 4.430 4.616 -0.186 18963 33 1 . 1 1 19 19 ARG H H 19 7.710 7.710 8.096 -0.386 18963 34 1 . 1 1 20 20 PHE HA H 20 4.510 4.510 4.435 0.075 18963 35 1 . 1 1 20 20 PHE H H 20 8.680 8.680 8.580 0.100 18963 36 1 . 1 1 21 21 MET HA H 21 5.310 5.310 4.919 0.391 18963 37 1 . 1 1 21 21 MET H H 21 7.880 7.880 7.337 0.543 18963 38 1 . 1 1 22 22 ILE HA H 22 4.390 4.390 4.456 -0.066 18963 39 1 . 1 1 22 22 ILE H H 22 9.180 9.180 9.122 0.058 18963 40 1 . 1 1 23 23 CYS HA H 23 4.390 4.390 4.194 0.196 18963 41 1 . 1 1 23 23 CYS H H 23 8.000 8.000 8.065 -0.065 18963 42 1 . 1 1 24 24 CYS HA H 24 4.550 4.550 5.029 -0.479 18963 43 1 . 1 1 24 24 CYS H H 24 8.750 8.750 8.976 -0.226 18963 44 1 . 1 1 25 25 ASP H H 25 9.390 9.390 8.420 0.970 18963 45 1 . 1 1 26 26 ARG HA H 26 4.520 4.520 4.135 0.385 18963 46 1 . 1 1 26 26 ARG H H 26 9.390 9.390 8.252 1.138 18963 47 1 . 1 1 27 27 CYS HA H 27 4.770 4.770 4.817 -0.047 18963 48 1 . 1 1 27 27 CYS H H 27 8.550 8.550 7.811 0.739 18963 49 1 . 1 1 28 28 GLU HA H 28 4.180 4.180 3.972 0.208 18963 50 1 . 1 1 28 28 GLU H H 28 7.660 7.660 8.242 -0.582 18963 51 1 . 1 1 29 29 GLU HA H 29 4.630 4.630 4.608 0.022 18963 52 1 . 1 1 29 29 GLU H H 29 8.220 8.220 7.801 0.419 18963 53 1 . 1 1 30 30 TRP HA H 30 4.840 4.840 5.469 -0.629 18963 54 1 . 1 1 30 30 TRP H H 30 8.250 8.250 8.073 0.177 18963 55 1 . 1 1 31 31 PHE HA H 31 4.580 4.580 4.811 -0.231 18963 56 1 . 1 1 31 31 PHE H H 31 9.210 9.210 9.356 -0.146 18963 57 1 . 1 1 32 32 HIS HA H 32 5.170 5.170 4.981 0.189 18963 58 1 . 1 1 32 32 HIS H H 32 9.740 9.740 8.628 1.112 18963 59 1 . 1 1 33 33 GLY H H 33 9.090 9.090 8.747 0.343 18963 60 1 . 1 1 34 34 ASP HA H 34 4.400 4.400 4.555 -0.155 18963 61 1 . 1 1 34 34 ASP H H 34 9.110 9.110 8.495 0.615 18963 62 1 . 1 1 35 35 CYS HA H 35 4.230 4.230 4.367 -0.137 18963 63 1 . 1 1 35 35 CYS H H 35 7.660 7.660 8.238 -0.578 18963 64 1 . 1 1 36 36 VAL HA H 36 4.630 4.630 4.263 0.367 18963 65 1 . 1 1 36 36 VAL H H 36 7.360 7.360 8.353 -0.993 18963 66 1 . 1 1 37 37 GLY H H 37 7.670 7.670 7.886 -0.216 18963 67 1 . 1 1 38 38 ILE HA H 38 4.340 4.340 4.072 0.268 18963 68 1 . 1 1 38 38 ILE H H 38 8.510 8.510 8.015 0.495 18963 69 1 . 1 1 39 39 SER HA H 39 4.450 4.450 4.520 -0.070 18963 70 1 . 1 1 39 39 SER H H 39 8.010 8.010 8.213 -0.203 18963 71 1 . 