data_25458 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25458 _Entry.PDB_ID 2MYQ 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 25458 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.248 -0.108 25458 2 1 1 . 1 1 3 3 LYS H H 3 8.310 8.310 8.315 -0.005 25458 3 1 1 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.135 0.065 25458 4 1 1 . 1 1 4 4 LEU H H 4 7.650 7.650 7.872 -0.222 25458 5 1 1 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.299 -0.049 25458 6 1 1 . 1 1 5 5 LEU H H 5 7.550 7.550 7.974 -0.424 25458 7 1 1 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.178 0.092 25458 8 1 1 . 1 1 6 6 LEU H H 6 7.860 7.860 8.294 -0.434 25458 9 1 1 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.513 0.097 25458 10 1 1 . 1 1 7 7 ASN H H 7 8.030 8.030 8.710 -0.680 25458 11 1 1 . 1 1 8 8 GLY H H 8 8.170 8.170 7.560 0.610 25458 12 1 1 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.331 0.069 25458 13 1 1 . 1 1 9 9 PHE H H 9 8.290 8.290 8.488 -0.198 25458 14 1 1 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.318 0.252 25458 15 1 1 . 1 1 10 10 ASP H H 10 8.630 8.630 8.377 0.253 25458 16 1 1 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.544 0.076 25458 17 1 1 . 1 1 11 11 ASP H H 11 8.470 8.470 8.249 0.221 25458 18 1 1 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.828 0.032 25458 19 1 1 . 1 1 12 12 VAL H H 12 8.270 8.270 7.577 0.693 25458 20 1 1 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.382 -0.022 25458 21 1 1 . 1 1 13 13 HIS H H 13 8.040 8.040 8.727 -0.687 25458 22 1 1 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.528 -0.078 25458 23 1 1 . 1 1 14 14 PHE H H 14 8.460 8.460 7.837 0.623 25458 24 1 1 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.686 0.444 25458 25 1 1 . 1 1 15 15 LEU H H 15 8.500 8.500 7.647 0.853 25458 26 1 1 . 1 1 16 16 GLY H H 16 8.470 8.470 7.969 0.501 25458 27 1 1 . 1 1 17 17 SER HA H 17 4.290 4.290 3.979 0.311 25458 28 1 1 . 1 1 17 17 SER H H 17 7.990 7.990 8.141 -0.151 25458 29 1 1 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.360 0.150 25458 30 1 1 . 1 1 18 18 ASN H H 18 7.810 7.810 7.332 0.478 25458 31 1 1 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.802 -0.072 25458 32 1 1 . 1 1 19 19 VAL H H 19 8.200 8.200 8.515 -0.315 25458 33 1 1 . 1 1 20 20 MET HA H 20 4.220 4.220 4.207 0.013 25458 34 1 1 . 1 1 20 20 MET H H 20 8.130 8.130 7.714 0.416 25458 35 1 1 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.999 0.131 25458 36 1 1 . 1 1 21 21 GLU H H 21 8.130 8.130 7.989 0.141 25458 37 1 1 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.090 -0.030 25458 38 1 1 . 1 1 22 22 GLU H H 22 8.220 8.220 8.327 -0.107 25458 39 1 1 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.179 -0.159 25458 40 1 1 . 1 1 23 23 GLN H H 23 8.280 8.280 7.616 0.664 25458 41 1 1 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.498 0.022 25458 42 1 1 . 1 1 24 24 ASP H H 24 8.380 8.380 8.164 0.216 25458 43 1 1 . 1 1 25 25 LEU H H 25 8.300 8.300 7.459 0.841 25458 44 1 1 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.283 -0.183 25458 45 1 1 . 1 1 26 26 ARG H H 26 8.090 8.090 7.480 0.610 25458 46 1 1 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.439 0.121 25458 47 1 1 . 1 1 27 27 ASP H H 27 8.280 8.280 8.054 0.226 25458 48 1 1 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.744 0.146 25458 49 1 1 . 1 1 28 28 ILE H H 28 8.260 8.260 7.423 0.837 25458 50 1 1 . 1 1 29 29 GLY H H 29 8.200 8.200 7.543 0.657 25458 51 1 1 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.404 -0.294 25458 52 1 1 . 1 1 30 30 ILE H H 30 7.960 7.960 7.483 0.477 25458 53 1 1 . 1 1 31 31 SER HA H 31 4.400 4.400 4.583 -0.183 25458 54 1 1 . 1 1 31 31 SER H H 31 7.880 7.880 7.994 -0.114 25458 55 1 1 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.612 0.298 25458 56 1 1 . 1 1 32 32 ASP H H 32 7.960 7.960 7.642 0.318 25458 57 1 1 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.306 0.004 25458 58 1 1 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.972 0.188 25458 59 1 1 . 1 1 34 34 GLN H H 34 8.190 8.190 8.686 -0.496 25458 60 1 1 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.259 0.211 25458 61 1 1 . 1 1 35 35 HIS H H 35 8.050 8.050 8.139 -0.089 25458 62 1 1 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.054 0.016 25458 63 1 1 . 1 1 36 36 ARG H H 36 8.230 8.230 8.238 -0.008 25458 64 1 1 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.106 -0.036 25458 65 1 1 . 1 1 37 37 ARG H H 37 8.210 8.210 7.830 0.380 25458 66 1 1 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.186 -0.036 25458 67 1 1 . 1 1 38 38 LYS H H 38 7.690 7.690 7.927 -0.237 25458 68 1 1 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.235 -0.065 25458 69 1 1 . 1 1 39 39 LEU H H 39 7.840 7.840 8.015 -0.175 25458 70 1 1 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.003 0.137 25458 71 1 1 . 1 1 40 40 LEU H H 40 8.030 8.030 7.990 0.040 25458 72 1 1 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.096 -0.016 25458 73 1 1 . 1 1 41 41 GLN H H 41 8.010 8.010 7.848 0.162 25458 74 1 1 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.333 -0.113 25458 75 1 1 . 1 1 42 42 ALA H H 42 8.030 8.030 7.829 0.201 25458 76 1 1 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.245 -0.005 25458 77 1 1 . 1 1 43 43 ALA H H 43 8.090 8.090 7.728 0.362 25458 78 1 2 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.582 -0.442 25458 79 1 2 . 1 1 3 3 LYS H H 3 8.310 8.310 8.525 -0.215 25458 80 1 2 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.452 -0.252 25458 81 1 2 . 1 1 4 4 LEU H H 4 7.650 7.650 7.560 0.090 25458 82 1 2 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.219 0.031 25458 83 1 2 . 1 1 5 5 LEU H H 5 7.550 7.550 7.826 -0.276 25458 84 1 2 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.397 -0.127 25458 85 1 2 . 1 1 6 6 LEU H H 6 7.860 7.860 7.493 0.367 25458 86 1 2 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.521 0.089 25458 87 1 2 . 1 1 7 7 ASN H H 7 8.030 8.030 8.800 -0.770 25458 88 1 2 . 1 1 8 8 GLY H H 8 8.170 8.170 7.860 0.310 25458 89 1 2 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.683 -0.283 25458 90 1 2 . 1 1 9 9 PHE H H 9 8.290 8.290 7.679 0.611 25458 91 1 2 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.268 0.302 25458 92 1 2 . 1 1 10 10 ASP H H 10 8.630 8.630 8.137 0.493 25458 93 1 2 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.473 0.147 25458 94 1 2 . 1 1 11 11 ASP H H 11 8.470 8.470 8.502 -0.032 25458 95 1 2 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.662 0.198 25458 96 1 2 . 1 1 12 12 VAL H H 12 8.270 8.270 7.457 0.813 25458 97 1 2 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.092 0.268 25458 98 1 2 . 1 1 13 13 HIS H H 13 8.040 8.040 8.365 -0.325 25458 99 1 2 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.427 0.023 25458 100 1 2 . 1 1 14 14 PHE H H 14 8.460 8.460 7.676 0.784 25458 101 1 2 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.850 0.280 25458 102 1 2 . 1 1 15 15 LEU H H 15 8.500 8.500 7.393 1.107 25458 103 1 2 . 1 1 16 16 GLY H H 16 8.470 8.470 7.757 0.713 25458 104 1 2 . 1 1 17 17 SER HA H 17 4.290 4.290 3.968 0.322 25458 105 1 2 . 1 1 17 17 SER H H 17 7.990 7.990 8.125 -0.135 25458 106 1 2 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.434 0.076 25458 107 1 2 . 1 1 18 18 ASN H H 18 7.810 7.810 7.239 0.571 25458 108 1 2 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.813 -0.083 25458 109 1 2 . 1 1 19 19 VAL H H 19 8.200 8.200 8.518 -0.318 25458 110 1 2 . 1 1 20 20 MET HA H 20 4.220 4.220 4.206 0.014 25458 111 1 2 . 1 1 20 20 MET H H 20 8.130 8.130 7.739 0.391 25458 112 1 2 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.987 0.143 25458 113 1 2 . 1 1 21 21 GLU H H 21 8.130 8.130 8.041 0.089 25458 114 1 2 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.126 -0.066 25458 115 1 2 . 1 1 22 22 GLU H H 22 8.220 8.220 8.359 -0.139 25458 116 1 2 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.210 -0.190 25458 117 1 2 . 1 1 23 23 GLN H H 23 8.280 8.280 7.527 0.753 25458 118 1 2 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.473 0.047 25458 119 1 2 . 1 1 24 24 ASP H H 24 8.380 8.380 8.212 0.168 25458 120 1 2 . 1 1 25 25 LEU H H 25 8.300 8.300 7.508 0.792 25458 121 1 2 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.323 -0.223 25458 122 1 2 . 1 1 26 26 ARG H H 26 8.090 8.090 7.370 0.720 25458 123 1 2 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.397 0.163 25458 124 1 2 . 1 1 27 27 ASP H H 27 8.280 8.280 8.277 0.003 25458 125 1 2 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.727 0.163 25458 126 1 2 . 1 1 28 28 ILE H H 28 8.260 8.260 7.385 0.875 25458 127 1 2 . 1 1 29 29 GLY H H 29 8.200 8.200 7.949 0.251 25458 128 1 2 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.356 -0.246 25458 129 1 2 . 1 1 30 30 ILE H H 30 7.960 7.960 7.471 0.489 25458 130 1 2 . 1 1 31 31 SER HA H 31 4.400 4.400 4.551 -0.151 25458 131 1 2 . 1 1 31 31 SER H H 31 7.880 7.880 8.141 -0.261 25458 132 1 2 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.604 0.306 25458 133 1 2 . 1 1 32 32 ASP H H 32 7.960 7.960 8.049 -0.089 25458 134 1 2 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.307 0.003 25458 135 1 2 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.983 0.177 25458 136 1 2 . 1 1 34 34 GLN H H 34 8.190 8.190 8.802 -0.612 25458 137 1 2 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.208 0.262 25458 138 1 2 . 1 1 35 35 HIS H H 35 8.050 8.050 8.385 -0.335 25458 139 1 2 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.102 -0.032 25458 140 1 2 . 1 1 36 36 ARG H H 36 8.230 8.230 8.156 0.073 25458 141 1 2 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.173 -0.103 25458 142 1 2 . 1 1 37 37 ARG H H 37 8.210 8.210 7.778 0.432 25458 143 1 2 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.264 -0.114 25458 144 1 2 . 1 1 38 38 LYS H H 38 7.690 7.690 8.052 -0.362 25458 145 1 2 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.291 -0.121 25458 146 1 2 . 1 1 39 39 LEU H H 39 7.840 7.840 8.019 -0.179 25458 147 1 2 . 1 1 40 40 LEU HA H 40 4.140 4.140 3.957 0.183 25458 148 1 2 . 1 1 40 40 LEU H H 40 8.030 8.030 7.861 0.169 25458 149 1 2 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.046 0.034 25458 150 1 2 . 1 1 41 41 GLN H H 41 8.010 8.010 7.837 0.173 25458 151 1 2 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.327 -0.107 25458 152 1 2 . 1 1 42 42 ALA H H 42 8.030 8.030 7.843 0.187 25458 153 1 2 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.242 -0.002 25458 154 1 2 . 1 1 43 43 ALA H H 43 8.090 8.090 7.714 0.376 25458 155 1 3 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.110 0.030 25458 156 1 3 . 1 1 3 3 LYS H H 3 8.310 8.310 8.557 -0.247 25458 157 1 3 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.065 0.135 25458 158 1 3 . 1 1 4 4 LEU H H 4 7.650 7.650 7.946 -0.296 25458 159 1 3 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.069 0.181 25458 160 1 3 . 1 1 5 5 LEU H H 5 7.550 7.550 7.604 -0.054 25458 161 1 3 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.884 0.386 25458 162 1 3 . 1 1 6 6 LEU H H 6 7.860 7.860 7.466 0.394 25458 163 1 3 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.478 0.132 25458 164 1 3 . 1 1 7 7 ASN H H 7 8.030 8.030 7.854 0.176 25458 165 1 3 . 1 1 8 8 GLY H H 8 8.170 8.170 7.305 0.865 25458 166 1 3 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.297 0.103 25458 167 1 3 . 1 1 9 9 PHE H H 9 8.290 8.290 8.512 -0.222 25458 168 1 3 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.212 0.358 25458 169 1 3 . 1 1 10 10 ASP H H 10 8.630 8.630 7.870 0.760 25458 170 1 3 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.478 0.142 25458 171 1 3 . 1 1 11 11 ASP H H 11 8.470 8.470 7.844 0.626 25458 172 1 3 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.714 0.146 25458 173 1 3 . 1 1 12 12 VAL H H 12 8.270 8.270 7.406 0.864 25458 174 1 3 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.075 0.285 25458 175 1 3 . 1 1 13 13 HIS H H 13 8.040 8.040 8.355 -0.315 25458 176 1 3 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.448 0.002 25458 177 1 3 . 1 1 14 14 PHE H H 14 8.460 8.460 7.673 0.787 25458 178 1 3 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.695 0.435 25458 179 1 3 . 1 1 15 15 LEU H H 15 8.500 8.500 7.305 1.195 25458 180 1 3 . 1 1 16 16 GLY H H 16 8.470 8.470 7.771 0.699 25458 181 1 3 . 1 1 17 17 SER HA H 17 4.290 4.290 3.935 0.355 25458 182 1 3 . 1 1 17 17 SER H H 17 7.990 7.990 8.109 -0.119 25458 183 1 3 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.331 0.179 25458 184 1 3 . 1 1 18 18 ASN H H 18 7.810 7.810 7.260 0.550 25458 185 1 3 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.827 -0.097 25458 186 1 3 . 1 1 19 19 VAL H H 19 8.200 8.200 8.454 -0.254 25458 187 1 3 . 1 1 20 20 MET HA H 20 4.220 4.220 4.183 0.037 25458 188 1 3 . 1 1 20 20 MET H H 20 8.130 8.130 7.664 0.466 25458 189 1 3 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.972 0.158 25458 190 1 3 . 1 1 21 21 GLU H H 21 8.130 8.130 7.966 0.164 25458 191 1 3 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.074 -0.014 25458 192 1 3 . 1 1 22 22 GLU H H 22 8.220 8.220 8.344 -0.124 25458 193 1 3 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.137 -0.117 25458 194 1 3 . 1 1 23 23 GLN H H 23 8.280 8.280 7.510 0.770 25458 195 1 3 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.493 0.027 25458 196 1 3 . 1 1 24 24 ASP H H 24 8.380 8.380 8.205 0.175 25458 197 1 3 . 1 1 25 25 LEU H H 25 8.300 8.300 7.468 0.832 25458 198 1 3 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.334 -0.234 25458 199 1 3 . 1 1 26 26 ARG H H 26 8.090 8.090 7.282 0.808 25458 200 1 3 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.454 0.106 25458 201 1 3 . 1 1 27 27 ASP H H 27 8.280 8.280 8.341 -0.061 25458 202 1 3 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.774 0.116 25458 203 1 3 . 1 1 28 28 ILE H H 28 8.260 8.260 7.416 0.844 25458 204 1 3 . 1 1 29 29 GLY H H 29 8.200 8.200 7.729 0.471 25458 205 1 3 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.500 -0.390 25458 206 1 3 . 1 1 30 30 ILE H H 30 7.960 7.960 7.609 0.351 25458 207 1 3 . 1 1 31 31 SER HA H 31 4.400 4.400 4.593 -0.193 25458 208 1 3 . 1 1 31 31 SER H H 31 7.880 7.880 8.252 -0.372 25458 209 1 3 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.604 0.306 25458 210 1 3 . 1 1 32 32 ASP H H 32 7.960 7.960 8.119 -0.159 25458 211 1 3 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.300 0.010 25458 212 1 3 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.978 0.182 25458 213 1 3 . 1 1 34 34 GLN H H 34 8.190 8.190 8.799 -0.609 25458 214 1 3 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.119 0.351 25458 215 1 3 . 1 1 35 35 HIS H H 35 8.050 8.050 8.506 -0.456 25458 216 1 3 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.030 0.040 25458 217 1 3 . 