data_19504 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19504 _Entry.PDB_ID 2MDV 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 19504 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.886 0.202 19504 2 1 1 . 1 1 2 2 TRP H H 2 9.010 9.010 8.325 0.685 19504 3 1 1 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.761 -0.071 19504 4 1 1 . 1 1 3 3 LEU H H 3 9.506 9.506 8.475 1.031 19504 5 1 1 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.982 0.823 19504 6 1 1 . 1 1 4 4 CYS H H 4 8.997 8.997 8.761 0.236 19504 7 1 1 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.598 0.177 19504 8 1 1 . 1 1 5 5 ILE H H 5 9.319 9.319 8.423 0.896 19504 9 1 1 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.975 -0.619 19504 10 1 1 . 1 1 6 6 TRP H H 6 8.606 8.606 8.391 0.215 19504 11 1 1 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.475 0.053 19504 12 1 1 . 1 1 7 7 LEU H H 7 7.784 7.784 7.787 -0.003 19504 13 1 1 . 1 1 8 8 SER HA H 8 4.275 4.275 4.087 0.188 19504 14 1 1 . 1 1 8 8 SER H H 8 8.678 8.678 7.954 0.724 19504 15 1 1 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.199 -0.024 19504 16 1 1 . 1 1 9 9 ASP H H 9 9.066 9.066 8.694 0.372 19504 17 1 1 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.051 -0.093 19504 18 1 1 . 1 1 10 10 GLN H H 10 8.689 8.689 8.644 0.045 19504 19 1 1 . 1 1 11 11 THR HA H 11 4.045 4.045 4.340 -0.295 19504 20 1 1 . 1 1 11 11 THR H H 11 8.000 8.000 7.701 0.299 19504 21 1 1 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.024 -0.192 19504 22 1 1 . 1 1 12 12 LEU H H 12 8.482 8.482 8.025 0.457 19504 23 1 1 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.071 -0.040 19504 24 1 1 . 1 1 13 13 GLU H H 13 8.242 8.242 8.497 -0.255 19504 25 1 1 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.382 0.002 19504 26 1 1 . 1 1 14 14 ASP H H 14 8.128 8.128 7.758 0.370 19504 27 1 1 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.187 -0.169 19504 28 1 1 . 1 1 15 15 LEU H H 15 8.721 8.721 7.687 1.034 19504 29 1 1 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.151 -0.232 19504 30 1 1 . 1 1 16 16 GLU H H 16 8.468 8.468 8.132 0.336 19504 31 1 1 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.121 -0.133 19504 32 1 1 . 1 1 17 17 LYS H H 17 8.128 8.128 7.492 0.636 19504 33 1 1 . 1 1 18 18 MET HA H 18 4.115 4.115 4.162 -0.047 19504 34 1 1 . 1 1 18 18 MET H H 18 8.403 8.403 8.078 0.325 19504 35 1 1 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.886 -0.103 19504 36 1 1 . 1 1 19 19 ALA H H 19 8.719 8.719 8.070 0.649 19504 37 1 1 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.976 0.145 19504 38 1 1 . 1 1 20 20 ARG H H 20 7.889 7.889 7.806 0.083 19504 39 1 1 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.069 0.011 19504 40 1 1 . 1 1 21 21 ARG H H 21 7.968 7.968 7.744 0.224 19504 41 1 1 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.358 0.031 19504 42 1 1 . 1 1 22 22 GLU H H 22 8.035 8.035 8.001 0.034 19504 43 1 1 . 1 1 23 23 GLY H H 23 7.912 7.912 8.124 -0.212 19504 44 1 1 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.450 0.390 19504 45 1 1 . 1 1 24 24 LEU H H 24 8.149 8.149 7.932 0.217 19504 46 1 1 . 1 1 25 25 SER HA H 25 4.563 4.563 4.708 -0.145 19504 47 1 1 . 1 1 25 25 SER H H 25 8.182 8.182 8.164 0.018 19504 48 1 1 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.948 -0.251 19504 49 1 1 . 1 1 26 26 LYS H H 26 9.270 9.270 8.766 0.504 19504 50 1 1 . 1 1 27 27 SER HA H 27 3.972 3.972 4.386 -0.414 19504 51 1 1 . 1 1 27 27 SER H H 27 8.615 8.615 8.101 0.514 19504 52 1 1 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.165 0.004 19504 53 1 1 . 1 1 28 28 GLU H H 28 7.969 7.969 8.547 -0.578 19504 54 1 1 . 1 1 29 29 MET HA H 29 4.239 4.239 4.385 -0.146 19504 55 1 1 . 1 1 29 29 MET H H 29 8.768 8.768 8.425 0.343 19504 56 1 1 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.768 -0.393 19504 57 1 1 . 1 1 30 30 ILE H H 30 7.966 7.966 7.486 0.480 19504 58 1 1 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.457 -0.221 19504 59 1 1 . 1 1 31 31 ASN H H 31 7.862 7.862 8.530 -0.668 19504 60 1 1 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.746 -0.038 19504 61 1 1 . 1 1 32 32 VAL H H 32 8.463 8.463 7.479 0.984 19504 62 1 1 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.118 -0.303 19504 63 1 1 . 1 1 33 33 ALA H H 33 8.285 8.285 7.809 0.476 19504 64 1 1 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.281 -0.329 19504 65 1 1 . 1 1 34 34 LEU H H 34 8.506 8.506 7.354 1.152 19504 66 1 1 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.097 -0.098 19504 67 1 1 . 1 1 35 35 GLN H H 35 8.340 8.340 7.831 0.509 19504 68 1 1 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.725 -0.200 19504 69 1 1 . 1 1 36 36 HIS H H 36 7.859 7.859 7.708 0.151 19504 70 1 1 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.317 -0.019 19504 71 1 1 . 1 1 37 37 TYR H H 37 7.655 7.655 7.535 0.120 19504 72 1 2 . 1 1 2 2 TRP HA H 2 5.088 5.088 5.007 0.081 19504 73 1 2 . 1 1 2 2 TRP H H 2 9.010 9.010 8.609 0.401 19504 74 1 2 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.566 0.124 19504 75 1 2 . 1 1 3 3 LEU H H 3 9.506 9.506 8.393 1.113 19504 76 1 2 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.143 0.662 19504 77 1 2 . 1 1 4 4 CYS H H 4 8.997 8.997 8.435 0.562 19504 78 1 2 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.602 0.173 19504 79 1 2 . 1 1 5 5 ILE H H 5 9.319 9.319 8.419 0.900 19504 80 1 2 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.980 -0.624 19504 81 1 2 . 