1 1 40 40 GLU HA H 40 2.620 2.620 2.963 -0.343 18963 72 1 . 1 1 40 40 GLU H H 40 8.660 8.660 8.938 -0.278 18963 73 1 . 1 1 41 41 ALA HA H 41 3.940 3.940 4.162 -0.222 18963 74 1 . 1 1 41 41 ALA H H 41 8.120 8.120 8.166 -0.046 18963 75 1 . 1 1 42 42 ARG HA H 42 4.100 4.100 4.094 0.006 18963 76 1 . 1 1 42 42 ARG H H 42 7.840 7.840 7.692 0.148 18963 77 1 . 1 1 43 43 GLY H H 43 8.840 8.840 8.595 0.245 18963 78 1 . 1 1 44 44 ARG HA H 44 4.240 4.240 4.236 0.004 18963 79 1 . 1 1 44 44 ARG H H 44 8.240 8.240 7.515 0.725 18963 80 1 . 1 1 45 45 LEU HA H 45 4.140 4.140 4.113 0.027 18963 81 1 . 1 1 45 45 LEU H H 45 7.610 7.610 7.604 0.006 18963 82 1 . 1 1 46 46 LEU HA H 46 4.110 4.110 3.968 0.142 18963 83 1 . 1 1 46 46 LEU H H 46 8.150 8.150 7.793 0.357 18963 84 1 . 1 1 47 47 GLU HA H 47 4.190 4.190 4.117 0.073 18963 85 1 . 1 1 47 47 GLU H H 47 7.800 7.800 7.735 0.065 18963 86 1 . 1 1 48 48 ARG HA H 48 4.160 4.160 4.274 -0.114 18963 87 1 . 1 1 48 48 ARG H H 48 8.250 8.250 7.754 0.496 18963 88 1 . 1 1 49 49 ASN HA H 49 4.740 4.740 4.759 -0.019 18963 89 1 . 1 1 49 49 ASN H H 49 8.280 8.280 8.173 0.107 18963 90 1 . 1 1 50 50 GLY H H 50 8.060 8.060 7.945 0.115 18963 91 1 . 1 1 51 51 GLU HA H 51 4.360 4.360 4.343 0.017 18963 92 1 . 1 1 51 51 GLU H H 51 8.180 8.180 8.018 0.162 18963 93 1 . 1 1 52 52 ASP HA H 52 4.650 4.650 4.390 0.260 18963 94 1 . 1 1 52 52 ASP H H 52 8.350 8.350 8.477 -0.127 18963 95 1 . 1 1 53 53 TYR HA H 53 4.490 4.490 4.548 -0.058 18963 96 1 . 1 1 53 53 TYR H H 53 9.200 9.200 7.987 1.213 18963 97 1 . 1 1 54 54 ILE HA H 54 4.650 4.650 4.107 0.543 18963 98 1 . 1 1 54 54 ILE H H 54 6.790 6.790 7.305 -0.515 18963 99 1 . 1 1 55 55 CYS HA H 55 4.320 4.320 4.248 0.072 18963 100 1 . 1 1 55 55 CYS H H 55 9.070 9.070 8.108 0.962 18963 101 1 . 1 1 56 56 PRO HA H 56 4.200 4.200 4.137 0.063 18963 102 1 . 1 1 57 57 ASN HA H 57 4.570 4.570 4.619 -0.049 18963 103 1 . 1 1 57 57 ASN H H 57 8.370 8.370 7.867 0.503 18963 104 1 . 1 1 58 58 CYS HA H 58 4.030 4.030 4.364 -0.334 18963 105 1 . 1 1 58 58 CYS H H 58 8.300 8.300 7.638 0.662 18963 106 1 . 1 1 59 59 THR HA H 59 3.860 3.860 3.981 -0.121 18963 107 1 . 1 1 59 59 THR H H 59 7.600 7.600 7.714 -0.114 18963 108 1 . 1 1 60 60 ILE HA H 60 4.210 4.210 4.426 -0.216 18963 109 1 . 1 1 60 60 ILE H H 60 7.480 7.480 7.563 -0.083 18963 stop_ save_