1 1 36 36 ARG H H 36 8.230 8.230 8.115 0.115 25458 218 1 3 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.230 -0.160 25458 219 1 3 . 1 1 37 37 ARG H H 37 8.210 8.210 7.878 0.332 25458 220 1 3 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.283 -0.133 25458 221 1 3 . 1 1 38 38 LYS H H 38 7.690 7.690 8.098 -0.408 25458 222 1 3 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.350 -0.180 25458 223 1 3 . 1 1 39 39 LEU H H 39 7.840 7.840 8.213 -0.373 25458 224 1 3 . 1 1 40 40 LEU HA H 40 4.140 4.140 3.989 0.151 25458 225 1 3 . 1 1 40 40 LEU H H 40 8.030 8.030 7.663 0.367 25458 226 1 3 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.079 0.001 25458 227 1 3 . 1 1 41 41 GLN H H 41 8.010 8.010 7.796 0.214 25458 228 1 3 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.309 -0.089 25458 229 1 3 . 1 1 42 42 ALA H H 42 8.030 8.030 7.854 0.176 25458 230 1 3 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.243 -0.003 25458 231 1 3 . 1 1 43 43 ALA H H 43 8.090 8.090 7.702 0.388 25458 232 1 4 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.126 0.014 25458 233 1 4 . 1 1 3 3 LYS H H 3 8.310 8.310 8.429 -0.119 25458 234 1 4 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.598 -0.398 25458 235 1 4 . 1 1 4 4 LEU H H 4 7.650 7.650 7.732 -0.082 25458 236 1 4 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.140 0.110 25458 237 1 4 . 1 1 5 5 LEU H H 5 7.550 7.550 8.019 -0.469 25458 238 1 4 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.283 -0.013 25458 239 1 4 . 1 1 6 6 LEU H H 6 7.860 7.860 7.573 0.287 25458 240 1 4 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.425 0.185 25458 241 1 4 . 1 1 7 7 ASN H H 7 8.030 8.030 8.665 -0.635 25458 242 1 4 . 1 1 8 8 GLY H H 8 8.170 8.170 7.942 0.228 25458 243 1 4 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.131 0.269 25458 244 1 4 . 1 1 9 9 PHE H H 9 8.290 8.290 7.725 0.565 25458 245 1 4 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.255 0.315 25458 246 1 4 . 1 1 10 10 ASP H H 10 8.630 8.630 8.323 0.307 25458 247 1 4 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.491 0.129 25458 248 1 4 . 1 1 11 11 ASP H H 11 8.470 8.470 7.883 0.587 25458 249 1 4 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.719 0.141 25458 250 1 4 . 1 1 12 12 VAL H H 12 8.270 8.270 7.348 0.922 25458 251 1 4 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.349 0.011 25458 252 1 4 . 1 1 13 13 HIS H H 13 8.040 8.040 8.594 -0.554 25458 253 1 4 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.483 -0.033 25458 254 1 4 . 1 1 14 14 PHE H H 14 8.460 8.460 7.809 0.651 25458 255 1 4 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.744 0.386 25458 256 1 4 . 1 1 15 15 LEU H H 15 8.500 8.500 7.589 0.911 25458 257 1 4 . 1 1 16 16 GLY H H 16 8.470 8.470 7.808 0.662 25458 258 1 4 . 1 1 17 17 SER HA H 17 4.290 4.290 3.946 0.344 25458 259 1 4 . 1 1 17 17 SER H H 17 7.990 7.990 8.104 -0.114 25458 260 1 4 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.345 0.165 25458 261 1 4 . 1 1 18 18 ASN H H 18 7.810 7.810 7.328 0.482 25458 262 1 4 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.843 -0.113 25458 263 1 4 . 1 1 19 19 VAL H H 19 8.200 8.200 8.511 -0.311 25458 264 1 4 . 1 1 20 20 MET HA H 20 4.220 4.220 4.098 0.122 25458 265 1 4 . 1 1 20 20 MET H H 20 8.130 8.130 7.682 0.448 25458 266 1 4 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.987 0.143 25458 267 1 4 . 1 1 21 21 GLU H H 21 8.130 8.130 7.960 0.170 25458 268 1 4 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.088 -0.028 25458 269 1 4 . 1 1 22 22 GLU H H 22 8.220 8.220 8.328 -0.108 25458 270 1 4 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.178 -0.158 25458 271 1 4 . 1 1 23 23 GLN H H 23 8.280 8.280 7.552 0.728 25458 272 1 4 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.520 0.000 25458 273 1 4 . 1 1 24 24 ASP H H 24 8.380 8.380 8.228 0.152 25458 274 1 4 . 1 1 25 25 LEU H H 25 8.300 8.300 7.510 0.790 25458 275 1 4 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.255 -0.155 25458 276 1 4 . 1 1 26 26 ARG H H 26 8.090 8.090 7.490 0.600 25458 277 1 4 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.425 0.135 25458 278 1 4 . 1 1 27 27 ASP H H 27 8.280 8.280 8.038 0.242 25458 279 1 4 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.873 0.017 25458 280 1 4 . 1 1 28 28 ILE H H 28 8.260 8.260 7.484 0.776 25458 281 1 4 . 1 1 29 29 GLY H H 29 8.200 8.200 7.689 0.511 25458 282 1 4 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.372 -0.262 25458 283 1 4 . 1 1 30 30 ILE H H 30 7.960 7.960 7.589 0.371 25458 284 1 4 . 1 1 31 31 SER HA H 31 4.400 4.400 4.572 -0.172 25458 285 1 4 . 1 1 31 31 SER H H 31 7.880 7.880 8.080 -0.200 25458 286 1 4 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.611 0.299 25458 287 1 4 . 1 1 32 32 ASP H H 32 7.960 7.960 7.475 0.485 25458 288 1 4 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.274 0.036 25458 289 1 4 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.012 0.148 25458 290 1 4 . 1 1 34 34 GLN H H 34 8.190 8.190 8.668 -0.478 25458 291 1 4 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.251 0.219 25458 292 1 4 . 1 1 35 35 HIS H H 35 8.050 8.050 8.068 -0.017 25458 293 1 4 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.090 -0.020 25458 294 1 4 . 1 1 36 36 ARG H H 36 8.230 8.230 8.303 -0.073 25458 295 1 4 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.133 -0.063 25458 296 1 4 . 1 1 37 37 ARG H H 37 8.210 8.210 7.813 0.397 25458 297 1 4 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.200 -0.050 25458 298 1 4 . 1 1 38 38 LYS H H 38 7.690 7.690 7.847 -0.157 25458 299 1 4 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.264 -0.094 25458 300 1 4 . 1 1 39 39 LEU H H 39 7.840 7.840 7.974 -0.134 25458 301 1 4 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.010 0.130 25458 302 1 4 . 1 1 40 40 LEU H H 40 8.030 8.030 8.030 0.000 25458 303 1 4 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.096 -0.016 25458 304 1 4 . 1 1 41 41 GLN H H 41 8.010 8.010 7.732 0.278 25458 305 1 4 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.387 -0.167 25458 306 1 4 . 1 1 42 42 ALA H H 42 8.030 8.030 7.695 0.335 25458 307 1 4 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.222 0.018 25458 308 1 4 . 1 1 43 43 ALA H H 43 8.090 8.090 7.905 0.184 25458 309 1 5 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.342 -0.202 25458 310 1 5 . 1 1 3 3 LYS H H 3 8.310 8.310 8.402 -0.092 25458 311 1 5 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.274 -0.074 25458 312 1 5 . 1 1 4 4 LEU H H 4 7.650 7.650 7.822 -0.172 25458 313 1 5 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.169 0.081 25458 314 1 5 . 1 1 5 5 LEU H H 5 7.550 7.550 8.098 -0.548 25458 315 1 5 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.474 -0.204 25458 316 1 5 . 1 1 6 6 LEU H H 6 7.860 7.860 7.450 0.410 25458 317 1 5 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.429 0.181 25458 318 1 5 . 1 1 7 7 ASN H H 7 8.030 8.030 8.388 -0.358 25458 319 1 5 . 1 1 8 8 GLY H H 8 8.170 8.170 7.392 0.778 25458 320 1 5 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.374 0.026 25458 321 1 5 . 1 1 9 9 PHE H H 9 8.290 8.290 7.753 0.537 25458 322 1 5 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.330 0.240 25458 323 1 5 . 1 1 10 10 ASP H H 10 8.630 8.630 8.051 0.579 25458 324 1 5 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.472 0.148 25458 325 1 5 . 1 1 11 11 ASP H H 11 8.470 8.470 8.338 0.132 25458 326 1 5 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.760 0.100 25458 327 1 5 . 1 1 12 12 VAL H H 12 8.270 8.270 7.549 0.721 25458 328 1 5 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.354 0.006 25458 329 1 5 . 1 1 13 13 HIS H H 13 8.040 8.040 8.689 -0.649 25458 330 1 5 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.418 0.032 25458 331 1 5 . 1 1 14 14 PHE H H 14 8.460 8.460 7.802 0.658 25458 332 1 5 . 1 1 15 15 LEU HA H 15 4.130 4.130 4.003 0.127 25458 333 1 5 . 1 1 15 15 LEU H H 15 8.500 8.500 7.577 0.923 25458 334 1 5 . 1 1 16 16 GLY H H 16 8.470 8.470 8.263 0.207 25458 335 1 5 . 1 1 17 17 SER HA H 17 4.290 4.290 3.974 0.316 25458 336 1 5 . 1 1 17 17 SER H H 17 7.990 7.990 7.723 0.267 25458 337 1 5 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.494 0.016 25458 338 1 5 . 1 1 18 18 ASN H H 18 7.810 7.810 7.218 0.592 25458 339 1 5 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.693 0.037 25458 340 1 5 . 1 1 19 19 VAL H H 19 8.200 8.200 8.560 -0.360 25458 341 1 5 . 1 1 20 20 MET HA H 20 4.220 4.220 4.196 0.024 25458 342 1 5 . 1 1 20 20 MET H H 20 8.130 8.130 7.782 0.348 25458 343 1 5 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.022 0.108 25458 344 1 5 . 1 1 21 21 GLU H H 21 8.130 8.130 8.122 0.008 25458 345 1 5 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.131 -0.071 25458 346 1 5 . 1 1 22 22 GLU H H 22 8.220 8.220 8.350 -0.130 25458 347 1 5 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.198 -0.178 25458 348 1 5 . 1 1 23 23 GLN H H 23 8.280 8.280 7.592 0.688 25458 349 1 5 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.505 0.015 25458 350 1 5 . 1 1 24 24 ASP H H 24 8.380 8.380 8.126 0.254 25458 351 1 5 . 1 1 25 25 LEU H H 25 8.300 8.300 7.448 0.852 25458 352 1 5 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.320 -0.220 25458 353 1 5 . 1 1 26 26 ARG H H 26 8.090 8.090 7.339 0.751 25458 354 1 5 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.530 0.030 25458 355 1 5 . 1 1 27 27 ASP H H 27 8.280 8.280 8.250 0.030 25458 356 1 5 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.828 0.062 25458 357 1 5 . 1 1 28 28 ILE H H 28 8.260 8.260 7.464 0.796 25458 358 1 5 . 1 1 29 29 GLY H H 29 8.200 8.200 7.527 0.673 25458 359 1 5 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.526 -0.416 25458 360 1 5 . 1 1 30 30 ILE H H 30 7.960 7.960 7.695 0.265 25458 361 1 5 . 1 1 31 31 SER HA H 31 4.400 4.400 4.574 -0.174 25458 362 1 5 . 1 1 31 31 SER H H 31 7.880 7.880 8.052 -0.172 25458 363 1 5 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.618 0.292 25458 364 1 5 . 1 1 32 32 ASP H H 32 7.960 7.960 7.894 0.066 25458 365 1 5 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.321 -0.011 25458 366 1 5 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.988 0.172 25458 367 1 5 . 1 1 34 34 GLN H H 34 8.190 8.190 8.737 -0.547 25458 368 1 5 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.148 0.322 25458 369 1 5 . 1 1 35 35 HIS H H 35 8.050 8.050 7.708 0.342 25458 370 1 5 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.038 0.032 25458 371 1 5 . 1 1 36 36 ARG H H 36 8.230 8.230 8.430 -0.200 25458 372 1 5 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.170 -0.100 25458 373 1 5 . 1 1 37 37 ARG H H 37 8.210 8.210 7.900 0.310 25458 374 1 5 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.272 -0.122 25458 375 1 5 . 1 1 38 38 LYS H H 38 7.690 7.690 7.626 0.064 25458 376 1 5 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.325 -0.155 25458 377 1 5 . 1 1 39 39 LEU H H 39 7.840 7.840 7.968 -0.128 25458 378 1 5 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.059 0.081 25458 379 1 5 . 1 1 40 40 LEU H H 40 8.030 8.030 8.472 -0.442 25458 380 1 5 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.128 -0.048 25458 381 1 5 . 1 1 41 41 GLN H H 41 8.010 8.010 7.724 0.286 25458 382 1 5 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.393 -0.173 25458 383 1 5 . 1 1 42 42 ALA H H 42 8.030 8.030 7.772 0.258 25458 384 1 5 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.187 0.053 25458 385 1 5 . 1 1 43 43 ALA H H 43 8.090 8.090 7.900 0.190 25458 386 1 6 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.345 -0.205 25458 387 1 6 . 1 1 3 3 LYS H H 3 8.310 8.310 8.051 0.259 25458 388 1 6 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.517 -0.317 25458 389 1 6 . 1 1 4 4 LEU H H 4 7.650 7.650 8.020 -0.370 25458 390 1 6 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.082 0.168 25458 391 1 6 . 1 1 5 5 LEU H H 5 7.550 7.550 7.720 -0.170 25458 392 1 6 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.997 0.273 25458 393 1 6 . 1 1 6 6 LEU H H 6 7.860 7.860 8.023 -0.163 25458 394 1 6 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.511 0.099 25458 395 1 6 . 1 1 7 7 ASN H H 7 8.030 8.030 7.760 0.270 25458 396 1 6 . 1 1 8 8 GLY H H 8 8.170 8.170 7.612 0.558 25458 397 1 6 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.402 -0.002 25458 398 1 6 . 1 1 9 9 PHE H H 9 8.290 8.290 8.105 0.185 25458 399 1 6 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.241 0.329 25458 400 1 6 . 1 1 10 10 ASP H H 10 8.630 8.630 8.396 0.234 25458 401 1 6 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.488 0.132 25458 402 1 6 . 1 1 11 11 ASP H H 11 8.470 8.470 8.059 0.411 25458 403 1 6 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.691 0.169 25458 404 1 6 . 1 1 12 12 VAL H H 12 8.270 8.270 7.459 0.811 25458 405 1 6 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.175 0.185 25458 406 1 6 . 1 1 13 13 HIS H H 13 8.040 8.040 8.539 -0.499 25458 407 1 6 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.447 0.003 25458 408 1 6 . 1 1 14 14 PHE H H 14 8.460 8.460 7.752 0.708 25458 409 1 6 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.911 0.219 25458 410 1 6 . 1 1 15 15 LEU H H 15 8.500 8.500 7.553 0.947 25458 411 1 6 . 1 1 16 16 GLY H H 16 8.470 8.470 8.555 -0.085 25458 412 1 6 . 1 1 17 17 SER HA H 17 4.290 4.290 4.177 0.113 25458 413 1 6 . 1 1 17 17 SER H H 17 7.990 7.990 7.799 0.191 25458 414 1 6 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.540 -0.030 25458 415 1 6 . 1 1 18 18 ASN H H 18 7.810 7.810 7.632 0.178 25458 416 1 6 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.894 -0.164 25458 417 1 6 . 1 1 19 19 VAL H H 19 8.200 8.200 8.540 -0.340 25458 418 1 6 . 1 1 20 20 MET HA H 20 4.220 4.220 4.236 -0.016 25458 419 1 6 . 1 1 20 20 MET H H 20 8.130 8.130 7.529 0.601 25458 420 1 6 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.002 0.128 25458 421 1 6 . 1 1 21 21 GLU H H 21 8.130 8.130 7.757 0.373 25458 422 1 6 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.099 -0.039 25458 423 1 6 . 1 1 22 22 GLU H H 22 8.220 8.220 8.287 -0.067 25458 424 1 6 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.170 -0.150 25458 425 1 6 . 1 1 23 23 GLN H H 23 8.280 8.280 7.667 0.613 25458 426 1 6 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.484 0.036 25458 427 1 6 . 1 1 24 24 ASP H H 24 8.380 8.380 8.021 0.359 25458 428 1 6 . 1 1 25 25 LEU H H 25 8.300 8.300 7.506 0.794 25458 429 1 6 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.270 -0.170 25458 430 1 6 . 1 1 26 26 ARG H H 26 8.090 8.090 7.327 0.763 25458 431 1 6 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.398 0.162 25458 432 1 6 . 1 1 27 27 ASP H H 27 8.280 8.280 8.094 0.186 25458 433 1 6 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.854 0.036 25458 434 1 6 . 