1 1 6 6 TRP H H 6 8.606 8.606 8.411 0.195 19504 82 1 2 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.444 0.084 19504 83 1 2 . 1 1 7 7 LEU H H 7 7.784 7.784 7.827 -0.043 19504 84 1 2 . 1 1 8 8 SER HA H 8 4.275 4.275 4.087 0.188 19504 85 1 2 . 1 1 8 8 SER H H 8 8.678 8.678 8.201 0.477 19504 86 1 2 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.245 -0.070 19504 87 1 2 . 1 1 9 9 ASP H H 9 9.066 9.066 8.227 0.839 19504 88 1 2 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.968 -0.010 19504 89 1 2 . 1 1 10 10 GLN H H 10 8.689 8.689 8.778 -0.089 19504 90 1 2 . 1 1 11 11 THR HA H 11 4.045 4.045 4.177 -0.132 19504 91 1 2 . 1 1 11 11 THR H H 11 8.000 8.000 7.711 0.289 19504 92 1 2 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.119 -0.287 19504 93 1 2 . 1 1 12 12 LEU H H 12 8.482 8.482 7.487 0.995 19504 94 1 2 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.137 -0.106 19504 95 1 2 . 1 1 13 13 GLU H H 13 8.242 8.242 8.203 0.039 19504 96 1 2 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.403 -0.019 19504 97 1 2 . 1 1 14 14 ASP H H 14 8.128 8.128 8.443 -0.315 19504 98 1 2 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.195 -0.177 19504 99 1 2 . 1 1 15 15 LEU H H 15 8.721 8.721 7.568 1.153 19504 100 1 2 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.351 -0.432 19504 101 1 2 . 1 1 16 16 GLU H H 16 8.468 8.468 7.985 0.483 19504 102 1 2 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.157 -0.169 19504 103 1 2 . 1 1 17 17 LYS H H 17 8.128 8.128 7.704 0.424 19504 104 1 2 . 1 1 18 18 MET HA H 18 4.115 4.115 4.377 -0.262 19504 105 1 2 . 1 1 18 18 MET H H 18 8.403 8.403 7.621 0.782 19504 106 1 2 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.260 -0.477 19504 107 1 2 . 1 1 19 19 ALA H H 19 8.719 8.719 7.750 0.969 19504 108 1 2 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.977 0.144 19504 109 1 2 . 1 1 20 20 ARG H H 20 7.889 7.889 8.005 -0.116 19504 110 1 2 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.081 -0.001 19504 111 1 2 . 1 1 21 21 ARG H H 21 7.968 7.968 7.736 0.232 19504 112 1 2 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.369 0.020 19504 113 1 2 . 1 1 22 22 GLU H H 22 8.035 8.035 7.691 0.344 19504 114 1 2 . 1 1 23 23 GLY H H 23 7.912 7.912 8.168 -0.256 19504 115 1 2 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.400 0.440 19504 116 1 2 . 1 1 24 24 LEU H H 24 8.149 8.149 7.818 0.331 19504 117 1 2 . 1 1 25 25 SER HA H 25 4.563 4.563 4.757 -0.194 19504 118 1 2 . 1 1 25 25 SER H H 25 8.182 8.182 8.068 0.114 19504 119 1 2 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.048 -0.351 19504 120 1 2 . 1 1 26 26 LYS H H 26 9.270 9.270 8.763 0.507 19504 121 1 2 . 1 1 27 27 SER HA H 27 3.972 3.972 4.415 -0.443 19504 122 1 2 . 1 1 27 27 SER H H 27 8.615 8.615 7.716 0.899 19504 123 1 2 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.117 0.052 19504 124 1 2 . 1 1 28 28 GLU H H 28 7.969 7.969 7.734 0.235 19504 125 1 2 . 1 1 29 29 MET HA H 29 4.239 4.239 4.427 -0.188 19504 126 1 2 . 1 1 29 29 MET H H 29 8.768 8.768 8.079 0.689 19504 127 1 2 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.753 -0.378 19504 128 1 2 . 1 1 30 30 ILE H H 30 7.966 7.966 7.456 0.510 19504 129 1 2 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.450 -0.214 19504 130 1 2 . 1 1 31 31 ASN H H 31 7.862 7.862 8.647 -0.785 19504 131 1 2 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.772 -0.064 19504 132 1 2 . 1 1 32 32 VAL H H 32 8.463 8.463 7.528 0.935 19504 133 1 2 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.136 -0.321 19504 134 1 2 . 1 1 33 33 ALA H H 33 8.285 8.285 7.719 0.566 19504 135 1 2 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.264 -0.312 19504 136 1 2 . 1 1 34 34 LEU H H 34 8.506 8.506 7.382 1.124 19504 137 1 2 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.091 -0.092 19504 138 1 2 . 1 1 35 35 GLN H H 35 8.340 8.340 7.892 0.448 19504 139 1 2 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.744 -0.219 19504 140 1 2 . 1 1 36 36 HIS H H 36 7.859 7.859 7.646 0.213 19504 141 1 2 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.306 -0.008 19504 142 1 2 . 1 1 37 37 TYR H H 37 7.655 7.655 7.522 0.133 19504 143 1 3 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.898 0.190 19504 144 1 3 . 1 1 2 2 TRP H H 2 9.010 9.010 8.344 0.666 19504 145 1 3 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.789 -0.099 19504 146 1 3 . 1 1 3 3 LEU H H 3 9.506 9.506 8.400 1.106 19504 147 1 3 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.897 0.908 19504 148 1 3 . 1 1 4 4 CYS H H 4 8.997 8.997 8.714 0.283 19504 149 1 3 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.535 0.240 19504 150 1 3 . 1 1 5 5 ILE H H 5 9.319 9.319 8.354 0.965 19504 151 1 3 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.992 -0.636 19504 152 1 3 . 1 1 6 6 TRP H H 6 8.606 8.606 8.323 0.283 19504 153 1 3 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.468 0.060 19504 154 1 3 . 1 1 7 7 LEU H H 7 7.784 7.784 7.873 -0.089 19504 155 1 3 . 1 1 8 8 SER HA H 8 4.275 4.275 4.184 0.091 19504 156 1 3 . 1 1 8 8 SER H H 8 8.678 8.678 7.784 0.894 19504 157 1 3 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.201 -0.026 19504 158 1 3 . 1 1 9 9 ASP H H 9 9.066 9.066 8.700 0.366 19504 159 1 3 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.007 -0.049 19504 160 1 3 . 1 1 10 10 GLN H H 10 8.689 8.689 8.519 0.170 19504 161 1 3 . 1 1 11 11 THR HA H 11 4.045 4.045 4.410 -0.365 19504 162 1 3 . 1 1 11 11 THR H H 11 8.000 8.000 7.510 0.490 19504 163 1 3 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.062 -0.230 19504 164 1 3 . 1 1 12 12 LEU H H 12 8.482 8.482 7.870 0.612 19504 165 1 3 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.952 0.079 19504 166 1 3 . 1 1 13 13 GLU H H 13 8.242 8.242 8.387 -0.145 19504 167 1 3 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.383 0.000 19504 168 1 3 . 1 1 14 14 ASP H H 14 8.128 8.128 7.611 0.517 19504 169 1 3 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.276 -0.258 19504 170 1 3 . 1 1 15 15 LEU H H 15 8.721 8.721 7.517 1.204 19504 171 1 3 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.431 -0.512 19504 172 1 3 . 1 1 16 16 GLU H H 16 8.468 8.468 8.051 0.417 19504 173 1 3 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.187 -0.199 19504 174 1 3 . 1 1 17 17 LYS H H 17 8.128 8.128 7.731 0.397 19504 175 1 3 . 1 1 18 18 MET HA H 18 4.115 4.115 4.193 -0.078 19504 176 1 3 . 1 1 18 18 MET H H 18 8.403 8.403 7.533 0.870 19504 177 1 3 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.941 -0.158 19504 178 1 3 . 1 1 19 19 ALA H H 19 8.719 8.719 8.137 0.582 19504 179 1 3 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.979 0.142 19504 180 1 3 . 1 1 20 20 ARG H H 20 7.889 7.889 7.703 0.186 19504 181 1 3 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.054 0.026 19504 182 1 3 . 1 1 21 21 ARG H H 21 7.968 7.968 7.740 0.228 19504 183 1 3 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.272 0.117 19504 184 1 3 . 1 1 22 22 GLU H H 22 8.035 8.035 8.007 0.028 19504 185 1 3 . 1 1 23 23 GLY H H 23 7.912 7.912 8.038 -0.126 19504 186 1 3 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.942 -0.102 19504 187 1 3 . 1 1 24 24 LEU H H 24 8.149 8.149 7.669 0.480 19504 188 1 3 . 1 1 25 25 SER HA H 25 4.563 4.563 4.719 -0.156 19504 189 1 3 . 1 1 25 25 SER H H 25 8.182 8.182 8.332 -0.150 19504 190 1 3 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.936 -0.239 19504 191 1 3 . 1 1 26 26 LYS H H 26 9.270 9.270 8.840 0.430 19504 192 1 3 . 1 1 27 27 SER HA H 27 3.972 3.972 4.248 -0.276 19504 193 1 3 . 1 1 27 27 SER H H 27 8.615 8.615 7.767 0.848 19504 194 1 3 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.061 0.108 19504 195 1 3 . 1 1 28 28 GLU H H 28 7.969 7.969 7.603 0.366 19504 196 1 3 . 1 1 29 29 MET HA H 29 4.239 4.239 4.296 -0.057 19504 197 1 3 . 1 1 29 29 MET H H 29 8.768 8.768 8.499 0.269 19504 198 1 3 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.767 -0.392 19504 199 1 3 . 1 1 30 30 ILE H H 30 7.966 7.966 7.741 0.225 19504 200 1 3 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.471 -0.235 19504 201 1 3 . 1 1 31 31 ASN H H 31 7.862 7.862 8.582 -0.720 19504 202 1 3 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.762 -0.054 19504 203 1 3 . 1 1 32 32 VAL H H 32 8.463 8.463 7.537 0.926 19504 204 1 3 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.056 -0.241 19504 205 1 3 . 1 1 33 33 ALA H H 33 8.285 8.285 7.864 0.421 19504 206 1 3 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.375 -0.423 19504 207 1 3 . 1 1 34 34 LEU H H 34 8.506 8.506 7.639 0.867 19504 208 1 3 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.000 -0.001 19504 209 1 3 . 1 1 35 35 GLN H H 35 8.340 8.340 7.839 0.501 19504 210 1 3 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.740 -0.215 19504 211 1 3 . 1 1 36 36 HIS H H 36 7.859 7.859 7.593 0.266 19504 212 1 3 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.513 -0.215 19504 213 1 3 . 1 1 37 37 TYR H H 37 7.655 7.655 7.818 -0.163 19504 214 1 4 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.855 0.233 19504 215 1 4 . 1 1 2 2 TRP H H 2 9.010 9.010 8.377 0.633 19504 216 1 4 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.705 -0.015 19504 217 1 4 . 1 1 3 3 LEU H H 3 9.506 9.506 8.567 0.939 19504 218 1 4 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.893 0.912 19504 219 1 4 . 1 1 4 4 CYS H H 4 8.997 8.997 8.644 0.353 19504 220 1 4 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.586 0.189 19504 221 1 4 . 1 1 5 5 ILE H H 5 9.319 9.319 8.421 0.898 19504 222 1 4 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.890 -0.534 19504 223 1 4 . 1 1 6 6 TRP H H 6 8.606 8.606 8.474 0.132 19504 224 1 4 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.607 -0.079 19504 225 1 4 . 1 1 7 7 LEU H H 7 7.784 7.784 7.630 0.154 19504 226 1 4 . 1 1 8 8 SER HA H 8 4.275 4.275 4.141 0.134 19504 227 1 4 . 1 1 8 8 SER H H 8 8.678 8.678 7.703 0.975 19504 228 1 4 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.399 -0.224 19504 229 1 4 . 1 1 9 9 ASP H H 9 9.066 9.066 8.145 0.921 19504 230 1 4 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.086 -0.128 19504 231 1 4 . 1 1 10 10 GLN H H 10 8.689 8.689 8.727 -0.038 19504 232 1 4 . 1 1 11 11 THR HA H 11 4.045 4.045 4.157 -0.112 19504 233 1 4 . 1 1 11 11 THR H H 11 8.000 8.000 7.681 0.319 19504 234 1 4 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.002 -0.170 19504 235 1 4 . 1 1 12 12 LEU H H 12 8.482 8.482 7.735 0.747 19504 236 1 4 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.110 -0.079 19504 237 1 4 . 1 1 13 13 GLU H H 13 8.242 8.242 8.265 -0.023 19504 238 1 4 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.371 0.013 19504 239 1 4 . 1 1 14 14 ASP H H 14 8.128 8.128 8.360 -0.232 19504 240 1 4 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.276 -0.258 19504 241 1 4 . 1 1 15 15 LEU H H 15 8.721 8.721 7.483 1.238 19504 242 1 4 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.209 -0.290 19504 243 1 4 . 