1 1 28 28 ILE H H 28 8.260 8.260 7.479 0.781 25458 435 1 6 . 1 1 29 29 GLY H H 29 8.200 8.200 7.728 0.472 25458 436 1 6 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.382 -0.272 25458 437 1 6 . 1 1 30 30 ILE H H 30 7.960 7.960 7.603 0.357 25458 438 1 6 . 1 1 31 31 SER HA H 31 4.400 4.400 4.567 -0.167 25458 439 1 6 . 1 1 31 31 SER H H 31 7.880 7.880 8.052 -0.172 25458 440 1 6 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.647 0.263 25458 441 1 6 . 1 1 32 32 ASP H H 32 7.960 7.960 7.508 0.452 25458 442 1 6 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.296 0.014 25458 443 1 6 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.010 0.150 25458 444 1 6 . 1 1 34 34 GLN H H 34 8.190 8.190 8.659 -0.469 25458 445 1 6 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.241 0.229 25458 446 1 6 . 1 1 35 35 HIS H H 35 8.050 8.050 8.122 -0.072 25458 447 1 6 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.058 0.012 25458 448 1 6 . 1 1 36 36 ARG H H 36 8.230 8.230 8.060 0.170 25458 449 1 6 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.142 -0.072 25458 450 1 6 . 1 1 37 37 ARG H H 37 8.210 8.210 7.634 0.576 25458 451 1 6 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.199 -0.049 25458 452 1 6 . 1 1 38 38 LYS H H 38 7.690 7.690 8.067 -0.377 25458 453 1 6 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.265 -0.095 25458 454 1 6 . 1 1 39 39 LEU H H 39 7.840 7.840 8.053 -0.213 25458 455 1 6 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.035 0.105 25458 456 1 6 . 1 1 40 40 LEU H H 40 8.030 8.030 7.817 0.213 25458 457 1 6 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.113 -0.033 25458 458 1 6 . 1 1 41 41 GLN H H 41 8.010 8.010 7.975 0.035 25458 459 1 6 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.334 -0.114 25458 460 1 6 . 1 1 42 42 ALA H H 42 8.030 8.030 7.878 0.152 25458 461 1 6 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.244 -0.004 25458 462 1 6 . 1 1 43 43 ALA H H 43 8.090 8.090 7.711 0.379 25458 463 1 7 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.098 0.042 25458 464 1 7 . 1 1 3 3 LYS H H 3 8.310 8.310 8.339 -0.029 25458 465 1 7 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.154 0.046 25458 466 1 7 . 1 1 4 4 LEU H H 4 7.650 7.650 7.941 -0.291 25458 467 1 7 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.175 0.075 25458 468 1 7 . 1 1 5 5 LEU H H 5 7.550 7.550 7.534 0.016 25458 469 1 7 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.838 0.432 25458 470 1 7 . 1 1 6 6 LEU H H 6 7.860 7.860 8.273 -0.413 25458 471 1 7 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.556 0.054 25458 472 1 7 . 1 1 7 7 ASN H H 7 8.030 8.030 8.086 -0.056 25458 473 1 7 . 1 1 8 8 GLY H H 8 8.170 8.170 7.454 0.716 25458 474 1 7 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.241 0.159 25458 475 1 7 . 1 1 9 9 PHE H H 9 8.290 8.290 8.742 -0.452 25458 476 1 7 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.308 0.262 25458 477 1 7 . 1 1 10 10 ASP H H 10 8.630 8.630 8.002 0.628 25458 478 1 7 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.556 0.064 25458 479 1 7 . 1 1 11 11 ASP H H 11 8.470 8.470 7.913 0.557 25458 480 1 7 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.723 0.137 25458 481 1 7 . 1 1 12 12 VAL H H 12 8.270 8.270 7.314 0.956 25458 482 1 7 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.380 -0.020 25458 483 1 7 . 1 1 13 13 HIS H H 13 8.040 8.040 8.837 -0.797 25458 484 1 7 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.500 -0.050 25458 485 1 7 . 1 1 14 14 PHE H H 14 8.460 8.460 7.759 0.701 25458 486 1 7 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.746 0.384 25458 487 1 7 . 1 1 15 15 LEU H H 15 8.500 8.500 7.571 0.929 25458 488 1 7 . 1 1 16 16 GLY H H 16 8.470 8.470 8.067 0.403 25458 489 1 7 . 1 1 17 17 SER HA H 17 4.290 4.290 4.176 0.114 25458 490 1 7 . 1 1 17 17 SER H H 17 7.990 7.990 7.886 0.104 25458 491 1 7 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.605 -0.095 25458 492 1 7 . 1 1 18 18 ASN H H 18 7.810 7.810 7.591 0.219 25458 493 1 7 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.887 -0.157 25458 494 1 7 . 1 1 19 19 VAL H H 19 8.200 8.200 8.538 -0.338 25458 495 1 7 . 1 1 20 20 MET HA H 20 4.220 4.220 4.270 -0.050 25458 496 1 7 . 1 1 20 20 MET H H 20 8.130 8.130 7.524 0.606 25458 497 1 7 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.018 0.112 25458 498 1 7 . 1 1 21 21 GLU H H 21 8.130 8.130 7.775 0.355 25458 499 1 7 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.097 -0.037 25458 500 1 7 . 1 1 22 22 GLU H H 22 8.220 8.220 8.298 -0.078 25458 501 1 7 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.158 -0.138 25458 502 1 7 . 1 1 23 23 GLN H H 23 8.280 8.280 7.615 0.665 25458 503 1 7 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.511 0.009 25458 504 1 7 . 1 1 24 24 ASP H H 24 8.380 8.380 8.019 0.361 25458 505 1 7 . 1 1 25 25 LEU H H 25 8.300 8.300 7.444 0.856 25458 506 1 7 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.224 -0.124 25458 507 1 7 . 1 1 26 26 ARG H H 26 8.090 8.090 7.297 0.793 25458 508 1 7 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.386 0.174 25458 509 1 7 . 1 1 27 27 ASP H H 27 8.280 8.280 8.160 0.120 25458 510 1 7 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.858 0.032 25458 511 1 7 . 1 1 28 28 ILE H H 28 8.260 8.260 7.500 0.760 25458 512 1 7 . 1 1 29 29 GLY H H 29 8.200 8.200 7.789 0.411 25458 513 1 7 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.380 -0.270 25458 514 1 7 . 1 1 30 30 ILE H H 30 7.960 7.960 7.513 0.447 25458 515 1 7 . 1 1 31 31 SER HA H 31 4.400 4.400 4.527 -0.127 25458 516 1 7 . 1 1 31 31 SER H H 31 7.880 7.880 8.109 -0.229 25458 517 1 7 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.668 0.242 25458 518 1 7 . 1 1 32 32 ASP H H 32 7.960 7.960 7.550 0.410 25458 519 1 7 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.304 0.006 25458 520 1 7 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.006 0.154 25458 521 1 7 . 1 1 34 34 GLN H H 34 8.190 8.190 8.612 -0.422 25458 522 1 7 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.218 0.252 25458 523 1 7 . 1 1 35 35 HIS H H 35 8.050 8.050 8.121 -0.071 25458 524 1 7 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.047 0.023 25458 525 1 7 . 1 1 36 36 ARG H H 36 8.230 8.230 8.150 0.080 25458 526 1 7 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.162 -0.092 25458 527 1 7 . 1 1 37 37 ARG H H 37 8.210 8.210 7.853 0.357 25458 528 1 7 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.214 -0.064 25458 529 1 7 . 1 1 38 38 LYS H H 38 7.690 7.690 7.980 -0.290 25458 530 1 7 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.314 -0.144 25458 531 1 7 . 1 1 39 39 LEU H H 39 7.840 7.840 8.211 -0.371 25458 532 1 7 . 1 1 40 40 LEU HA H 40 4.140 4.140 3.991 0.149 25458 533 1 7 . 1 1 40 40 LEU H H 40 8.030 8.030 7.695 0.335 25458 534 1 7 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.098 -0.018 25458 535 1 7 . 1 1 41 41 GLN H H 41 8.010 8.010 7.761 0.249 25458 536 1 7 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.302 -0.082 25458 537 1 7 . 1 1 42 42 ALA H H 42 8.030 8.030 7.809 0.221 25458 538 1 7 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.234 0.006 25458 539 1 7 . 1 1 43 43 ALA H H 43 8.090 8.090 7.864 0.226 25458 540 1 8 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.350 -0.210 25458 541 1 8 . 1 1 3 3 LYS H H 3 8.310 8.310 8.441 -0.131 25458 542 1 8 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.290 -0.090 25458 543 1 8 . 1 1 4 4 LEU H H 4 7.650 7.650 7.741 -0.091 25458 544 1 8 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.145 0.105 25458 545 1 8 . 1 1 5 5 LEU H H 5 7.550 7.550 7.867 -0.317 25458 546 1 8 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.981 0.289 25458 547 1 8 . 1 1 6 6 LEU H H 6 7.860 7.860 7.683 0.177 25458 548 1 8 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.453 0.157 25458 549 1 8 . 1 1 7 7 ASN H H 7 8.030 8.030 7.780 0.250 25458 550 1 8 . 1 1 8 8 GLY H H 8 8.170 8.170 7.519 0.651 25458 551 1 8 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.431 -0.031 25458 552 1 8 . 1 1 9 9 PHE H H 9 8.290 8.290 8.481 -0.191 25458 553 1 8 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.495 0.075 25458 554 1 8 . 1 1 10 10 ASP H H 10 8.630 8.630 8.256 0.374 25458 555 1 8 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.732 -0.112 25458 556 1 8 . 1 1 11 11 ASP H H 11 8.470 8.470 7.539 0.931 25458 557 1 8 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.726 0.134 25458 558 1 8 . 1 1 12 12 VAL H H 12 8.270 8.270 7.554 0.716 25458 559 1 8 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.135 0.225 25458 560 1 8 . 1 1 13 13 HIS H H 13 8.040 8.040 7.506 0.534 25458 561 1 8 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.365 0.085 25458 562 1 8 . 1 1 14 14 PHE H H 14 8.460 8.460 7.373 1.087 25458 563 1 8 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.660 0.470 25458 564 1 8 . 1 1 15 15 LEU H H 15 8.500 8.500 7.438 1.062 25458 565 1 8 . 1 1 16 16 GLY H H 16 8.470 8.470 7.694 0.776 25458 566 1 8 . 1 1 17 17 SER HA H 17 4.290 4.290 4.170 0.120 25458 567 1 8 . 1 1 17 17 SER H H 17 7.990 7.990 7.828 0.162 25458 568 1 8 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.425 0.085 25458 569 1 8 . 1 1 18 18 ASN H H 18 7.810 7.810 7.484 0.326 25458 570 1 8 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.708 0.022 25458 571 1 8 . 1 1 19 19 VAL H H 19 8.200 8.200 8.399 -0.199 25458 572 1 8 . 1 1 20 20 MET HA H 20 4.220 4.220 4.222 -0.002 25458 573 1 8 . 1 1 20 20 MET H H 20 8.130 8.130 7.476 0.654 25458 574 1 8 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.024 0.106 25458 575 1 8 . 1 1 21 21 GLU H H 21 8.130 8.130 7.750 0.381 25458 576 1 8 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.110 -0.050 25458 577 1 8 . 1 1 22 22 GLU H H 22 8.220 8.220 8.120 0.100 25458 578 1 8 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.202 -0.182 25458 579 1 8 . 1 1 23 23 GLN H H 23 8.280 8.280 7.564 0.716 25458 580 1 8 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.506 0.014 25458 581 1 8 . 1 1 24 24 ASP H H 24 8.380 8.380 7.992 0.388 25458 582 1 8 . 1 1 25 25 LEU H H 25 8.300 8.300 7.426 0.874 25458 583 1 8 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.296 -0.196 25458 584 1 8 . 1 1 26 26 ARG H H 26 8.090 8.090 7.611 0.479 25458 585 1 8 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.416 0.144 25458 586 1 8 . 1 1 27 27 ASP H H 27 8.280 8.280 7.961 0.319 25458 587 1 8 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.815 0.075 25458 588 1 8 . 1 1 28 28 ILE H H 28 8.260 8.260 7.389 0.871 25458 589 1 8 . 1 1 29 29 GLY H H 29 8.200 8.200 7.747 0.453 25458 590 1 8 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.466 -0.356 25458 591 1 8 . 1 1 30 30 ILE H H 30 7.960 7.960 7.511 0.449 25458 592 1 8 . 1 1 31 31 SER HA H 31 4.400 4.400 4.572 -0.172 25458 593 1 8 . 1 1 31 31 SER H H 31 7.880 7.880 8.001 -0.121 25458 594 1 8 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.630 0.280 25458 595 1 8 . 1 1 32 32 ASP H H 32 7.960 7.960 7.670 0.290 25458 596 1 8 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.301 0.009 25458 597 1 8 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.974 0.186 25458 598 1 8 . 1 1 34 34 GLN H H 34 8.190 8.190 8.689 -0.499 25458 599 1 8 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.161 0.309 25458 600 1 8 . 1 1 35 35 HIS H H 35 8.050 8.050 7.801 0.249 25458 601 1 8 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.037 0.033 25458 602 1 8 . 1 1 36 36 ARG H H 36 8.230 8.230 8.213 0.017 25458 603 1 8 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.230 -0.160 25458 604 1 8 . 1 1 37 37 ARG H H 37 8.210 8.210 8.088 0.122 25458 605 1 8 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.231 -0.081 25458 606 1 8 . 1 1 38 38 LYS H H 38 7.690 7.690 7.879 -0.189 25458 607 1 8 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.266 -0.096 25458 608 1 8 . 1 1 39 39 LEU H H 39 7.840 7.840 8.368 -0.528 25458 609 1 8 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.016 0.124 25458 610 1 8 . 1 1 40 40 LEU H H 40 8.030 8.030 7.596 0.434 25458 611 1 8 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.059 0.021 25458 612 1 8 . 1 1 41 41 GLN H H 41 8.010 8.010 7.842 0.168 25458 613 1 8 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.317 -0.097 25458 614 1 8 . 1 1 42 42 ALA H H 42 8.030 8.030 7.859 0.171 25458 615 1 8 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.235 0.005 25458 616 1 8 . 1 1 43 43 ALA H H 43 8.090 8.090 7.713 0.377 25458 617 1 9 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.154 -0.014 25458 618 1 9 . 1 1 3 3 LYS H H 3 8.310 8.310 8.463 -0.153 25458 619 1 9 . 1 1 4 4 LEU HA H 4 4.200 4.200 3.992 0.208 25458 620 1 9 . 1 1 4 4 LEU H H 4 7.650 7.650 7.883 -0.233 25458 621 1 9 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.261 -0.011 25458 622 1 9 . 1 1 5 5 LEU H H 5 7.550 7.550 7.955 -0.405 25458 623 1 9 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.990 0.280 25458 624 1 9 . 1 1 6 6 LEU H H 6 7.860 7.860 8.173 -0.313 25458 625 1 9 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.535 0.075 25458 626 1 9 . 1 1 7 7 ASN H H 7 8.030 8.030 8.426 -0.396 25458 627 1 9 . 1 1 8 8 GLY H H 8 8.170 8.170 7.953 0.217 25458 628 1 9 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.354 0.046 25458 629 1 9 . 1 1 9 9 PHE H H 9 8.290 8.290 8.334 -0.044 25458 630 1 9 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.282 0.288 25458 631 1 9 . 1 1 10 10 ASP H H 10 8.630 8.630 7.819 0.811 25458 632 1 9 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.510 0.110 25458 633 1 9 . 1 1 11 11 ASP H H 11 8.470 8.470 8.647 -0.177 25458 634 1 9 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.789 0.071 25458 635 1 9 . 1 1 12 12 VAL H H 12 8.270 8.270 7.310 0.960 25458 636 1 9 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.369 -0.009 25458 637 1 9 . 1 1 13 13 HIS H H 13 8.040 8.040 8.670 -0.630 25458 638 1 9 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.422 0.028 25458 639 1 9 . 1 1 14 14 PHE H H 14 8.460 8.460 7.841 0.619 25458 640 1 9 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.728 0.402 25458 641 1 9 . 1 1 15 15 LEU H H 15 8.500 8.500 7.536 0.964 25458 642 1 9 . 1 1 16 16 GLY H H 16 8.470 8.470 8.112 0.358 25458 643 1 9 . 1 1 17 17 SER HA H 17 4.290 4.290 4.218 0.072 25458 644 1 9 . 1 1 17 17 SER H H 17 7.990 7.990 7.792 0.198 25458 645 1 9 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.554 -0.044 25458 646 1 9 . 1 1 18 18 ASN H H 18 7.810 7.810 7.146 0.664 25458 647 1 9 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.766 -0.036 25458 648 1 9 . 1 1 19 19 VAL H H 19 8.200 8.200 8.409 -0.209 25458 649 1 9 . 1 1 20 20 MET HA H 20 4.220 4.220 4.240 -0.020 25458 650 1 9 . 