1 1 16 16 GLU H H 16 8.468 8.468 7.609 0.859 19504 244 1 4 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.404 -0.416 19504 245 1 4 . 1 1 17 17 LYS H H 17 8.128 8.128 8.411 -0.283 19504 246 1 4 . 1 1 18 18 MET HA H 18 4.115 4.115 4.550 -0.435 19504 247 1 4 . 1 1 18 18 MET H H 18 8.403 8.403 7.608 0.795 19504 248 1 4 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.104 -0.321 19504 249 1 4 . 1 1 19 19 ALA H H 19 8.719 8.719 8.243 0.476 19504 250 1 4 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.158 -0.037 19504 251 1 4 . 1 1 20 20 ARG H H 20 7.889 7.889 7.893 -0.004 19504 252 1 4 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.128 -0.048 19504 253 1 4 . 1 1 21 21 ARG H H 21 7.968 7.968 8.545 -0.577 19504 254 1 4 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.511 -0.122 19504 255 1 4 . 1 1 22 22 GLU H H 22 8.035 8.035 7.931 0.104 19504 256 1 4 . 1 1 23 23 GLY H H 23 7.912 7.912 7.677 0.235 19504 257 1 4 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.849 0.991 19504 258 1 4 . 1 1 24 24 LEU H H 24 8.149 8.149 7.421 0.728 19504 259 1 4 . 1 1 25 25 SER HA H 25 4.563 4.563 4.411 0.152 19504 260 1 4 . 1 1 25 25 SER H H 25 8.182 8.182 8.185 -0.003 19504 261 1 4 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.012 -0.315 19504 262 1 4 . 1 1 26 26 LYS H H 26 9.270 9.270 8.849 0.421 19504 263 1 4 . 1 1 27 27 SER HA H 27 3.972 3.972 4.357 -0.385 19504 264 1 4 . 1 1 27 27 SER H H 27 8.615 8.615 8.032 0.583 19504 265 1 4 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.016 0.153 19504 266 1 4 . 1 1 28 28 GLU H H 28 7.969 7.969 8.477 -0.508 19504 267 1 4 . 1 1 29 29 MET HA H 29 4.239 4.239 4.364 -0.125 19504 268 1 4 . 1 1 29 29 MET H H 29 8.768 8.768 8.589 0.179 19504 269 1 4 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.850 -0.475 19504 270 1 4 . 1 1 30 30 ILE H H 30 7.966 7.966 7.408 0.558 19504 271 1 4 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.484 -0.248 19504 272 1 4 . 1 1 31 31 ASN H H 31 7.862 7.862 8.238 -0.376 19504 273 1 4 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.780 -0.072 19504 274 1 4 . 1 1 32 32 VAL H H 32 8.463 8.463 7.943 0.520 19504 275 1 4 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.996 -0.181 19504 276 1 4 . 1 1 33 33 ALA H H 33 8.285 8.285 7.803 0.482 19504 277 1 4 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.161 -0.209 19504 278 1 4 . 1 1 34 34 LEU H H 34 8.506 8.506 7.380 1.126 19504 279 1 4 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.017 -0.018 19504 280 1 4 . 1 1 35 35 GLN H H 35 8.340 8.340 7.707 0.633 19504 281 1 4 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.763 -0.238 19504 282 1 4 . 1 1 36 36 HIS H H 36 7.859 7.859 7.561 0.298 19504 283 1 4 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.409 -0.111 19504 284 1 4 . 1 1 37 37 TYR H H 37 7.655 7.655 7.647 0.008 19504 285 1 5 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.654 0.434 19504 286 1 5 . 1 1 2 2 TRP H H 2 9.010 9.010 8.253 0.757 19504 287 1 5 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.714 -0.024 19504 288 1 5 . 1 1 3 3 LEU H H 3 9.506 9.506 8.310 1.196 19504 289 1 5 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.977 0.828 19504 290 1 5 . 1 1 4 4 CYS H H 4 8.997 8.997 8.773 0.224 19504 291 1 5 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.599 0.176 19504 292 1 5 . 1 1 5 5 ILE H H 5 9.319 9.319 8.407 0.912 19504 293 1 5 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.953 -0.597 19504 294 1 5 . 1 1 6 6 TRP H H 6 8.606 8.606 8.406 0.200 19504 295 1 5 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.590 -0.062 19504 296 1 5 . 1 1 7 7 LEU H H 7 7.784 7.784 7.816 -0.032 19504 297 1 5 . 1 1 8 8 SER HA H 8 4.275 4.275 3.990 0.285 19504 298 1 5 . 1 1 8 8 SER H H 8 8.678 8.678 8.232 0.446 19504 299 1 5 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.601 -0.426 19504 300 1 5 . 1 1 9 9 ASP H H 9 9.066 9.066 8.107 0.959 19504 301 1 5 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.998 -0.040 19504 302 1 5 . 1 1 10 10 GLN H H 10 8.689 8.689 8.845 -0.156 19504 303 1 5 . 1 1 11 11 THR HA H 11 4.045 4.045 4.243 -0.198 19504 304 1 5 . 1 1 11 11 THR H H 11 8.000 8.000 7.902 0.098 19504 305 1 5 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.049 -0.217 19504 306 1 5 . 1 1 12 12 LEU H H 12 8.482 8.482 8.080 0.402 19504 307 1 5 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.135 -0.104 19504 308 1 5 . 1 1 13 13 GLU H H 13 8.242 8.242 8.049 0.193 19504 309 1 5 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.356 0.028 19504 310 1 5 . 1 1 14 14 ASP H H 14 8.128 8.128 8.556 -0.428 19504 311 1 5 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.168 -0.150 19504 312 1 5 . 1 1 15 15 LEU H H 15 8.721 8.721 7.587 1.134 19504 313 1 5 . 1 1 16 16 GLU HA H 16 3.919 3.919 3.911 0.008 19504 314 1 5 . 1 1 16 16 GLU H H 16 8.468 8.468 8.028 0.440 19504 315 1 5 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.225 -0.237 19504 316 1 5 . 1 1 17 17 LYS H H 17 8.128 8.128 7.615 0.513 19504 317 1 5 . 1 1 18 18 MET HA H 18 4.115 4.115 4.664 -0.549 19504 318 1 5 . 1 1 18 18 MET H H 18 8.403 8.403 7.646 0.757 19504 319 1 5 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.027 -0.244 19504 320 1 5 . 1 1 19 19 ALA H H 19 8.719 8.719 7.899 0.820 19504 321 1 5 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.968 0.153 19504 322 1 5 . 1 1 20 20 ARG H H 20 7.889 7.889 7.935 -0.046 19504 323 1 5 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.089 -0.009 19504 324 1 5 . 1 1 21 21 ARG H H 21 7.968 7.968 8.486 -0.518 19504 325 1 5 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.491 -0.102 19504 326 1 5 . 1 1 22 22 GLU H H 22 8.035 8.035 8.273 -0.237 19504 327 1 5 . 1 1 23 23 GLY H H 23 7.912 7.912 7.982 -0.070 19504 328 1 5 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.910 0.930 19504 329 1 5 . 1 1 24 24 LEU H H 24 8.149 8.149 7.430 0.719 19504 330 1 5 . 1 1 25 25 SER HA H 25 4.563 4.563 4.385 0.178 19504 331 1 5 . 1 1 25 25 SER H H 25 8.182 8.182 8.198 -0.016 19504 332 1 5 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.000 -0.303 19504 333 1 5 . 1 1 26 26 LYS H H 26 9.270 9.270 8.893 0.377 19504 334 1 5 . 1 1 27 27 SER HA H 27 3.972 3.972 4.361 -0.389 19504 335 1 5 . 1 1 27 27 SER H H 27 8.615 8.615 8.192 0.423 19504 336 1 5 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.111 0.058 19504 337 1 5 . 1 1 28 28 GLU H H 28 7.969 7.969 7.586 0.383 19504 338 1 5 . 1 1 29 29 MET HA H 29 4.239 4.239 4.324 -0.085 19504 339 1 5 . 1 1 29 29 MET H H 29 8.768 8.768 8.537 0.231 19504 340 1 5 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.787 -0.412 19504 341 1 5 . 1 1 30 30 ILE H H 30 7.966 7.966 7.457 0.509 19504 342 1 5 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.436 -0.200 19504 343 1 5 . 1 1 31 31 ASN H H 31 7.862 7.862 8.412 -0.550 19504 344 1 5 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.785 -0.077 19504 345 1 5 . 1 1 32 32 VAL H H 32 8.463 8.463 7.809 0.654 19504 346 1 5 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.066 -0.251 19504 347 1 5 . 1 1 33 33 ALA H H 33 8.285 8.285 7.830 0.455 19504 348 1 5 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.189 -0.236 19504 349 1 5 . 1 1 34 34 LEU H H 34 8.506 8.506 7.476 1.030 19504 350 1 5 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.047 -0.048 19504 351 1 5 . 1 1 35 35 GLN H H 35 8.340 8.340 7.675 0.665 19504 352 1 5 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.757 -0.232 19504 353 1 5 . 1 1 36 36 HIS H H 36 7.859 7.859 7.715 0.144 19504 354 1 5 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.520 -0.222 19504 355 1 5 . 1 1 37 37 TYR H H 37 7.655 7.655 7.667 -0.012 19504 356 1 6 . 1 1 2 2 TRP HA H 2 5.088 5.088 5.129 -0.041 19504 357 1 6 . 1 1 2 2 TRP H H 2 9.010 9.010 8.658 0.352 19504 358 1 6 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.521 0.169 19504 359 1 6 . 1 1 3 3 LEU H H 3 9.506 9.506 8.395 1.111 19504 360 1 6 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.140 0.665 19504 361 1 6 . 1 1 4 4 CYS H H 4 8.997 8.997 8.369 0.628 19504 362 1 6 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.601 0.174 19504 363 1 6 . 1 1 5 5 ILE H H 5 9.319 9.319 8.417 0.902 19504 364 1 6 . 1 1 6 6 TRP HA H 6 4.356 4.356 5.011 -0.655 19504 365 1 6 . 1 1 6 6 TRP H H 6 8.606 8.606 8.363 0.243 19504 366 1 6 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.384 0.144 19504 367 1 6 . 1 1 7 7 LEU H H 7 7.784 7.784 7.951 -0.167 19504 368 1 6 . 1 1 8 8 SER HA H 8 4.275 4.275 4.147 0.128 19504 369 1 6 . 1 1 8 8 SER H H 8 8.678 8.678 7.849 0.829 19504 370 1 6 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.183 -0.008 19504 371 1 6 . 1 1 9 9 ASP H H 9 9.066 9.066 8.612 0.454 19504 372 1 6 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.032 -0.074 19504 373 1 6 . 1 1 10 10 GLN H H 10 8.689 8.689 8.779 -0.090 19504 374 1 6 . 1 1 11 11 THR HA H 11 4.045 4.045 4.300 -0.255 19504 375 1 6 . 1 1 11 11 THR H H 11 8.000 8.000 7.517 0.483 19504 376 1 6 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.032 -0.200 19504 377 1 6 . 1 1 12 12 LEU H H 12 8.482 8.482 8.073 0.409 19504 378 1 6 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.209 -0.178 19504 379 1 6 . 1 1 13 13 GLU H H 13 8.242 8.242 8.212 0.030 19504 380 1 6 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.416 -0.032 19504 381 1 6 . 1 1 14 14 ASP H H 14 8.128 8.128 7.514 0.614 19504 382 1 6 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.255 -0.237 19504 383 1 6 . 1 1 15 15 LEU H H 15 8.721 8.721 8.233 0.488 19504 384 1 6 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.231 -0.312 19504 385 1 6 . 1 1 16 16 GLU H H 16 8.468 8.468 7.752 0.716 19504 386 1 6 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.293 -0.305 19504 387 1 6 . 1 1 17 17 LYS H H 17 8.128 8.128 7.559 0.569 19504 388 1 6 . 1 1 18 18 MET HA H 18 4.115 4.115 4.841 -0.726 19504 389 1 6 . 1 1 18 18 MET H H 18 8.403 8.403 8.115 0.288 19504 390 1 6 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.393 -0.610 19504 391 1 6 . 1 1 19 19 ALA H H 19 8.719 8.719 8.084 0.635 19504 392 1 6 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.105 0.016 19504 393 1 6 . 1 1 20 20 ARG H H 20 7.889 7.889 7.655 0.234 19504 394 1 6 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.078 0.002 19504 395 1 6 . 1 1 21 21 ARG H H 21 7.968 7.968 8.715 -0.747 19504 396 1 6 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.385 0.004 19504 397 1 6 . 1 1 22 22 GLU H H 22 8.035 8.035 8.550 -0.515 19504 398 1 6 . 1 1 23 23 GLY H H 23 7.912 7.912 7.757 0.155 19504 399 1 6 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.851 0.989 19504 400 1 6 . 1 1 24 24 LEU H H 24 8.149 8.149 7.861 0.288 19504 401 1 6 . 1 1 25 25 SER HA H 25 4.563 4.563 4.412 0.151 19504 402 1 6 . 1 1 25 25 SER H H 25 8.182 8.182 8.076 0.106 19504 403 1 6 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.954 -0.257 19504 404 1 6 . 