1 1 20 20 MET H H 20 8.130 8.130 7.653 0.477 25458 651 1 9 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.032 0.098 25458 652 1 9 . 1 1 21 21 GLU H H 21 8.130 8.130 7.747 0.383 25458 653 1 9 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.099 -0.039 25458 654 1 9 . 1 1 22 22 GLU H H 22 8.220 8.220 8.230 -0.010 25458 655 1 9 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.207 -0.187 25458 656 1 9 . 1 1 23 23 GLN H H 23 8.280 8.280 7.472 0.808 25458 657 1 9 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.629 -0.109 25458 658 1 9 . 1 1 24 24 ASP H H 24 8.380 8.380 7.944 0.436 25458 659 1 9 . 1 1 25 25 LEU H H 25 8.300 8.300 7.396 0.904 25458 660 1 9 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.357 -0.257 25458 661 1 9 . 1 1 26 26 ARG H H 26 8.090 8.090 7.733 0.357 25458 662 1 9 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.738 -0.178 25458 663 1 9 . 1 1 27 27 ASP H H 27 8.280 8.280 7.687 0.593 25458 664 1 9 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.743 0.147 25458 665 1 9 . 1 1 28 28 ILE H H 28 8.260 8.260 7.452 0.808 25458 666 1 9 . 1 1 29 29 GLY H H 29 8.200 8.200 7.951 0.249 25458 667 1 9 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.395 -0.285 25458 668 1 9 . 1 1 30 30 ILE H H 30 7.960 7.960 7.563 0.397 25458 669 1 9 . 1 1 31 31 SER HA H 31 4.400 4.400 4.542 -0.142 25458 670 1 9 . 1 1 31 31 SER H H 31 7.880 7.880 7.996 -0.116 25458 671 1 9 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.644 0.266 25458 672 1 9 . 1 1 32 32 ASP H H 32 7.960 7.960 7.602 0.358 25458 673 1 9 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.303 0.007 25458 674 1 9 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.012 0.148 25458 675 1 9 . 1 1 34 34 GLN H H 34 8.190 8.190 8.678 -0.488 25458 676 1 9 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.254 0.216 25458 677 1 9 . 1 1 35 35 HIS H H 35 8.050 8.050 8.175 -0.125 25458 678 1 9 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.048 0.022 25458 679 1 9 . 1 1 36 36 ARG H H 36 8.230 8.230 8.243 -0.013 25458 680 1 9 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.148 -0.078 25458 681 1 9 . 1 1 37 37 ARG H H 37 8.210 8.210 7.852 0.358 25458 682 1 9 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.260 -0.110 25458 683 1 9 . 1 1 38 38 LYS H H 38 7.690 7.690 7.991 -0.301 25458 684 1 9 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.301 -0.131 25458 685 1 9 . 1 1 39 39 LEU H H 39 7.840 7.840 7.993 -0.153 25458 686 1 9 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.035 0.105 25458 687 1 9 . 1 1 40 40 LEU H H 40 8.030 8.030 7.897 0.133 25458 688 1 9 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.057 0.023 25458 689 1 9 . 1 1 41 41 GLN H H 41 8.010 8.010 7.797 0.213 25458 690 1 9 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.330 -0.110 25458 691 1 9 . 1 1 42 42 ALA H H 42 8.030 8.030 7.835 0.195 25458 692 1 9 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.224 0.016 25458 693 1 9 . 1 1 43 43 ALA H H 43 8.090 8.090 7.749 0.341 25458 694 1 10 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.446 -0.306 25458 695 1 10 . 1 1 3 3 LYS H H 3 8.310 8.310 8.527 -0.217 25458 696 1 10 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.229 -0.029 25458 697 1 10 . 1 1 4 4 LEU H H 4 7.650 7.650 7.898 -0.248 25458 698 1 10 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.041 0.209 25458 699 1 10 . 1 1 5 5 LEU H H 5 7.550 7.550 7.712 -0.162 25458 700 1 10 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.875 0.395 25458 701 1 10 . 1 1 6 6 LEU H H 6 7.860 7.860 8.228 -0.368 25458 702 1 10 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.526 0.084 25458 703 1 10 . 1 1 7 7 ASN H H 7 8.030 8.030 8.018 0.012 25458 704 1 10 . 1 1 8 8 GLY H H 8 8.170 8.170 7.786 0.384 25458 705 1 10 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.707 -0.307 25458 706 1 10 . 1 1 9 9 PHE H H 9 8.290 8.290 8.155 0.135 25458 707 1 10 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.328 0.242 25458 708 1 10 . 1 1 10 10 ASP H H 10 8.630 8.630 8.461 0.169 25458 709 1 10 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.555 0.065 25458 710 1 10 . 1 1 11 11 ASP H H 11 8.470 8.470 7.973 0.497 25458 711 1 10 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.837 0.023 25458 712 1 10 . 1 1 12 12 VAL H H 12 8.270 8.270 7.625 0.645 25458 713 1 10 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.387 -0.027 25458 714 1 10 . 1 1 13 13 HIS H H 13 8.040 8.040 8.786 -0.746 25458 715 1 10 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.571 -0.121 25458 716 1 10 . 1 1 14 14 PHE H H 14 8.460 8.460 7.897 0.563 25458 717 1 10 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.866 0.264 25458 718 1 10 . 1 1 15 15 LEU H H 15 8.500 8.500 7.764 0.736 25458 719 1 10 . 1 1 16 16 GLY H H 16 8.470 8.470 8.468 0.002 25458 720 1 10 . 1 1 17 17 SER HA H 17 4.290 4.290 4.185 0.105 25458 721 1 10 . 1 1 17 17 SER H H 17 7.990 7.990 7.361 0.629 25458 722 1 10 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.411 0.099 25458 723 1 10 . 1 1 18 18 ASN H H 18 7.810 7.810 7.921 -0.111 25458 724 1 10 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.966 -0.236 25458 725 1 10 . 1 1 19 19 VAL H H 19 8.200 8.200 8.309 -0.109 25458 726 1 10 . 1 1 20 20 MET HA H 20 4.220 4.220 4.249 -0.029 25458 727 1 10 . 1 1 20 20 MET H H 20 8.130 8.130 7.470 0.660 25458 728 1 10 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.983 0.147 25458 729 1 10 . 1 1 21 21 GLU H H 21 8.130 8.130 7.856 0.274 25458 730 1 10 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.080 -0.020 25458 731 1 10 . 1 1 22 22 GLU H H 22 8.220 8.220 7.986 0.234 25458 732 1 10 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.164 -0.144 25458 733 1 10 . 1 1 23 23 GLN H H 23 8.280 8.280 7.652 0.628 25458 734 1 10 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.493 0.027 25458 735 1 10 . 1 1 24 24 ASP H H 24 8.380 8.380 8.067 0.313 25458 736 1 10 . 1 1 25 25 LEU H H 25 8.300 8.300 7.484 0.816 25458 737 1 10 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.175 -0.075 25458 738 1 10 . 1 1 26 26 ARG H H 26 8.090 8.090 7.518 0.572 25458 739 1 10 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.429 0.131 25458 740 1 10 . 1 1 27 27 ASP H H 27 8.280 8.280 7.829 0.451 25458 741 1 10 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.773 0.117 25458 742 1 10 . 1 1 28 28 ILE H H 28 8.260 8.260 7.449 0.811 25458 743 1 10 . 1 1 29 29 GLY H H 29 8.200 8.200 7.473 0.727 25458 744 1 10 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.456 -0.346 25458 745 1 10 . 1 1 30 30 ILE H H 30 7.960 7.960 7.510 0.450 25458 746 1 10 . 1 1 31 31 SER HA H 31 4.400 4.400 4.599 -0.199 25458 747 1 10 . 1 1 31 31 SER H H 31 7.880 7.880 8.083 -0.203 25458 748 1 10 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.628 0.282 25458 749 1 10 . 1 1 32 32 ASP H H 32 7.960 7.960 7.471 0.489 25458 750 1 10 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.292 0.018 25458 751 1 10 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.013 0.147 25458 752 1 10 . 1 1 34 34 GLN H H 34 8.190 8.190 8.632 -0.442 25458 753 1 10 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.233 0.237 25458 754 1 10 . 1 1 35 35 HIS H H 35 8.050 8.050 8.155 -0.105 25458 755 1 10 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.052 0.018 25458 756 1 10 . 1 1 36 36 ARG H H 36 8.230 8.230 8.269 -0.039 25458 757 1 10 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.138 -0.068 25458 758 1 10 . 1 1 37 37 ARG H H 37 8.210 8.210 7.854 0.356 25458 759 1 10 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.237 -0.087 25458 760 1 10 . 1 1 38 38 LYS H H 38 7.690 7.690 7.970 -0.280 25458 761 1 10 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.243 -0.073 25458 762 1 10 . 1 1 39 39 LEU H H 39 7.840 7.840 8.001 -0.161 25458 763 1 10 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.008 0.132 25458 764 1 10 . 1 1 40 40 LEU H H 40 8.030 8.030 8.013 0.017 25458 765 1 10 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.077 0.003 25458 766 1 10 . 1 1 41 41 GLN H H 41 8.010 8.010 7.792 0.218 25458 767 1 10 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.341 -0.121 25458 768 1 10 . 1 1 42 42 ALA H H 42 8.030 8.030 7.830 0.200 25458 769 1 10 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.239 0.001 25458 770 1 10 . 1 1 43 43 ALA H H 43 8.090 8.090 7.720 0.370 25458 771 1 11 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.219 -0.079 25458 772 1 11 . 1 1 3 3 LYS H H 3 8.310 8.310 8.368 -0.058 25458 773 1 11 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.382 -0.182 25458 774 1 11 . 1 1 4 4 LEU H H 4 7.650 7.650 8.236 -0.586 25458 775 1 11 . 1 1 5 5 LEU HA H 5 4.250 4.250 3.976 0.274 25458 776 1 11 . 1 1 5 5 LEU H H 5 7.550 7.550 7.893 -0.343 25458 777 1 11 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.074 0.196 25458 778 1 11 . 1 1 6 6 LEU H H 6 7.860 7.860 8.136 -0.276 25458 779 1 11 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.436 0.174 25458 780 1 11 . 1 1 7 7 ASN H H 7 8.030 8.030 7.747 0.283 25458 781 1 11 . 1 1 8 8 GLY H H 8 8.170 8.170 7.790 0.380 25458 782 1 11 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.420 -0.020 25458 783 1 11 . 1 1 9 9 PHE H H 9 8.290 8.290 7.985 0.305 25458 784 1 11 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.458 0.112 25458 785 1 11 . 1 1 10 10 ASP H H 10 8.630 8.630 7.998 0.632 25458 786 1 11 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.711 -0.091 25458 787 1 11 . 1 1 11 11 ASP H H 11 8.470 8.470 7.559 0.911 25458 788 1 11 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.727 0.133 25458 789 1 11 . 1 1 12 12 VAL H H 12 8.270 8.270 7.606 0.664 25458 790 1 11 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.130 0.230 25458 791 1 11 . 1 1 13 13 HIS H H 13 8.040 8.040 7.538 0.502 25458 792 1 11 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.392 0.058 25458 793 1 11 . 1 1 14 14 PHE H H 14 8.460 8.460 7.387 1.073 25458 794 1 11 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.668 0.462 25458 795 1 11 . 1 1 15 15 LEU H H 15 8.500 8.500 7.433 1.067 25458 796 1 11 . 1 1 16 16 GLY H H 16 8.470 8.470 7.669 0.801 25458 797 1 11 . 1 1 17 17 SER HA H 17 4.290 4.290 3.981 0.309 25458 798 1 11 . 1 1 17 17 SER H H 17 7.990 7.990 7.956 0.034 25458 799 1 11 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.355 0.155 25458 800 1 11 . 1 1 18 18 ASN H H 18 7.810 7.810 7.312 0.498 25458 801 1 11 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.601 0.129 25458 802 1 11 . 1 1 19 19 VAL H H 19 8.200 8.200 8.350 -0.150 25458 803 1 11 . 1 1 20 20 MET HA H 20 4.220 4.220 4.150 0.070 25458 804 1 11 . 1 1 20 20 MET H H 20 8.130 8.130 7.676 0.454 25458 805 1 11 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.016 0.114 25458 806 1 11 . 1 1 21 21 GLU H H 21 8.130 8.130 8.010 0.120 25458 807 1 11 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.151 -0.091 25458 808 1 11 . 1 1 22 22 GLU H H 22 8.220 8.220 8.074 0.146 25458 809 1 11 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.281 -0.261 25458 810 1 11 . 1 1 23 23 GLN H H 23 8.280 8.280 7.583 0.697 25458 811 1 11 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.493 0.027 25458 812 1 11 . 1 1 24 24 ASP H H 24 8.380 8.380 8.210 0.171 25458 813 1 11 . 1 1 25 25 LEU H H 25 8.300 8.300 7.427 0.873 25458 814 1 11 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.300 -0.200 25458 815 1 11 . 1 1 26 26 ARG H H 26 8.090 8.090 7.420 0.670 25458 816 1 11 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.379 0.181 25458 817 1 11 . 1 1 27 27 ASP H H 27 8.280 8.280 8.369 -0.089 25458 818 1 11 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.716 0.174 25458 819 1 11 . 1 1 28 28 ILE H H 28 8.260 8.260 7.381 0.879 25458 820 1 11 . 1 1 29 29 GLY H H 29 8.200 8.200 8.001 0.199 25458 821 1 11 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.502 -0.392 25458 822 1 11 . 1 1 30 30 ILE H H 30 7.960 7.960 7.666 0.294 25458 823 1 11 . 1 1 31 31 SER HA H 31 4.400 4.400 4.599 -0.199 25458 824 1 11 . 1 1 31 31 SER H H 31 7.880 7.880 7.854 0.026 25458 825 1 11 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.589 0.321 25458 826 1 11 . 1 1 32 32 ASP H H 32 7.960 7.960 8.153 -0.193 25458 827 1 11 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.326 -0.016 25458 828 1 11 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.196 -0.036 25458 829 1 11 . 1 1 34 34 GLN H H 34 8.190 8.190 8.638 -0.448 25458 830 1 11 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.327 0.143 25458 831 1 11 . 1 1 35 35 HIS H H 35 8.050 8.050 7.719 0.331 25458 832 1 11 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.035 0.035 25458 833 1 11 . 1 1 36 36 ARG H H 36 8.230 8.230 8.357 -0.127 25458 834 1 11 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.261 -0.191 25458 835 1 11 . 1 1 37 37 ARG H H 37 8.210 8.210 7.799 0.411 25458 836 1 11 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.308 -0.158 25458 837 1 11 . 1 1 38 38 LYS H H 38 7.690 7.690 7.491 0.199 25458 838 1 11 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.283 -0.113 25458 839 1 11 . 1 1 39 39 LEU H H 39 7.840 7.840 8.007 -0.167 25458 840 1 11 . 1 1 40 40 LEU HA H 40 4.140 4.140 3.963 0.177 25458 841 1 11 . 1 1 40 40 LEU H H 40 8.030 8.030 7.776 0.255 25458 842 1 11 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.062 0.018 25458 843 1 11 . 1 1 41 41 GLN H H 41 8.010 8.010 7.999 0.011 25458 844 1 11 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.299 -0.079 25458 845 1 11 . 1 1 42 42 ALA H H 42 8.030 8.030 7.862 0.168 25458 846 1 11 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.266 -0.026 25458 847 1 11 . 1 1 43 43 ALA H H 43 8.090 8.090 7.722 0.368 25458 848 1 12 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.461 -0.321 25458 849 1 12 . 1 1 3 3 LYS H H 3 8.310 8.310 8.389 -0.079 25458 850 1 12 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.642 -0.442 25458 851 1 12 . 1 1 4 4 LEU H H 4 7.650 7.650 7.831 -0.181 25458 852 1 12 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.232 0.018 25458 853 1 12 . 1 1 5 5 LEU H H 5 7.550 7.550 7.790 -0.240 25458 854 1 12 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.959 0.311 25458 855 1 12 . 1 1 6 6 LEU H H 6 7.860 7.860 8.179 -0.319 25458 856 1 12 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.453 0.157 25458 857 1 12 . 1 1 7 7 ASN H H 7 8.030 8.030 8.686 -0.656 25458 858 1 12 . 1 1 8 8 GLY H H 8 8.170 8.170 7.918 0.252 25458 859 1 12 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.593 -0.193 25458 860 1 12 . 1 1 9 9 PHE H H 9 8.290 8.290 8.040 0.250 25458 861 1 12 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.380 0.190 25458 862 1 12 . 1 1 10 10 ASP H H 10 8.630 8.630 7.807 0.823 25458 863 1 12 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.628 -0.008 25458 864 1 12 . 