1 1 26 26 LYS H H 26 9.270 9.270 8.897 0.373 19504 405 1 6 . 1 1 27 27 SER HA H 27 3.972 3.972 4.357 -0.385 19504 406 1 6 . 1 1 27 27 SER H H 27 8.615 8.615 8.254 0.361 19504 407 1 6 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.037 0.132 19504 408 1 6 . 1 1 28 28 GLU H H 28 7.969 7.969 7.545 0.424 19504 409 1 6 . 1 1 29 29 MET HA H 29 4.239 4.239 4.310 -0.071 19504 410 1 6 . 1 1 29 29 MET H H 29 8.768 8.768 8.680 0.088 19504 411 1 6 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.786 -0.411 19504 412 1 6 . 1 1 30 30 ILE H H 30 7.966 7.966 7.380 0.586 19504 413 1 6 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.451 -0.215 19504 414 1 6 . 1 1 31 31 ASN H H 31 7.862 7.862 8.305 -0.443 19504 415 1 6 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.664 0.044 19504 416 1 6 . 1 1 32 32 VAL H H 32 8.463 8.463 7.997 0.466 19504 417 1 6 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.060 -0.245 19504 418 1 6 . 1 1 33 33 ALA H H 33 8.285 8.285 7.811 0.474 19504 419 1 6 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.232 -0.280 19504 420 1 6 . 1 1 34 34 LEU H H 34 8.506 8.506 7.456 1.050 19504 421 1 6 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.062 -0.063 19504 422 1 6 . 1 1 35 35 GLN H H 35 8.340 8.340 7.776 0.564 19504 423 1 6 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.609 -0.084 19504 424 1 6 . 1 1 36 36 HIS H H 36 7.859 7.859 7.765 0.094 19504 425 1 6 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.232 0.066 19504 426 1 6 . 1 1 37 37 TYR H H 37 7.655 7.655 7.963 -0.308 19504 427 1 7 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.958 0.130 19504 428 1 7 . 1 1 2 2 TRP H H 2 9.010 9.010 8.268 0.743 19504 429 1 7 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.779 -0.089 19504 430 1 7 . 1 1 3 3 LEU H H 3 9.506 9.506 8.413 1.093 19504 431 1 7 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.973 0.832 19504 432 1 7 . 1 1 4 4 CYS H H 4 8.997 8.997 8.696 0.301 19504 433 1 7 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.591 0.184 19504 434 1 7 . 1 1 5 5 ILE H H 5 9.319 9.319 8.436 0.883 19504 435 1 7 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.967 -0.611 19504 436 1 7 . 1 1 6 6 TRP H H 6 8.606 8.606 8.451 0.155 19504 437 1 7 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.549 -0.021 19504 438 1 7 . 1 1 7 7 LEU H H 7 7.784 7.784 7.875 -0.091 19504 439 1 7 . 1 1 8 8 SER HA H 8 4.275 4.275 4.103 0.172 19504 440 1 7 . 1 1 8 8 SER H H 8 8.678 8.678 8.284 0.394 19504 441 1 7 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.502 -0.327 19504 442 1 7 . 1 1 9 9 ASP H H 9 9.066 9.066 8.157 0.909 19504 443 1 7 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.003 -0.045 19504 444 1 7 . 1 1 10 10 GLN H H 10 8.689 8.689 8.677 0.012 19504 445 1 7 . 1 1 11 11 THR HA H 11 4.045 4.045 4.235 -0.190 19504 446 1 7 . 1 1 11 11 THR H H 11 8.000 8.000 7.784 0.216 19504 447 1 7 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.037 -0.205 19504 448 1 7 . 1 1 12 12 LEU H H 12 8.482 8.482 7.768 0.714 19504 449 1 7 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.084 -0.053 19504 450 1 7 . 1 1 13 13 GLU H H 13 8.242 8.242 8.246 -0.004 19504 451 1 7 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.345 0.039 19504 452 1 7 . 1 1 14 14 ASP H H 14 8.128 8.128 8.497 -0.369 19504 453 1 7 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.148 -0.130 19504 454 1 7 . 1 1 15 15 LEU H H 15 8.721 8.721 7.564 1.157 19504 455 1 7 . 1 1 16 16 GLU HA H 16 3.919 3.919 3.959 -0.040 19504 456 1 7 . 1 1 16 16 GLU H H 16 8.468 8.468 8.247 0.221 19504 457 1 7 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.378 -0.390 19504 458 1 7 . 1 1 17 17 LYS H H 17 8.128 8.128 7.518 0.610 19504 459 1 7 . 1 1 18 18 MET HA H 18 4.115 4.115 4.576 -0.461 19504 460 1 7 . 1 1 18 18 MET H H 18 8.403 8.403 7.647 0.756 19504 461 1 7 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.037 -0.254 19504 462 1 7 . 1 1 19 19 ALA H H 19 8.719 8.719 7.616 1.103 19504 463 1 7 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.055 0.066 19504 464 1 7 . 1 1 20 20 ARG H H 20 7.889 7.889 8.047 -0.158 19504 465 1 7 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.144 -0.064 19504 466 1 7 . 1 1 21 21 ARG H H 21 7.968 7.968 8.501 -0.533 19504 467 1 7 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.504 -0.115 19504 468 1 7 . 1 1 22 22 GLU H H 22 8.035 8.035 8.262 -0.227 19504 469 1 7 . 1 1 23 23 GLY H H 23 7.912 7.912 7.795 0.117 19504 470 1 7 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.891 0.949 19504 471 1 7 . 1 1 24 24 LEU H H 24 8.149 8.149 7.507 0.642 19504 472 1 7 . 1 1 25 25 SER HA H 25 4.563 4.563 4.427 0.136 19504 473 1 7 . 1 1 25 25 SER H H 25 8.182 8.182 8.080 0.102 19504 474 1 7 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.987 -0.290 19504 475 1 7 . 1 1 26 26 LYS H H 26 9.270 9.270 8.917 0.353 19504 476 1 7 . 1 1 27 27 SER HA H 27 3.972 3.972 4.401 -0.429 19504 477 1 7 . 1 1 27 27 SER H H 27 8.615 8.615 8.288 0.327 19504 478 1 7 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.158 0.011 19504 479 1 7 . 1 1 28 28 GLU H H 28 7.969 7.969 7.540 0.429 19504 480 1 7 . 1 1 29 29 MET HA H 29 4.239 4.239 4.322 -0.083 19504 481 1 7 . 1 1 29 29 MET H H 29 8.768 8.768 8.589 0.179 19504 482 1 7 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.892 -0.517 19504 483 1 7 . 1 1 30 30 ILE H H 30 7.966 7.966 7.633 0.333 19504 484 1 7 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.521 -0.285 19504 485 1 7 . 1 1 31 31 ASN H H 31 7.862 7.862 7.292 0.570 19504 486 1 7 . 1 1 32 32 VAL HA H 32 3.708 3.708 4.120 -0.412 19504 487 1 7 . 1 1 32 32 VAL H H 32 8.463 8.463 7.703 0.760 19504 488 1 7 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.105 -0.290 19504 489 1 7 . 1 1 33 33 ALA H H 33 8.285 8.285 7.742 0.543 19504 490 1 7 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.109 -0.157 19504 491 1 7 . 1 1 34 34 LEU H H 34 8.506 8.506 7.506 1.000 19504 492 1 7 . 1 1 35 35 GLN HA H 35 3.999 3.999 3.966 0.033 19504 493 1 7 . 1 1 35 35 GLN H H 35 8.340 8.340 7.692 0.648 19504 494 1 7 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.575 -0.050 19504 495 1 7 . 1 1 36 36 HIS H H 36 7.859 7.859 6.994 0.865 19504 496 1 7 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.174 0.124 19504 497 1 7 . 1 1 37 37 TYR H H 37 7.655 7.655 7.136 0.519 19504 498 1 8 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.757 0.331 19504 499 1 8 . 1 1 2 2 TRP H H 2 9.010 9.010 8.310 0.700 19504 500 1 8 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.738 -0.048 19504 501 1 8 . 1 1 3 3 LEU H H 3 9.506 9.506 8.432 1.074 19504 502 1 8 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.983 0.822 19504 503 1 8 . 1 1 4 4 CYS H H 4 8.997 8.997 8.698 0.299 19504 504 1 8 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.620 0.155 19504 505 1 8 . 1 1 5 5 ILE H H 5 9.319 9.319 8.419 0.900 19504 506 1 8 . 1 1 6 6 TRP HA H 6 4.356 4.356 5.018 -0.662 19504 507 1 8 . 1 1 6 6 TRP H H 6 8.606 8.606 8.337 0.269 19504 508 1 8 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.449 0.079 19504 509 1 8 . 1 1 7 7 LEU H H 7 7.784 7.784 7.934 -0.150 19504 510 1 8 . 1 1 8 8 SER HA H 8 4.275 4.275 4.110 0.165 19504 511 1 8 . 1 1 8 8 SER H H 8 8.678 8.678 7.850 0.828 19504 512 1 8 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.189 -0.014 19504 513 1 8 . 1 1 9 9 ASP H H 9 9.066 9.066 8.593 0.473 19504 514 1 8 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.995 -0.037 19504 515 1 8 . 1 1 10 10 GLN H H 10 8.689 8.689 8.231 0.458 19504 516 1 8 . 1 1 11 11 THR HA H 11 4.045 4.045 4.392 -0.347 19504 517 1 8 . 1 1 11 11 THR H H 11 8.000 8.000 7.459 0.541 19504 518 1 8 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.020 -0.188 19504 519 1 8 . 1 1 12 12 LEU H H 12 8.482 8.482 7.561 0.921 19504 520 1 8 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.154 -0.123 19504 521 1 8 . 1 1 13 13 GLU H H 13 8.242 8.242 7.976 0.266 19504 522 1 8 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.387 -0.003 19504 523 1 8 . 1 1 14 14 ASP H H 14 8.128 8.128 7.627 0.501 19504 524 1 8 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.277 -0.259 19504 525 1 8 . 1 1 15 15 LEU H H 15 8.721 8.721 7.895 0.826 19504 526 1 8 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.306 -0.387 19504 527 1 8 . 1 1 16 16 GLU H H 16 8.468 8.468 8.125 0.343 19504 528 1 8 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.328 -0.340 19504 529 1 8 . 1 1 17 17 LYS H H 17 8.128 8.128 7.442 0.686 19504 530 1 8 . 1 1 18 18 MET HA H 18 4.115 4.115 4.188 -0.073 19504 531 1 8 . 1 1 18 18 MET H H 18 8.403 8.403 7.829 0.574 19504 532 1 8 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.057 -0.274 19504 533 1 8 . 1 1 19 19 ALA H H 19 8.719 8.719 8.100 0.619 19504 534 1 8 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.005 0.116 19504 535 1 8 . 1 1 20 20 ARG H H 20 7.889 7.889 7.606 0.283 19504 536 1 8 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.080 -0.000 19504 537 1 8 . 1 1 21 21 ARG H H 21 7.968 7.968 8.618 -0.650 19504 538 1 8 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.471 -0.082 19504 539 1 8 . 1 1 22 22 GLU H H 22 8.035 8.035 8.070 -0.035 19504 540 1 8 . 1 1 23 23 GLY H H 23 7.912 7.912 7.930 -0.018 19504 541 1 8 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.889 0.951 19504 542 1 8 . 1 1 24 24 LEU H H 24 8.149 8.149 7.549 0.600 19504 543 1 8 . 1 1 25 25 SER HA H 25 4.563 4.563 4.433 0.130 19504 544 1 8 . 1 1 25 25 SER H H 25 8.182 8.182 8.093 0.089 19504 545 1 8 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.012 -0.315 19504 546 1 8 . 1 1 26 26 LYS H H 26 9.270 9.270 8.999 0.271 19504 547 1 8 . 1 1 27 27 SER HA H 27 3.972 3.972 4.379 -0.407 19504 548 1 8 . 1 1 27 27 SER H H 27 8.615 8.615 8.191 0.424 19504 549 1 8 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.050 0.119 19504 550 1 8 . 1 1 28 28 GLU H H 28 7.969 7.969 7.503 0.466 19504 551 1 8 . 1 1 29 29 MET HA H 29 4.239 4.239 4.373 -0.134 19504 552 1 8 . 1 1 29 29 MET H H 29 8.768 8.768 8.667 0.101 19504 553 1 8 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.809 -0.434 19504 554 1 8 . 1 1 30 30 ILE H H 30 7.966 7.966 7.396 0.570 19504 555 1 8 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.506 -0.270 19504 556 1 8 . 1 1 31 31 ASN H H 31 7.862 7.862 8.240 -0.378 19504 557 1 8 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.727 -0.019 19504 558 1 8 . 1 1 32 32 VAL H H 32 8.463 8.463 7.858 0.605 19504 559 1 8 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.080 -0.265 19504 560 1 8 . 1 1 33 33 ALA H H 33 8.285 8.285 7.825 0.460 19504 561 1 8 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.181 -0.229 19504 562 1 8 . 1 1 34 34 LEU H H 34 8.506 8.506 7.573 0.933 19504 563 1 8 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.063 -0.064 19504 564 1 8 . 1 1 35 35 GLN H H 35 8.340 8.340 7.503 0.837 19504 565 1 8 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.577 -0.052 19504 566 1 8 . 