1 1 11 11 ASP H H 11 8.470 8.470 7.815 0.655 25458 865 1 12 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.773 0.087 25458 866 1 12 . 1 1 12 12 VAL H H 12 8.270 8.270 7.519 0.751 25458 867 1 12 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.147 0.213 25458 868 1 12 . 1 1 13 13 HIS H H 13 8.040 8.040 7.561 0.479 25458 869 1 12 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.420 0.030 25458 870 1 12 . 1 1 14 14 PHE H H 14 8.460 8.460 7.368 1.092 25458 871 1 12 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.918 0.212 25458 872 1 12 . 1 1 15 15 LEU H H 15 8.500 8.500 7.780 0.720 25458 873 1 12 . 1 1 16 16 GLY H H 16 8.470 8.470 7.918 0.552 25458 874 1 12 . 1 1 17 17 SER HA H 17 4.290 4.290 4.257 0.033 25458 875 1 12 . 1 1 17 17 SER H H 17 7.990 7.990 7.430 0.560 25458 876 1 12 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.552 -0.042 25458 877 1 12 . 1 1 18 18 ASN H H 18 7.810 7.810 7.680 0.130 25458 878 1 12 . 1 1 19 19 VAL HA H 19 3.730 3.730 4.013 -0.283 25458 879 1 12 . 1 1 19 19 VAL H H 19 8.200 8.200 8.153 0.047 25458 880 1 12 . 1 1 20 20 MET HA H 20 4.220 4.220 4.245 -0.025 25458 881 1 12 . 1 1 20 20 MET H H 20 8.130 8.130 7.361 0.769 25458 882 1 12 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.995 0.135 25458 883 1 12 . 1 1 21 21 GLU H H 21 8.130 8.130 7.794 0.336 25458 884 1 12 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.003 0.057 25458 885 1 12 . 1 1 22 22 GLU H H 22 8.220 8.220 7.943 0.277 25458 886 1 12 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.122 -0.102 25458 887 1 12 . 1 1 23 23 GLN H H 23 8.280 8.280 7.570 0.710 25458 888 1 12 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.494 0.026 25458 889 1 12 . 1 1 24 24 ASP H H 24 8.380 8.380 8.042 0.338 25458 890 1 12 . 1 1 25 25 LEU H H 25 8.300 8.300 7.480 0.820 25458 891 1 12 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.249 -0.149 25458 892 1 12 . 1 1 26 26 ARG H H 26 8.090 8.090 7.381 0.709 25458 893 1 12 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.447 0.113 25458 894 1 12 . 1 1 27 27 ASP H H 27 8.280 8.280 7.888 0.392 25458 895 1 12 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.731 0.159 25458 896 1 12 . 1 1 28 28 ILE H H 28 8.260 8.260 7.449 0.811 25458 897 1 12 . 1 1 29 29 GLY H H 29 8.200 8.200 7.469 0.731 25458 898 1 12 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.351 -0.241 25458 899 1 12 . 1 1 30 30 ILE H H 30 7.960 7.960 7.510 0.450 25458 900 1 12 . 1 1 31 31 SER HA H 31 4.400 4.400 4.557 -0.157 25458 901 1 12 . 1 1 31 31 SER H H 31 7.880 7.880 8.130 -0.250 25458 902 1 12 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.619 0.291 25458 903 1 12 . 1 1 32 32 ASP H H 32 7.960 7.960 8.070 -0.110 25458 904 1 12 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.300 0.010 25458 905 1 12 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.982 0.178 25458 906 1 12 . 1 1 34 34 GLN H H 34 8.190 8.190 8.750 -0.560 25458 907 1 12 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.178 0.292 25458 908 1 12 . 1 1 35 35 HIS H H 35 8.050 8.050 7.784 0.266 25458 909 1 12 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.044 0.026 25458 910 1 12 . 1 1 36 36 ARG H H 36 8.230 8.230 8.312 -0.082 25458 911 1 12 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.191 -0.121 25458 912 1 12 . 1 1 37 37 ARG H H 37 8.210 8.210 8.112 0.098 25458 913 1 12 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.225 -0.075 25458 914 1 12 . 1 1 38 38 LYS H H 38 7.690 7.690 7.745 -0.055 25458 915 1 12 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.274 -0.104 25458 916 1 12 . 1 1 39 39 LEU H H 39 7.840 7.840 8.162 -0.322 25458 917 1 12 . 1 1 40 40 LEU HA H 40 4.140 4.140 3.900 0.240 25458 918 1 12 . 1 1 40 40 LEU H H 40 8.030 8.030 7.642 0.388 25458 919 1 12 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.042 0.038 25458 920 1 12 . 1 1 41 41 GLN H H 41 8.010 8.010 7.785 0.225 25458 921 1 12 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.311 -0.091 25458 922 1 12 . 1 1 42 42 ALA H H 42 8.030 8.030 7.798 0.232 25458 923 1 12 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.217 0.023 25458 924 1 12 . 1 1 43 43 ALA H H 43 8.090 8.090 7.971 0.119 25458 925 1 13 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.088 0.052 25458 926 1 13 . 1 1 3 3 LYS H H 3 8.310 8.310 8.728 -0.418 25458 927 1 13 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.219 -0.019 25458 928 1 13 . 1 1 4 4 LEU H H 4 7.650 7.650 7.814 -0.164 25458 929 1 13 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.107 0.143 25458 930 1 13 . 1 1 5 5 LEU H H 5 7.550 7.550 7.467 0.083 25458 931 1 13 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.977 0.293 25458 932 1 13 . 1 1 6 6 LEU H H 6 7.860 7.860 7.708 0.152 25458 933 1 13 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.610 0.000 25458 934 1 13 . 1 1 7 7 ASN H H 7 8.030 8.030 7.697 0.333 25458 935 1 13 . 1 1 8 8 GLY H H 8 8.170 8.170 7.438 0.732 25458 936 1 13 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.415 -0.015 25458 937 1 13 . 1 1 9 9 PHE H H 9 8.290 8.290 8.526 -0.236 25458 938 1 13 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.356 0.214 25458 939 1 13 . 1 1 10 10 ASP H H 10 8.630 8.630 7.961 0.669 25458 940 1 13 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.850 -0.230 25458 941 1 13 . 1 1 11 11 ASP H H 11 8.470 8.470 7.856 0.614 25458 942 1 13 . 1 1 12 12 VAL HA H 12 3.860 3.860 4.014 -0.154 25458 943 1 13 . 1 1 12 12 VAL H H 12 8.270 8.270 7.703 0.567 25458 944 1 13 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.351 0.009 25458 945 1 13 . 1 1 13 13 HIS H H 13 8.040 8.040 8.538 -0.498 25458 946 1 13 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.496 -0.046 25458 947 1 13 . 1 1 14 14 PHE H H 14 8.460 8.460 7.669 0.791 25458 948 1 13 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.541 0.589 25458 949 1 13 . 1 1 15 15 LEU H H 15 8.500 8.500 7.077 1.423 25458 950 1 13 . 1 1 16 16 GLY H H 16 8.470 8.470 7.745 0.725 25458 951 1 13 . 1 1 17 17 SER HA H 17 4.290 4.290 4.140 0.150 25458 952 1 13 . 1 1 17 17 SER H H 17 7.990 7.990 7.766 0.224 25458 953 1 13 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.513 -0.003 25458 954 1 13 . 1 1 18 18 ASN H H 18 7.810 7.810 7.240 0.570 25458 955 1 13 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.588 0.142 25458 956 1 13 . 1 1 19 19 VAL H H 19 8.200 8.200 8.388 -0.188 25458 957 1 13 . 1 1 20 20 MET HA H 20 4.220 4.220 4.069 0.151 25458 958 1 13 . 1 1 20 20 MET H H 20 8.130 8.130 7.473 0.657 25458 959 1 13 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.991 0.139 25458 960 1 13 . 1 1 21 21 GLU H H 21 8.130 8.130 7.815 0.315 25458 961 1 13 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.102 -0.042 25458 962 1 13 . 1 1 22 22 GLU H H 22 8.220 8.220 8.089 0.131 25458 963 1 13 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.145 -0.125 25458 964 1 13 . 1 1 23 23 GLN H H 23 8.280 8.280 7.730 0.550 25458 965 1 13 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.519 0.001 25458 966 1 13 . 1 1 24 24 ASP H H 24 8.380 8.380 8.243 0.137 25458 967 1 13 . 1 1 25 25 LEU H H 25 8.300 8.300 7.692 0.608 25458 968 1 13 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.272 -0.172 25458 969 1 13 . 1 1 26 26 ARG H H 26 8.090 8.090 7.392 0.698 25458 970 1 13 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.381 0.179 25458 971 1 13 . 1 1 27 27 ASP H H 27 8.280 8.280 8.088 0.192 25458 972 1 13 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.775 0.115 25458 973 1 13 . 1 1 28 28 ILE H H 28 8.260 8.260 7.491 0.769 25458 974 1 13 . 1 1 29 29 GLY H H 29 8.200 8.200 7.688 0.512 25458 975 1 13 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.396 -0.286 25458 976 1 13 . 1 1 30 30 ILE H H 30 7.960 7.960 7.548 0.412 25458 977 1 13 . 1 1 31 31 SER HA H 31 4.400 4.400 4.562 -0.162 25458 978 1 13 . 1 1 31 31 SER H H 31 7.880 7.880 8.079 -0.199 25458 979 1 13 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.669 0.241 25458 980 1 13 . 1 1 32 32 ASP H H 32 7.960 7.960 7.494 0.466 25458 981 1 13 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.307 0.003 25458 982 1 13 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.005 0.155 25458 983 1 13 . 1 1 34 34 GLN H H 34 8.190 8.190 8.617 -0.427 25458 984 1 13 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.229 0.241 25458 985 1 13 . 1 1 35 35 HIS H H 35 8.050 8.050 8.127 -0.077 25458 986 1 13 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.086 -0.016 25458 987 1 13 . 1 1 36 36 ARG H H 36 8.230 8.230 8.065 0.165 25458 988 1 13 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.168 -0.098 25458 989 1 13 . 1 1 37 37 ARG H H 37 8.210 8.210 7.629 0.581 25458 990 1 13 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.235 -0.085 25458 991 1 13 . 1 1 38 38 LYS H H 38 7.690 7.690 8.092 -0.402 25458 992 1 13 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.280 -0.110 25458 993 1 13 . 1 1 39 39 LEU H H 39 7.840 7.840 8.057 -0.217 25458 994 1 13 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.047 0.093 25458 995 1 13 . 1 1 40 40 LEU H H 40 8.030 8.030 7.788 0.242 25458 996 1 13 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.095 -0.015 25458 997 1 13 . 1 1 41 41 GLN H H 41 8.010 8.010 7.794 0.216 25458 998 1 13 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.296 -0.076 25458 999 1 13 . 1 1 42 42 ALA H H 42 8.030 8.030 7.839 0.191 25458 1000 1 13 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.230 0.010 25458 1001 1 13 . 1 1 43 43 ALA H H 43 8.090 8.090 7.703 0.387 25458 1002 1 14 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.520 -0.380 25458 1003 1 14 . 1 1 3 3 LYS H H 3 8.310 8.310 8.373 -0.063 25458 1004 1 14 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.526 -0.326 25458 1005 1 14 . 1 1 4 4 LEU H H 4 7.650 7.650 7.914 -0.264 25458 1006 1 14 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.039 0.211 25458 1007 1 14 . 1 1 5 5 LEU H H 5 7.550 7.550 8.164 -0.614 25458 1008 1 14 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.023 0.247 25458 1009 1 14 . 1 1 6 6 LEU H H 6 7.860 7.860 7.997 -0.137 25458 1010 1 14 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.669 -0.059 25458 1011 1 14 . 1 1 7 7 ASN H H 7 8.030 8.030 8.088 -0.058 25458 1012 1 14 . 1 1 8 8 GLY H H 8 8.170 8.170 7.492 0.678 25458 1013 1 14 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.466 -0.066 25458 1014 1 14 . 1 1 9 9 PHE H H 9 8.290 8.290 8.746 -0.456 25458 1015 1 14 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.239 0.331 25458 1016 1 14 . 1 1 10 10 ASP H H 10 8.630 8.630 7.842 0.788 25458 1017 1 14 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.500 0.120 25458 1018 1 14 . 1 1 11 11 ASP H H 11 8.470 8.470 8.595 -0.125 25458 1019 1 14 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.664 0.196 25458 1020 1 14 . 1 1 12 12 VAL H H 12 8.270 8.270 7.420 0.850 25458 1021 1 14 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.068 0.292 25458 1022 1 14 . 1 1 13 13 HIS H H 13 8.040 8.040 8.291 -0.251 25458 1023 1 14 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.410 0.040 25458 1024 1 14 . 1 1 14 14 PHE H H 14 8.460 8.460 7.652 0.808 25458 1025 1 14 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.707 0.423 25458 1026 1 14 . 1 1 15 15 LEU H H 15 8.500 8.500 7.519 0.981 25458 1027 1 14 . 1 1 16 16 GLY H H 16 8.470 8.470 7.861 0.609 25458 1028 1 14 . 1 1 17 17 SER HA H 17 4.290 4.290 4.020 0.270 25458 1029 1 14 . 1 1 17 17 SER H H 17 7.990 7.990 7.991 -0.001 25458 1030 1 14 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.287 0.223 25458 1031 1 14 . 1 1 18 18 ASN H H 18 7.810 7.810 7.385 0.425 25458 1032 1 14 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.560 0.170 25458 1033 1 14 . 1 1 19 19 VAL H H 19 8.200 8.200 8.445 -0.245 25458 1034 1 14 . 1 1 20 20 MET HA H 20 4.220 4.220 4.089 0.131 25458 1035 1 14 . 1 1 20 20 MET H H 20 8.130 8.130 7.575 0.555 25458 1036 1 14 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.043 0.087 25458 1037 1 14 . 1 1 21 21 GLU H H 21 8.130 8.130 7.846 0.284 25458 1038 1 14 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.148 -0.088 25458 1039 1 14 . 1 1 22 22 GLU H H 22 8.220 8.220 8.160 0.060 25458 1040 1 14 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.203 -0.183 25458 1041 1 14 . 1 1 23 23 GLN H H 23 8.280 8.280 7.758 0.522 25458 1042 1 14 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.489 0.031 25458 1043 1 14 . 1 1 24 24 ASP H H 24 8.380 8.380 8.188 0.192 25458 1044 1 14 . 1 1 25 25 LEU H H 25 8.300 8.300 7.456 0.844 25458 1045 1 14 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.302 -0.202 25458 1046 1 14 . 1 1 26 26 ARG H H 26 8.090 8.090 7.338 0.752 25458 1047 1 14 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.410 0.150 25458 1048 1 14 . 1 1 27 27 ASP H H 27 8.280 8.280 8.300 -0.020 25458 1049 1 14 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.828 0.062 25458 1050 1 14 . 1 1 28 28 ILE H H 28 8.260 8.260 7.441 0.819 25458 1051 1 14 . 1 1 29 29 GLY H H 29 8.200 8.200 7.935 0.265 25458 1052 1 14 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.453 -0.343 25458 1053 1 14 . 1 1 30 30 ILE H H 30 7.960 7.960 7.561 0.399 25458 1054 1 14 . 1 1 31 31 SER HA H 31 4.400 4.400 4.565 -0.165 25458 1055 1 14 . 1 1 31 31 SER H H 31 7.880 7.880 7.854 0.026 25458 1056 1 14 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.633 0.277 25458 1057 1 14 . 1 1 32 32 ASP H H 32 7.960 7.960 8.107 -0.147 25458 1058 1 14 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.321 -0.011 25458 1059 1 14 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.041 0.119 25458 1060 1 14 . 1 1 34 34 GLN H H 34 8.190 8.190 8.862 -0.672 25458 1061 1 14 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.241 0.229 25458 1062 1 14 . 1 1 35 35 HIS H H 35 8.050 8.050 7.757 0.293 25458 1063 1 14 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.119 -0.049 25458 1064 1 14 . 1 1 36 36 ARG H H 36 8.230 8.230 8.376 -0.146 25458 1065 1 14 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.163 -0.093 25458 1066 1 14 . 1 1 37 37 ARG H H 37 8.210 8.210 7.989 0.221 25458 1067 1 14 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.254 -0.104 25458 1068 1 14 . 1 1 38 38 LYS H H 38 7.690 7.690 7.787 -0.097 25458 1069 1 14 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.225 -0.055 25458 1070 1 14 . 1 1 39 39 LEU H H 39 7.840 7.840 7.738 0.102 25458 1071 1 14 . 1 1 40 40 LEU HA H 40 4.140 4.140 3.959 0.181 25458 1072 1 14 . 1 1 40 40 LEU H H 40 8.030 8.030 7.680 0.350 25458 1073 1 14 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.032 0.049 25458 1074 1 14 . 1 1 41 41 GLN H H 41 8.010 8.010 7.891 0.119 25458 1075 1 14 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.326 -0.106 25458 1076 1 14 . 1 1 42 42 ALA H H 42 8.030 8.030 7.800 0.230 25458 1077 1 14 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.226 0.014 25458 1078 1 14 . 1 1 43 43 ALA H H 43 8.090 8.090 7.806 0.284 25458 1079 1 15 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.130 0.010 25458 1080 1 15 . 1 1 3 3 LYS H H 3 8.310 8.310 8.454 -0.144 25458 1081 1 15 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.030 0.170 25458 1082 1 15 . 1 1 4 4 LEU H H 4 7.650 7.650 8.195 -0.545 25458 1083 1 15 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.332 -0.082 25458 1084 1 15 . 1 1 5 5 LEU H H 5 7.550 7.550 7.870 -0.320 25458 1085 1 15 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.087 0.183 25458 1086 1 15 . 1 1 6 6 LEU H H 6 7.860 7.860 8.363 -0.503 25458 1087 1 15 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.553 0.057 25458 1088 1 15 . 1 1 7 7 ASN H H 7 8.030 8.030 8.633 -0.603 25458 1089 1 15 . 1 1 8 8 GLY H H 8 8.170 8.170 7.383 0.787 25458 1090 1 15 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.504 -0.104 25458 1091 1 15 . 1 1 9 9 PHE H H 9 8.290 8.290 8.549 -0.259 25458 1092 1 15 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.516 0.054 25458 1093 1 15 . 1 1 10 10 ASP H H 10 8.630 8.630 7.914 0.716 25458 1094 1 15 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.682 -0.062 25458 1095 1 15 . 1 1 11 11 ASP H H 11 8.470 8.470 7.522 0.948 25458 1096 1 15 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.735 0.125 25458 1097 1 15 . 1 1 12 12 VAL H H 12 8.270 8.270 7.535 0.735 25458 1098 1 15 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.139 0.221 25458 1099 1 15 . 1 1 13 13 HIS H H 13 8.040 8.040 7.497 0.543 25458 1100 1 15 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.462 -0.012 25458 1101 1 15 . 1 1 14 14 PHE H H 14 8.460 8.460 7.330 1.130 25458 1102 1 15 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.698 0.432 25458 1103 1 15 . 1 1 15 15 LEU H H 15 8.500 8.500 7.607 0.893 25458 1104 1 15 . 1 1 16 16 GLY H H 16 8.470 8.470 7.772 0.698 25458 1105 1 15 . 1 1 17 17 SER HA H 17 4.290 4.290 3.915 0.375 25458 1106 1 15 . 1 1 17 17 SER H H 17 7.990 7.990 7.829 0.161 25458 1107 1 15 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.339 0.171 25458 1108 1 15 . 1 1 18 18 ASN H H 18 7.810 7.810 7.366 0.444 25458 1109 1 15 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.869 -0.139 25458 1110 1 15 . 1 1 19 19 VAL H H 19 8.200 8.200 8.459 -0.259 25458 1111 1 15 . 1 1 20 20 MET HA H 20 4.220 4.220 4.204 0.016 25458 1112 1 15 . 1 1 20 20 MET H H 20 8.130 8.130 7.731 0.399 25458 1113 1 15 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.005 0.125 25458 1114 1 15 . 1 1 21 21 GLU H H 21 8.130 8.130 8.035 0.095 25458 1115 1 15 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.103 -0.043 25458 1116 1 15 . 1 1 22 22 GLU H H 22 8.220 8.220 8.333 -0.113 25458 1117 1 15 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.191 -0.171 25458 1118 1 15 . 1 1 23 23 GLN H H 23 8.280 8.280 7.471 0.809 25458 1119 1 15 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.490 0.030 25458 1120 1 15 . 1 1 24 24 ASP H H 24 8.380 8.380 8.193 0.187 25458 1121 1 15 . 1 1 25 25 LEU H H 25 8.300 8.300 7.441 0.859 25458 1122 1 15 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.300 -0.200 25458 1123 1 15 . 1 1 26 26 ARG H H 26 8.090 8.090 7.467 0.623 25458 1124 1 15 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.434 0.126 25458 1125 1 15 . 1 1 27 27 ASP H H 27 8.280 8.280 8.078 0.202 25458 1126 1 15 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.694 0.196 25458 1127 1 15 . 1 1 28 28 ILE H H 28 8.260 8.260 7.413 0.847 25458 1128 1 15 . 1 1 29 29 GLY H H 29 8.200 8.200 7.613 0.587 25458 1129 1 15 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.392 -0.282 25458 1130 1 15 . 1 1 30 30 ILE H H 30 7.960 7.960 7.510 0.450 25458 1131 1 15 . 1 1 31 31 SER HA H 31 4.400 4.400 4.599 -0.199 25458 1132 1 15 . 1 1 31 31 SER H H 31 7.880 7.880 7.947 -0.067 25458 1133 1 15 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.601 0.309 25458 1134 1 15 . 1 1 32 32 ASP H H 32 7.960 7.960 8.046 -0.086 25458 1135 1 15 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.286 0.024 25458 1136 1 15 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.037 0.123 25458 1137 1 15 . 1 1 34 34 GLN H H 34 8.190 8.190 8.906 -0.716 25458 1138 1 15 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.252 0.218 25458 1139 1 15 . 1 1 35 35 HIS H H 35 8.050 8.050 7.392 0.658 25458 1140 1 15 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.047 0.023 25458 1141 1 15 . 1 1 36 36 ARG H H 36 8.230 8.230 8.024 0.206 25458 1142 1 15 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.235 -0.165 25458 1143 1 15 . 1 1 37 37 ARG H H 37 8.210 8.210 7.713 0.497 25458 1144 1 15 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.250 -0.100 25458 1145 1 15 . 1 1 38 38 LYS H H 38 7.690 7.690 7.904 -0.214 25458 1146 1 15 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.331 -0.161 25458 1147 1 15 . 1 1 39 39 LEU H H 39 7.840 7.840 8.310 -0.470 25458 1148 1 15 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.050 0.090 25458 1149 1 15 . 1 1 40 40 LEU H H 40 8.030 8.030 7.537 0.493 25458 1150 1 15 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.094 -0.014 25458 1151 1 15 . 1 1 41 41 GLN H H 41 8.010 8.010 7.856 0.154 25458 1152 1 15 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.335 -0.115 25458 1153 1 15 . 1 1 42 42 ALA H H 42 8.030 8.030 7.897 0.133 25458 1154 1 15 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.218 0.022 25458 1155 1 15 . 1 1 43 43 ALA H H 43 8.090 8.090 7.753 0.337 25458 1156 1 16 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.467 -0.327 25458 1157 1 16 . 1 1 3 3 LYS H H 3 8.310 8.310 8.275 0.035 25458 1158 1 16 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.079 0.121 25458 1159 1 16 . 1 1 4 4 LEU H H 4 7.650 7.650 7.713 -0.063 25458 1160 1 16 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.156 0.094 25458 1161 1 16 . 1 1 5 5 LEU H H 5 7.550 7.550 8.081 -0.531 25458 1162 1 16 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.322 -0.052 25458 1163 1 16 . 1 1 6 6 LEU H H 6 7.860 7.860 7.965 -0.105 25458 1164 1 16 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.563 0.047 25458 1165 1 16 . 1 1 7 7 ASN H H 7 8.030 8.030 8.522 -0.492 25458 1166 1 16 . 1 1 8 8 GLY H H 8 8.170 8.170 7.703 0.467 25458 1167 1 16 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.488 -0.088 25458 1168 1 16 . 1 1 9 9 PHE H H 9 8.290 8.290 7.856 0.434 25458 1169 1 16 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.428 0.142 25458 1170 1 16 . 1 1 10 10 ASP H H 10 8.630 8.630 7.863 0.767 25458 1171 1 16 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.744 -0.124 25458 1172 1 16 . 1 1 11 11 ASP H H 11 8.470 8.470 7.544 0.926 25458 1173 1 16 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.707 0.153 25458 1174 1 16 . 1 1 12 12 VAL H H 12 8.270 8.270 7.644 0.626 25458 1175 1 16 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.145 0.215 25458 1176 1 16 . 1 1 13 13 HIS H H 13 8.040 8.040 7.533 0.507 25458 1177 1 16 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.495 -0.045 25458 1178 1 16 . 1 1 14 14 PHE H H 14 8.460 8.460 7.372 1.088 25458 1179 1 16 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.747 0.383 25458 1180 1 16 . 1 1 15 15 LEU H H 15 8.500 8.500 7.467 1.033 25458 1181 1 16 . 1 1 16 16 GLY H H 16 8.470 8.470 7.804 0.666 25458 1182 1 16 . 1 1 17 17 SER HA H 17 4.290 4.290 3.969 0.321 25458 1183 1 16 . 1 1 17 17 SER H H 17 7.990 7.990 7.859 0.131 25458 1184 1 16 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.474 0.036 25458 1185 1 16 . 1 1 18 18 ASN H H 18 7.810 7.810 7.217 0.593 25458 1186 1 16 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.736 -0.006 25458 1187 1 16 . 1 1 19 19 VAL H H 19 8.200 8.200 8.238 -0.038 25458 1188 1 16 . 1 1 20 20 MET HA H 20 4.220 4.220 4.199 0.021 25458 1189 1 16 . 1 1 20 20 MET H H 20 8.130 8.130 7.866 0.264 25458 1190 1 16 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.039 0.091 25458 1191 1 16 . 1 1 21 21 GLU H H 21 8.130 8.130 7.783 0.347 25458 1192 1 16 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.095 -0.035 25458 1193 1 16 . 1 1 22 22 GLU H H 22 8.220 8.220 8.028 0.192 25458 1194 1 16 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.197 -0.177 25458 1195 1 16 . 1 1 23 23 GLN H H 23 8.280 8.280 7.513 0.767 25458 1196 1 16 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.603 -0.083 25458 1197 1 16 . 1 1 24 24 ASP H H 24 8.380 8.380 8.061 0.319 25458 1198 1 16 . 1 1 25 25 LEU H H 25 8.300 8.300 7.364 0.936 25458 1199 1 16 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.226 -0.126 25458 1200 1 16 . 1 1 26 26 ARG H H 26 8.090 8.090 7.523 0.567 25458 1201 1 16 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.476 0.084 25458 1202 1 16 . 1 1 27 27 ASP H H 27 8.280 8.280 7.883 0.397 25458 1203 1 16 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.871 0.019 25458 1204 1 16 . 1 1 28 28 ILE H H 28 8.260 8.260 7.635 0.625 25458 1205 1 16 . 1 1 29 29 GLY H H 29 8.200 8.200 7.493 0.707 25458 1206 1 16 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.524 -0.414 25458 1207 1 16 . 1 1 30 30 ILE H H 30 7.960 7.960 7.333 0.627 25458 1208 1 16 . 1 1 31 31 SER HA H 31 4.400 4.400 4.563 -0.163 25458 1209 1 16 . 1 1 31 31 SER H H 31 7.880 7.880 8.182 -0.302 25458 1210 1 16 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.669 0.241 25458 1211 1 16 . 1 1 32 32 ASP H H 32 7.960 7.960 8.115 -0.155 25458 1212 1 16 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.331 -0.021 25458 1213 1 16 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.044 0.116 25458 1214 1 16 . 1 1 34 34 GLN H H 34 8.190 8.190 8.859 -0.669 25458 1215 1 16 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.142 0.328 25458 1216 1 16 . 1 1 35 35 HIS H H 35 8.050 8.050 7.761 0.289 25458 1217 1 16 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.039 0.031 25458 1218 1 16 . 1 1 36 36 ARG H H 36 8.230 8.230 8.512 -0.282 25458 1219 1 16 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.161 -0.091 25458 1220 1 16 . 1 1 37 37 ARG H H 37 8.210 8.210 7.879 0.331 25458 1221 1 16 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.236 -0.086 25458 1222 1 16 . 1 1 38 38 LYS H H 38 7.690 7.690 7.592 0.098 25458 1223 1 16 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.361 -0.191 25458 1224 1 16 . 1 1 39 39 LEU H H 39 7.840 7.840 8.071 -0.231 25458 1225 1 16 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.144 -0.004 25458 1226 1 16 . 1 1 40 40 LEU H H 40 8.030 8.030 8.353 -0.323 25458 1227 1 16 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.165 -0.085 25458 1228 1 16 . 1 1 41 41 GLN H H 41 8.010 8.010 7.815 0.195 25458 1229 1 16 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.388 -0.168 25458 1230 1 16 . 1 1 42 42 ALA H H 42 8.030 8.030 7.997 0.033 25458 1231 1 16 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.210 0.030 25458 1232 1 16 . 1 1 43 43 ALA H H 43 8.090 8.090 7.827 0.263 25458 1233 1 17 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.434 -0.294 25458 1234 1 17 . 1 1 3 3 LYS H H 3 8.310 8.310 7.953 0.357 25458 1235 1 17 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.049 0.151 25458 1236 1 17 . 1 1 4 4 LEU H H 4 7.650 7.650 7.812 -0.162 25458 1237 1 17 . 1 1 5 5 LEU HA H 5 4.250 4.250 3.902 0.348 25458 1238 1 17 . 1 1 5 5 LEU H H 5 7.550 7.550 8.240 -0.690 25458 1239 1 17 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.347 -0.077 25458 1240 1 17 . 1 1 6 6 LEU H H 6 7.860 7.860 8.049 -0.189 25458 1241 1 17 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.518 0.092 25458 1242 1 17 . 1 1 7 7 ASN H H 7 8.030 8.030 8.438 -0.408 25458 1243 1 17 . 1 1 8 8 GLY H H 8 8.170 8.170 8.371 -0.201 25458 1244 1 17 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.441 -0.042 25458 1245 1 17 . 1 1 9 9 PHE H H 9 8.290 8.290 8.358 -0.068 25458 1246 1 17 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.412 0.158 25458 1247 1 17 . 1 1 10 10 ASP H H 10 8.630 8.630 7.913 0.717 25458 1248 1 17 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.640 -0.020 25458 1249 1 17 . 1 1 11 11 ASP H H 11 8.470 8.470 7.641 0.829 25458 1250 1 17 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.692 0.168 25458 1251 1 17 . 1 1 12 12 VAL H H 12 8.270 8.270 7.412 0.858 25458 1252 1 17 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.251 0.109 25458 1253 1 17 . 1 1 13 13 HIS H H 13 8.040 8.040 7.523 0.517 25458 1254 1 17 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.552 -0.102 25458 1255 1 17 . 1 1 14 14 PHE H H 14 8.460 8.460 7.816 0.644 25458 1256 1 17 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.793 0.337 25458 1257 1 17 . 1 1 15 15 LEU H H 15 8.500 8.500 8.132 0.368 25458 1258 1 17 . 1 1 16 16 GLY H H 16 8.470 8.470 7.835 0.635 25458 1259 1 17 . 1 1 17 17 SER HA H 17 4.290 4.290 4.197 0.093 25458 1260 1 17 . 1 1 17 17 SER H H 17 7.990 7.990 7.945 0.045 25458 1261 1 17 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.354 0.156 25458 1262 1 17 . 1 1 18 18 ASN H H 18 7.810 7.810 7.665 0.145 25458 1263 1 17 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.620 0.110 25458 1264 1 17 . 1 1 19 19 VAL H H 19 8.200 8.200 8.271 -0.071 25458 1265 1 17 . 1 1 20 20 MET HA H 20 4.220 4.220 4.171 0.049 25458 1266 1 17 . 1 1 20 20 MET H H 20 8.130 8.130 7.465 0.665 25458 1267 1 17 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.033 0.097 25458 1268 1 17 . 1 1 21 21 GLU H H 21 8.130 8.130 7.892 0.238 25458 1269 1 17 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.112 -0.052 25458 1270 1 17 . 1 1 22 22 GLU H H 22 8.220 8.220 8.008 0.212 25458 1271 1 17 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.229 -0.209 25458 1272 1 17 . 1 1 23 23 GLN H H 23 8.280 8.280 7.671 0.609 25458 1273 1 17 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.520 -0.000 25458 1274 1 17 . 1 1 24 24 ASP H H 24 8.380 8.380 8.070 0.310 25458 1275 1 17 . 1 1 25 25 LEU H H 25 8.300 8.300 7.461 0.839 25458 1276 1 17 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.237 -0.137 25458 1277 1 17 . 1 1 26 26 ARG H H 26 8.090 8.090 7.472 0.618 25458 1278 1 17 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.465 0.095 25458 1279 1 17 . 1 1 27 27 ASP H H 27 8.280 8.280 7.891 0.389 25458 1280 1 17 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.791 0.099 25458 1281 1 17 . 1 1 28 28 ILE H H 28 8.260 8.260 7.434 0.826 25458 1282 1 17 . 1 1 29 29 GLY H H 29 8.200 8.200 7.569 0.631 25458 1283 1 17 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.515 -0.405 25458 1284 1 17 . 1 1 30 30 ILE H H 30 7.960 7.960 7.627 0.333 25458 1285 1 17 . 1 1 31 31 SER HA H 31 4.400 4.400 4.618 -0.218 25458 1286 1 17 . 1 1 31 31 SER H H 31 7.880 7.880 8.272 -0.392 25458 1287 1 17 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.605 0.305 25458 1288 1 17 . 1 1 32 32 ASP H H 32 7.960 7.960 8.061 -0.101 25458 1289 1 17 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.309 0.001 25458 1290 1 17 . 1 1 34 34 GLN HA H 34 4.160 4.160 3.967 0.193 25458 1291 1 17 . 1 1 34 34 GLN H H 34 8.190 8.190 8.726 -0.536 25458 1292 1 17 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.119 0.351 25458 1293 1 17 . 1 1 35 35 HIS H H 35 8.050 8.050 7.832 0.218 25458 1294 1 17 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.034 0.036 25458 1295 1 17 . 1 1 36 36 ARG H H 36 8.230 8.230 8.315 -0.085 25458 1296 1 17 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.168 -0.098 25458 1297 1 17 . 1 1 37 37 ARG H H 37 8.210 8.210 8.112 0.098 25458 1298 1 17 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.219 -0.069 25458 1299 1 17 . 1 1 38 38 LYS H H 38 7.690 7.690 7.748 -0.058 25458 1300 1 17 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.324 -0.154 25458 1301 1 17 . 1 1 39 39 LEU H H 39 7.840 7.840 8.263 -0.423 25458 1302 1 17 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.017 0.123 25458 1303 1 17 . 1 1 40 40 LEU H H 40 8.030 8.030 7.649 0.381 25458 1304 1 17 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.084 -0.004 25458 1305 1 17 . 1 1 41 41 GLN H H 41 8.010 8.010 7.850 0.160 25458 1306 1 17 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.305 -0.085 25458 1307 1 17 . 1 1 42 42 ALA H H 42 8.030 8.030 7.828 0.202 25458 1308 1 17 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.129 0.111 25458 1309 1 17 . 1 1 43 43 ALA H H 43 8.090 8.090 7.783 0.307 25458 1310 1 18 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.190 -0.050 25458 1311 1 18 . 1 1 3 3 LYS H H 3 8.310 8.310 7.936 0.374 25458 1312 1 18 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.155 0.045 25458 1313 1 18 . 1 1 4 4 LEU H H 4 7.650 7.650 7.820 -0.170 25458 1314 1 18 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.203 0.047 25458 1315 1 18 . 1 1 5 5 LEU H H 5 7.550 7.550 7.990 -0.440 25458 1316 1 18 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.039 0.231 25458 1317 1 18 . 1 1 6 6 LEU H H 6 7.860 7.860 8.254 -0.394 25458 1318 1 18 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.453 0.157 25458 1319 1 18 . 1 1 7 7 ASN H H 7 8.030 8.030 8.552 -0.522 25458 1320 1 18 . 1 1 8 8 GLY H H 8 8.170 8.170 7.476 0.694 25458 1321 1 18 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.492 -0.092 25458 1322 1 18 . 1 1 9 9 PHE H H 9 8.290 8.290 8.377 -0.087 25458 1323 1 18 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.571 -0.001 25458 1324 1 18 . 1 1 10 10 ASP H H 10 8.630 8.630 7.852 0.778 25458 1325 1 18 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.962 -0.342 25458 1326 1 18 . 1 1 11 11 ASP H H 11 8.470 8.470 7.690 0.780 25458 1327 1 18 . 1 1 12 12 VAL HA H 12 3.860 3.860 4.025 -0.165 25458 1328 1 18 . 1 1 12 12 VAL H H 12 8.270 8.270 7.464 0.806 25458 1329 1 18 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.261 0.099 25458 1330 1 18 . 1 1 13 13 HIS H H 13 8.040 8.040 7.634 0.406 25458 1331 1 18 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.531 -0.081 25458 1332 1 18 . 1 1 14 14 PHE H H 14 8.460 8.460 7.759 0.701 25458 1333 1 18 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.288 0.842 25458 1334 1 18 . 1 1 15 15 LEU H H 15 8.500 8.500 7.501 0.999 25458 1335 1 18 . 1 1 16 16 GLY H H 16 8.470 8.470 7.962 0.508 25458 1336 1 18 . 1 1 17 17 SER HA H 17 4.290 4.290 4.029 0.261 25458 1337 1 18 . 1 1 17 17 SER H H 17 7.990 7.990 7.929 0.061 25458 1338 1 18 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.540 -0.030 25458 1339 1 18 . 1 1 18 18 ASN H H 18 7.810 7.810 7.696 0.114 25458 1340 1 18 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.612 0.118 25458 1341 1 18 . 1 1 19 19 VAL H H 19 8.200 8.200 8.126 0.074 25458 1342 1 18 . 1 1 20 20 MET HA H 20 4.220 4.220 4.221 -0.001 25458 1343 1 18 . 1 1 20 20 MET H H 20 8.130 8.130 7.665 0.465 25458 1344 1 18 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.033 0.097 25458 1345 1 18 . 1 1 21 21 GLU H H 21 8.130 8.130 8.193 -0.063 25458 1346 1 18 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.149 -0.089 25458 1347 1 18 . 1 1 22 22 GLU H H 22 8.220 8.220 8.288 -0.068 25458 1348 1 18 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.210 -0.190 25458 1349 1 18 . 1 1 23 23 GLN H H 23 8.280 8.280 7.661 0.619 25458 1350 1 18 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.497 0.023 25458 1351 1 18 . 1 1 24 24 ASP H H 24 8.380 8.380 8.139 0.241 25458 1352 1 18 . 1 1 25 25 LEU H H 25 8.300 8.300 7.383 0.917 25458 1353 1 18 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.260 -0.160 25458 1354 1 18 . 1 1 26 26 ARG H H 26 8.090 8.090 7.584 0.506 25458 1355 1 18 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.428 0.132 25458 1356 1 18 . 1 1 27 27 ASP H H 27 8.280 8.280 8.082 0.198 25458 1357 1 18 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.815 0.075 25458 1358 1 18 . 1 1 28 28 ILE H H 28 8.260 8.260 7.453 0.807 25458 1359 1 18 . 1 1 29 29 GLY H H 29 8.200 8.200 7.656 0.544 25458 1360 1 18 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.349 -0.239 25458 1361 1 18 . 1 1 30 30 ILE H H 30 7.960 7.960 7.561 0.399 25458 1362 1 18 . 1 1 31 31 SER HA H 31 4.400 4.400 4.586 -0.186 25458 1363 1 18 . 1 1 31 31 SER H H 31 7.880 7.880 7.985 -0.105 25458 1364 1 18 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.596 0.314 25458 1365 1 18 . 1 1 32 32 ASP H H 32 7.960 7.960 7.601 0.359 25458 1366 1 18 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.286 0.024 25458 1367 1 18 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.029 0.131 25458 1368 1 18 . 1 1 34 34 GLN H H 34 8.190 8.190 8.906 -0.716 25458 1369 1 18 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.245 0.225 25458 1370 1 18 . 1 1 35 35 HIS H H 35 8.050 8.050 7.438 0.612 25458 1371 1 18 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.019 0.051 25458 1372 1 18 . 1 1 36 36 ARG H H 36 8.230 8.230 8.047 0.183 25458 1373 1 18 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.250 -0.180 25458 1374 1 18 . 1 1 37 37 ARG H H 37 8.210 8.210 7.730 0.480 25458 1375 1 18 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.256 -0.106 25458 1376 1 18 . 1 1 38 38 LYS H H 38 7.690 7.690 8.009 -0.319 25458 1377 1 18 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.315 -0.145 25458 1378 1 18 . 1 1 39 39 LEU H H 39 7.840 7.840 8.365 -0.525 25458 1379 1 18 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.051 0.089 25458 1380 1 18 . 1 1 40 40 LEU H H 40 8.030 8.030 7.616 0.414 25458 1381 1 18 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.104 -0.024 25458 1382 1 18 . 1 1 41 41 GLN H H 41 8.010 8.010 7.762 0.248 25458 1383 1 18 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.390 -0.170 25458 1384 1 18 . 1 1 42 42 ALA H H 42 8.030 8.030 7.891 0.139 25458 1385 1 18 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.210 0.030 25458 1386 1 18 . 1 1 43 43 ALA H H 43 8.090 8.090 7.752 0.338 25458 1387 1 19 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.359 -0.219 25458 1388 1 19 . 1 1 3 3 LYS H H 3 8.310 8.310 8.437 -0.127 25458 1389 1 19 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.129 0.071 25458 1390 1 19 . 1 1 4 4 LEU H H 4 7.650 7.650 7.978 -0.328 25458 1391 1 19 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.087 0.163 25458 1392 1 19 . 1 1 5 5 LEU H H 5 7.550 7.550 7.821 -0.271 25458 1393 1 19 . 1 1 6 6 LEU HA H 6 4.270 4.270 3.898 0.372 25458 1394 1 19 . 1 1 6 6 LEU H H 6 7.860 7.860 7.379 0.481 25458 1395 1 19 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.530 0.080 25458 1396 1 19 . 1 1 7 7 ASN H H 7 8.030 8.030 7.905 0.125 25458 1397 1 19 . 1 1 8 8 GLY H H 8 8.170 8.170 7.308 0.862 25458 1398 1 19 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.575 -0.175 25458 1399 1 19 . 1 1 9 9 PHE H H 9 8.290 8.290 8.164 0.126 25458 1400 1 19 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.203 0.367 25458 1401 1 19 . 1 1 10 10 ASP H H 10 8.630 8.630 8.094 0.536 25458 1402 1 19 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.481 0.139 25458 1403 1 19 . 1 1 11 11 ASP H H 11 8.470 8.470 8.582 -0.112 25458 1404 1 19 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.700 0.160 25458 1405 1 19 . 1 1 12 12 VAL H H 12 8.270 8.270 7.289 0.981 25458 1406 1 19 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.064 0.296 25458 1407 1 19 . 1 1 13 13 HIS H H 13 8.040 8.040 8.334 -0.294 25458 1408 1 19 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.411 0.039 25458 1409 1 19 . 1 1 14 14 PHE H H 14 8.460 8.460 7.697 0.763 25458 1410 1 19 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.862 0.268 25458 1411 1 19 . 1 1 15 15 LEU H H 15 8.500 8.500 7.598 0.902 25458 1412 1 19 . 1 1 16 16 GLY H H 16 8.470 8.470 8.254 0.216 25458 1413 1 19 . 1 1 17 17 SER HA H 17 4.290 4.290 4.231 0.059 25458 1414 1 19 . 1 1 17 17 SER H H 17 7.990 7.990 7.430 0.560 25458 1415 1 19 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.404 0.106 25458 1416 1 19 . 1 1 18 18 ASN H H 18 7.810 7.810 7.854 -0.044 25458 1417 1 19 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.697 0.033 25458 1418 1 19 . 1 1 19 19 VAL H H 19 8.200 8.200 8.244 -0.044 25458 1419 1 19 . 1 1 20 20 MET HA H 20 4.220 4.220 4.237 -0.017 25458 1420 1 19 . 1 1 20 20 MET H H 20 8.130 8.130 7.387 0.743 25458 1421 1 19 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.981 0.149 25458 1422 1 19 . 1 1 21 21 GLU H H 21 8.130 8.130 7.868 0.262 25458 1423 1 19 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.115 -0.055 25458 1424 1 19 . 1 1 22 22 GLU H H 22 8.220 8.220 8.043 0.177 25458 1425 1 19 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.200 -0.180 25458 1426 1 19 . 1 1 23 23 GLN H H 23 8.280 8.280 7.558 0.722 25458 1427 1 19 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.488 0.032 25458 1428 1 19 . 1 1 24 24 ASP H H 24 8.380 8.380 8.142 0.238 25458 1429 1 19 . 1 1 25 25 LEU H H 25 8.300 8.300 7.409 0.891 25458 1430 1 19 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.238 -0.138 25458 1431 1 19 . 1 1 26 26 ARG H H 26 8.090 8.090 7.472 0.618 25458 1432 1 19 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.389 0.171 25458 1433 1 19 . 1 1 27 27 ASP H H 27 8.280 8.280 8.135 0.145 25458 1434 1 19 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.804 0.086 25458 1435 1 19 . 1 1 28 28 ILE H H 28 8.260 8.260 7.373 0.887 25458 1436 1 19 . 1 1 29 29 GLY H H 29 8.200 8.200 8.016 0.184 25458 1437 1 19 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.517 -0.407 25458 1438 1 19 . 1 1 30 30 ILE H H 30 7.960 7.960 7.688 0.272 25458 1439 1 19 . 1 1 31 31 SER HA H 31 4.400 4.400 4.528 -0.128 25458 1440 1 19 . 1 1 31 31 SER H H 31 7.880 7.880 7.859 0.021 25458 1441 1 19 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.622 0.288 25458 1442 1 19 . 1 1 32 32 ASP H H 32 7.960 7.960 7.502 0.458 25458 1443 1 19 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.282 0.028 25458 1444 1 19 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.033 0.127 25458 1445 1 19 . 1 1 34 34 GLN H H 34 8.190 8.190 8.886 -0.696 25458 1446 1 19 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.145 0.325 25458 1447 1 19 . 1 1 35 35 HIS H H 35 8.050 8.050 7.595 0.455 25458 1448 1 19 . 1 1 36 36 ARG HA H 36 4.070 4.070 3.992 0.078 25458 1449 1 19 . 1 1 36 36 ARG H H 36 8.230 8.230 8.517 -0.287 25458 1450 1 19 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.154 -0.084 25458 1451 1 19 . 1 1 37 37 ARG H H 37 8.210 8.210 7.931 0.279 25458 1452 1 19 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.239 -0.089 25458 1453 1 19 . 1 1 38 38 LYS H H 38 7.690 7.690 7.582 0.108 25458 1454 1 19 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.286 -0.116 25458 1455 1 19 . 1 1 39 39 LEU H H 39 7.840 7.840 7.987 -0.147 25458 1456 1 19 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.080 0.060 25458 1457 1 19 . 1 1 40 40 LEU H H 40 8.030 8.030 8.530 -0.500 25458 1458 1 19 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.127 -0.047 25458 1459 1 19 . 1 1 41 41 GLN H H 41 8.010 8.010 7.661 0.349 25458 1460 1 19 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.337 -0.117 25458 1461 1 19 . 1 1 42 42 ALA H H 42 8.030 8.030 7.875 0.155 25458 1462 1 19 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.254 -0.014 25458 1463 1 19 . 1 1 43 43 ALA H H 43 8.090 8.090 7.692 0.398 25458 1464 1 20 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.247 -0.107 25458 1465 1 20 . 1 1 3 3 LYS H H 3 8.310 8.310 8.313 -0.003 25458 1466 1 20 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.431 -0.231 25458 1467 1 20 . 1 1 4 4 LEU H H 4 7.650 7.650 7.920 -0.270 25458 1468 1 20 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.173 0.077 25458 1469 1 20 . 1 1 5 5 LEU H H 5 7.550 7.550 7.719 -0.169 25458 1470 1 20 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.024 0.246 25458 1471 1 20 . 1 1 6 6 LEU H H 6 7.860 7.860 8.161 -0.301 25458 1472 1 20 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.463 0.147 25458 1473 1 20 . 1 1 7 7 ASN H H 7 8.030 8.030 8.606 -0.576 25458 1474 1 20 . 1 1 8 8 GLY H H 8 8.170 8.170 7.591 0.579 25458 1475 1 20 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.452 -0.052 25458 1476 1 20 . 1 1 9 9 PHE H H 9 8.290 8.290 8.069 0.221 25458 1477 1 20 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.437 0.133 25458 1478 1 20 . 1 1 10 10 ASP H H 10 8.630 8.630 7.903 0.727 25458 1479 1 20 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.684 -0.064 25458 1480 1 20 . 1 1 11 11 ASP H H 11 8.470 8.470 7.567 0.903 25458 1481 1 20 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.745 0.115 25458 1482 1 20 . 1 1 12 12 VAL H H 12 8.270 8.270 7.675 0.595 25458 1483 1 20 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.153 0.207 25458 1484 1 20 . 1 1 13 13 HIS H H 13 8.040 8.040 7.539 0.501 25458 1485 1 20 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.456 -0.006 25458 1486 1 20 . 1 1 14 14 PHE H H 14 8.460 8.460 7.343 1.117 25458 1487 1 20 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.873 0.257 25458 1488 1 20 . 1 1 15 15 LEU H H 15 8.500 8.500 7.857 0.643 25458 1489 1 20 . 1 1 16 16 GLY H H 16 8.470 8.470 7.799 0.671 25458 1490 1 20 . 1 1 17 17 SER HA H 17 4.290 4.290 3.984 0.306 25458 1491 1 20 . 1 1 17 17 SER H H 17 7.990 7.990 8.143 -0.153 25458 1492 1 20 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.463 0.047 25458 1493 1 20 . 1 1 18 18 ASN H H 18 7.810 7.810 7.236 0.574 25458 1494 1 20 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.830 -0.100 25458 1495 1 20 . 1 1 19 19 VAL H H 19 8.200 8.200 8.561 -0.361 25458 1496 1 20 . 1 1 20 20 MET HA H 20 4.220 4.220 4.224 -0.004 25458 1497 1 20 . 1 1 20 20 MET H H 20 8.130 8.130 7.765 0.365 25458 1498 1 20 . 1 1 21 21 GLU HA H 21 4.130 4.130 3.990 0.140 25458 1499 1 20 . 1 1 21 21 GLU H H 21 8.130 8.130 8.036 0.094 25458 1500 1 20 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.136 -0.076 25458 1501 1 20 . 1 1 22 22 GLU H H 22 8.220 8.220 8.357 -0.137 25458 1502 1 20 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.224 -0.204 25458 1503 1 20 . 1 1 23 23 GLN H H 23 8.280 8.280 7.550 0.730 25458 1504 1 20 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.437 0.083 25458 1505 1 20 . 1 1 24 24 ASP H H 24 8.380 8.380 8.284 0.096 25458 1506 1 20 . 1 1 25 25 LEU H H 25 8.300 8.300 7.462 0.838 25458 1507 1 20 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.321 -0.221 25458 1508 1 20 . 1 1 26 26 ARG H H 26 8.090 8.090 7.419 0.671 25458 1509 1 20 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.409 0.151 25458 1510 1 20 . 1 1 27 27 ASP H H 27 8.280 8.280 8.454 -0.174 25458 1511 1 20 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.906 -0.016 25458 1512 1 20 . 1 1 28 28 ILE H H 28 8.260 8.260 7.516 0.744 25458 1513 1 20 . 1 1 29 29 GLY H H 29 8.200 8.200 8.073 0.127 25458 1514 1 20 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.507 -0.397 25458 1515 1 20 . 1 1 30 30 ILE H H 30 7.960 7.960 7.743 0.217 25458 1516 1 20 . 1 1 31 31 SER HA H 31 4.400 4.400 4.514 -0.114 25458 1517 1 20 . 1 1 31 31 SER H H 31 7.880 7.880 7.870 0.010 25458 1518 1 20 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.616 0.294 25458 1519 1 20 . 1 1 32 32 ASP H H 32 7.960 7.960 7.534 0.426 25458 1520 1 20 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.283 0.027 25458 1521 1 20 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.030 0.130 25458 1522 1 20 . 1 1 34 34 GLN H H 34 8.190 8.190 8.852 -0.662 25458 1523 1 20 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.095 0.375 25458 1524 1 20 . 1 1 35 35 HIS H H 35 8.050 8.050 7.649 0.401 25458 1525 1 20 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.095 -0.025 25458 1526 1 20 . 1 1 36 36 ARG H H 36 8.230 8.230 8.086 0.144 25458 1527 1 20 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.211 -0.141 25458 1528 1 20 . 1 1 37 37 ARG H H 37 8.210 8.210 7.872 0.338 25458 1529 1 20 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.210 -0.060 25458 1530 1 20 . 1 1 38 38 LYS H H 38 7.690 7.690 8.229 -0.539 25458 1531 1 20 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.324 -0.154 25458 1532 1 20 . 1 1 39 39 LEU H H 39 7.840 7.840 8.292 -0.452 25458 1533 1 20 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.101 0.039 25458 1534 1 20 . 1 1 40 40 LEU H H 40 8.030 8.030 7.706 0.324 25458 1535 1 20 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.142 -0.062 25458 1536 1 20 . 1 1 41 41 GLN H H 41 8.010 8.010 7.912 0.098 25458 1537 1 20 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.380 -0.160 25458 1538 1 20 . 1 1 42 42 ALA H H 42 8.030 8.030 7.931 0.099 25458 1539 1 20 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.179 0.061 25458 1540 1 20 . 1 1 43 43 ALA H H 43 8.090 8.090 7.851 0.239 25458 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 25458 2 1 1 "Average Difference" HA 43 0.174 -0.054 0.168 25458 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 25458 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 25458 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 25458 6 1 1 "Average Difference" HN 40 0.449 -0.161 0.424 25458 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 25458 8 1 2 "Average Difference" HA 43 0.205 -0.039 0.204 25458 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 25458 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 25458 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 25458 12 1 2 "Average Difference" HN 40 0.481 -0.194 0.446 25458 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 25458 14 1 3 "Average Difference" HA 43 0.219 -0.084 0.204 25458 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 25458 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 25458 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 25458 18 1 3 "Average Difference" HN 40 0.517 -0.233 0.467 25458 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 25458 20 1 4 "Average Difference" HA 43 0.197 -0.063 0.189 25458 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 25458 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 25458 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 25458 24 1 4 "Average Difference" HN 40 0.461 -0.216 0.413 25458 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 25458 26 1 5 "Average Difference" HA 43 0.171 -0.021 0.172 25458 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 25458 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 25458 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 25458 30 1 5 "Average Difference" HN 40 0.469 -0.205 0.428 25458 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 25458 32 1 6 "Average Difference" HA 43 0.169 -0.037 0.167 25458 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 25458 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 25458 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 25458 36 1 6 "Average Difference" HN 40 0.443 -0.226 0.385 25458 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 25458 38 1 7 "Average Difference" HA 43 0.170 -0.049 0.164 25458 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 25458 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 25458 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 25458 42 1 7 "Average Difference" HN 40 0.483 -0.216 0.438 25458 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 25458 44 1 8 "Average Difference" HA 43 0.189 -0.046 0.186 25458 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 25458 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 25458 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 25458 48 1 8 "Average Difference" HN 40 0.505 -0.307 0.406 25458 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 25458 50 1 9 "Average Difference" HA 43 0.163 -0.037 0.160 25458 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 25458 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 25458 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 25458 54 1 9 "Average Difference" HN 40 0.468 -0.201 0.428 25458 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 25458 56 1 10 "Average Difference" HA 43 0.169 -0.032 0.168 25458 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 25458 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 25458 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 25458 60 1 10 "Average Difference" HN 40 0.434 -0.204 0.388 25458 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 25458 62 1 11 "Average Difference" HA 43 0.203 -0.050 0.199 25458 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 25458 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 25458 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 25458 66 1 11 "Average Difference" HN 40 0.492 -0.275 0.414 25458 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 25458 68 1 12 "Average Difference" HA 43 0.175 -0.026 0.175 25458 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 25458 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 25458 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 25458 72 1 12 "Average Difference" HN 40 0.499 -0.278 0.420 25458 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 25458 74 1 13 "Average Difference" HA 43 0.187 -0.045 0.183 25458 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 25458 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 25458 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 25458 78 1 13 "Average Difference" HN 40 0.500 -0.282 0.418 25458 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 25458 80 1 14 "Average Difference" HA 43 0.211 -0.053 0.207 25458 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 25458 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 25458 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 25458 84 1 14 "Average Difference" HN 40 0.463 -0.204 0.421 25458 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 25458 86 1 15 "Average Difference" HA 43 0.184 -0.053 0.179 25458 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 25458 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 25458 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 25458 90 1 15 "Average Difference" HN 40 0.549 -0.257 0.491 25458 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 25458 92 1 16 "Average Difference" HA 43 0.189 -0.009 0.191 25458 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 25458 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 25458 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 25458 96 1 16 "Average Difference" HN 40 0.519 -0.276 0.445 25458 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 25458 98 1 17 "Average Difference" HA 43 0.187 -0.026 0.188 25458 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 25458 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 25458 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 25458 102 1 17 "Average Difference" HN 40 0.461 -0.219 0.411 25458 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 25458 104 1 18 "Average Difference" HA 43 0.220 -0.049 0.217 25458 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 25458 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 25458 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 25458 108 1 18 "Average Difference" HN 40 0.501 -0.259 0.434 25458 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 25458 110 1 19 "Average Difference" HA 43 0.178 -0.052 0.172 25458 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 25458 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 25458 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 25458 114 1 19 "Average Difference" HN 40 0.482 -0.252 0.416 25458 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 25458 116 1 20 "Average Difference" HA 43 0.185 -0.033 0.184 25458 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 25458 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 25458 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 25458 120 1 20 "Average Difference" HN 40 0.489 -0.217 0.443 25458 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 25458 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 LYS HA H 3 4.140 4.140 4.296 -0.156 25458 2 1 . 1 1 3 3 LYS H H 3 8.310 8.310 8.364 -0.054 25458 3 1 . 1 1 4 4 LEU HA H 4 4.200 4.200 4.267 -0.067 25458 4 1 . 1 1 4 4 LEU H H 4 7.650 7.650 7.882 -0.232 25458 5 1 . 1 1 5 5 LEU HA H 5 4.250 4.250 4.140 0.110 25458 6 1 . 1 1 5 5 LEU H H 5 7.550 7.550 7.867 -0.317 25458 7 1 . 1 1 6 6 LEU HA H 6 4.270 4.270 4.082 0.188 25458 8 1 . 1 1 6 6 LEU H H 6 7.860 7.860 7.942 -0.082 25458 9 1 . 1 1 7 7 ASN HA H 7 4.610 4.610 4.510 0.100 25458 10 1 . 1 1 7 7 ASN H H 7 8.030 8.030 8.268 -0.238 25458 11 1 . 1 1 8 8 GLY H H 8 8.170 8.170 7.643 0.527 25458 12 1 . 1 1 9 9 PHE HA H 9 4.400 4.400 4.440 -0.040 25458 13 1 . 1 1 9 9 PHE H H 9 8.290 8.290 8.232 0.058 25458 14 1 . 1 1 10 10 ASP HA H 10 4.570 4.570 4.352 0.218 25458 15 1 . 1 1 10 10 ASP H H 10 8.630 8.630 8.042 0.588 25458 16 1 . 1 1 11 11 ASP HA H 11 4.620 4.620 4.609 0.011 25458 17 1 . 1 1 11 11 ASP H H 11 8.470 8.470 7.966 0.504 25458 18 1 . 1 1 12 12 VAL HA H 12 3.860 3.860 3.762 0.098 25458 19 1 . 1 1 12 12 VAL H H 12 8.270 8.270 7.493 0.777 25458 20 1 . 1 1 13 13 HIS HA H 13 4.360 4.360 4.220 0.140 25458 21 1 . 1 1 13 13 HIS H H 13 8.040 8.040 8.153 -0.113 25458 22 1 . 1 1 14 14 PHE HA H 14 4.450 4.450 4.462 -0.012 25458 23 1 . 1 1 14 14 PHE H H 14 8.460 8.460 7.641 0.819 25458 24 1 . 1 1 15 15 LEU HA H 15 4.130 4.130 3.749 0.381 25458 25 1 . 1 1 15 15 LEU H H 15 8.500 8.500 7.567 0.933 25458 26 1 . 1 1 16 16 GLY H H 16 8.470 8.470 7.954 0.516 25458 27 1 . 1 1 17 17 SER HA H 17 4.290 4.290 4.073 0.217 25458 28 1 . 1 1 17 17 SER H H 17 7.990 7.990 7.857 0.133 25458 29 1 . 1 1 18 18 ASN HA H 18 4.510 4.510 4.439 0.071 25458 30 1 . 1 1 18 18 ASN H H 18 7.810 7.810 7.440 0.370 25458 31 1 . 1 1 19 19 VAL HA H 19 3.730 3.730 3.766 -0.036 25458 32 1 . 1 1 19 19 VAL H H 19 8.200 8.200 8.399 -0.199 25458 33 1 . 1 1 20 20 MET HA H 20 4.220 4.220 4.196 0.024 25458 34 1 . 1 1 20 20 MET H H 20 8.130 8.130 7.610 0.520 25458 35 1 . 1 1 21 21 GLU HA H 21 4.130 4.130 4.008 0.122 25458 36 1 . 1 1 21 21 GLU H H 21 8.130 8.130 7.912 0.218 25458 37 1 . 1 1 22 22 GLU HA H 22 4.060 4.060 4.105 -0.045 25458 38 1 . 1 1 22 22 GLU H H 22 8.220 8.220 8.198 0.022 25458 39 1 . 1 1 23 23 GLN HA H 23 4.020 4.020 4.190 -0.170 25458 40 1 . 1 1 23 23 GLN H H 23 8.280 8.280 7.592 0.688 25458 41 1 . 1 1 24 24 ASP HA H 24 4.520 4.520 4.507 0.013 25458 42 1 . 1 1 24 24 ASP H H 24 8.380 8.380 8.128 0.253 25458 43 1 . 1 1 25 25 LEU H H 25 8.300 8.300 7.461 0.839 25458 44 1 . 1 1 26 26 ARG HA H 26 4.100 4.100 4.277 -0.177 25458 45 1 . 1 1 26 26 ARG H H 26 8.090 8.090 7.446 0.644 25458 46 1 . 1 1 27 27 ASP HA H 27 4.560 4.560 4.441 0.118 25458 47 1 . 1 1 27 27 ASP H H 27 8.280 8.280 8.093 0.187 25458 48 1 . 1 1 28 28 ILE HA H 28 3.890 3.890 3.796 0.094 25458 49 1 . 1 1 28 28 ILE H H 28 8.260 8.260 7.451 0.809 25458 50 1 . 1 1 29 29 GLY H H 29 8.200 8.200 7.732 0.468 25458 51 1 . 1 1 30 30 ILE HA H 30 4.110 4.110 4.437 -0.327 25458 52 1 . 1 1 30 30 ILE H H 30 7.960 7.960 7.565 0.395 25458 53 1 . 1 1 31 31 SER HA H 31 4.400 4.400 4.569 -0.169 25458 54 1 . 1 1 31 31 SER H H 31 7.880 7.880 8.040 -0.160 25458 55 1 . 1 1 32 32 ASP HA H 32 4.910 4.910 4.624 0.286 25458 56 1 . 1 1 32 32 ASP H H 32 7.960 7.960 7.783 0.177 25458 57 1 . 1 1 33 33 PRO HA H 33 4.310 4.310 4.302 0.008 25458 58 1 . 1 1 34 34 GLN HA H 34 4.160 4.160 4.016 0.144 25458 59 1 . 1 1 34 34 GLN H H 34 8.190 8.190 8.748 -0.558 25458 60 1 . 1 1 35 35 HIS HA H 35 4.470 4.470 4.203 0.267 25458 61 1 . 1 1 35 35 HIS H H 35 8.050 8.050 7.912 0.138 25458 62 1 . 1 1 36 36 ARG HA H 36 4.070 4.070 4.053 0.017 25458 63 1 . 1 1 36 36 ARG H H 36 8.230 8.230 8.239 -0.009 25458 64 1 . 1 1 37 37 ARG HA H 37 4.070 4.070 4.180 -0.110 25458 65 1 . 1 1 37 37 ARG H H 37 8.210 8.210 7.862 0.348 25458 66 1 . 1 1 38 38 LYS HA H 38 4.150 4.150 4.239 -0.089 25458 67 1 . 1 1 38 38 LYS H H 38 7.690 7.690 7.881 -0.191 25458 68 1 . 1 1 39 39 LEU HA H 39 4.170 4.170 4.293 -0.123 25458 69 1 . 1 1 39 39 LEU H H 39 7.840 7.840 8.103 -0.263 25458 70 1 . 1 1 40 40 LEU HA H 40 4.140 4.140 4.021 0.119 25458 71 1 . 1 1 40 40 LEU H H 40 8.030 8.030 7.866 0.164 25458 72 1 . 1 1 41 41 GLN HA H 41 4.080 4.080 4.090 -0.010 25458 73 1 . 1 1 41 41 GLN H H 41 8.010 8.010 7.821 0.189 25458 74 1 . 1 1 42 42 ALA HA H 42 4.220 4.220 4.337 -0.117 25458 75 1 . 1 1 42 42 ALA H H 42 8.030 8.030 7.846 0.184 25458 76 1 . 1 1 43 43 ALA HA H 43 4.240 4.240 4.223 0.017 25458 77 1 . 1 1 43 43 ALA H H 43 8.090 8.090 7.778 0.312 25458 stop_ save_