1 1 36 36 HIS H H 36 7.859 7.859 7.566 0.293 19504 567 1 8 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.175 0.123 19504 568 1 8 . 1 1 37 37 TYR H H 37 7.655 7.655 8.164 -0.509 19504 569 1 9 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.871 0.217 19504 570 1 9 . 1 1 2 2 TRP H H 2 9.010 9.010 8.323 0.687 19504 571 1 9 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.753 -0.063 19504 572 1 9 . 1 1 3 3 LEU H H 3 9.506 9.506 8.437 1.069 19504 573 1 9 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.963 0.842 19504 574 1 9 . 1 1 4 4 CYS H H 4 8.997 8.997 8.742 0.255 19504 575 1 9 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.609 0.166 19504 576 1 9 . 1 1 5 5 ILE H H 5 9.319 9.319 8.368 0.951 19504 577 1 9 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.976 -0.620 19504 578 1 9 . 1 1 6 6 TRP H H 6 8.606 8.606 8.383 0.223 19504 579 1 9 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.439 0.089 19504 580 1 9 . 1 1 7 7 LEU H H 7 7.784 7.784 7.995 -0.211 19504 581 1 9 . 1 1 8 8 SER HA H 8 4.275 4.275 3.979 0.296 19504 582 1 9 . 1 1 8 8 SER H H 8 8.678 8.678 8.210 0.468 19504 583 1 9 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.521 -0.346 19504 584 1 9 . 1 1 9 9 ASP H H 9 9.066 9.066 8.521 0.545 19504 585 1 9 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.205 -0.247 19504 586 1 9 . 1 1 10 10 GLN H H 10 8.689 8.689 8.540 0.149 19504 587 1 9 . 1 1 11 11 THR HA H 11 4.045 4.045 4.255 -0.210 19504 588 1 9 . 1 1 11 11 THR H H 11 8.000 8.000 8.543 -0.543 19504 589 1 9 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.037 -0.205 19504 590 1 9 . 1 1 12 12 LEU H H 12 8.482 8.482 7.741 0.741 19504 591 1 9 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.935 0.096 19504 592 1 9 . 1 1 13 13 GLU H H 13 8.242 8.242 7.684 0.558 19504 593 1 9 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.359 0.025 19504 594 1 9 . 1 1 14 14 ASP H H 14 8.128 8.128 7.868 0.260 19504 595 1 9 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.329 -0.311 19504 596 1 9 . 1 1 15 15 LEU H H 15 8.721 8.721 7.445 1.276 19504 597 1 9 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.430 -0.511 19504 598 1 9 . 1 1 16 16 GLU H H 16 8.468 8.468 8.119 0.349 19504 599 1 9 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.193 -0.205 19504 600 1 9 . 1 1 17 17 LYS H H 17 8.128 8.128 7.993 0.135 19504 601 1 9 . 1 1 18 18 MET HA H 18 4.115 4.115 4.276 -0.161 19504 602 1 9 . 1 1 18 18 MET H H 18 8.403 8.403 7.449 0.954 19504 603 1 9 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.093 -0.310 19504 604 1 9 . 1 1 19 19 ALA H H 19 8.719 8.719 8.262 0.457 19504 605 1 9 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.995 0.126 19504 606 1 9 . 1 1 20 20 ARG H H 20 7.889 7.889 7.745 0.144 19504 607 1 9 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.096 -0.016 19504 608 1 9 . 1 1 21 21 ARG H H 21 7.968 7.968 8.565 -0.597 19504 609 1 9 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.534 -0.145 19504 610 1 9 . 1 1 22 22 GLU H H 22 8.035 8.035 8.148 -0.113 19504 611 1 9 . 1 1 23 23 GLY H H 23 7.912 7.912 7.958 -0.046 19504 612 1 9 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.857 0.983 19504 613 1 9 . 1 1 24 24 LEU H H 24 8.149 8.149 7.543 0.606 19504 614 1 9 . 1 1 25 25 SER HA H 25 4.563 4.563 4.375 0.188 19504 615 1 9 . 1 1 25 25 SER H H 25 8.182 8.182 8.257 -0.075 19504 616 1 9 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.975 -0.278 19504 617 1 9 . 1 1 26 26 LYS H H 26 9.270 9.270 8.782 0.488 19504 618 1 9 . 1 1 27 27 SER HA H 27 3.972 3.972 4.296 -0.324 19504 619 1 9 . 1 1 27 27 SER H H 27 8.615 8.615 8.199 0.416 19504 620 1 9 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.038 0.131 19504 621 1 9 . 1 1 28 28 GLU H H 28 7.969 7.969 8.308 -0.339 19504 622 1 9 . 1 1 29 29 MET HA H 29 4.239 4.239 4.332 -0.093 19504 623 1 9 . 1 1 29 29 MET H H 29 8.768 8.768 8.696 0.072 19504 624 1 9 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.806 -0.431 19504 625 1 9 . 1 1 30 30 ILE H H 30 7.966 7.966 7.707 0.259 19504 626 1 9 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.573 -0.337 19504 627 1 9 . 1 1 31 31 ASN H H 31 7.862 7.862 7.245 0.617 19504 628 1 9 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.498 0.210 19504 629 1 9 . 1 1 32 32 VAL H H 32 8.463 8.463 7.730 0.733 19504 630 1 9 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.726 0.089 19504 631 1 9 . 1 1 33 33 ALA H H 33 8.285 8.285 7.666 0.619 19504 632 1 9 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.153 -0.201 19504 633 1 9 . 1 1 34 34 LEU H H 34 8.506 8.506 7.376 1.130 19504 634 1 9 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.151 -0.152 19504 635 1 9 . 1 1 35 35 GLN H H 35 8.340 8.340 7.391 0.949 19504 636 1 9 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.737 -0.212 19504 637 1 9 . 1 1 36 36 HIS H H 36 7.859 7.859 8.203 -0.344 19504 638 1 9 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.388 -0.090 19504 639 1 9 . 1 1 37 37 TYR H H 37 7.655 7.655 7.806 -0.151 19504 640 1 10 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.677 0.411 19504 641 1 10 . 1 1 2 2 TRP H H 2 9.010 9.010 8.246 0.764 19504 642 1 10 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.725 -0.035 19504 643 1 10 . 1 1 3 3 LEU H H 3 9.506 9.506 8.377 1.129 19504 644 1 10 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.988 0.817 19504 645 1 10 . 1 1 4 4 CYS H H 4 8.997 8.997 8.728 0.269 19504 646 1 10 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.664 0.111 19504 647 1 10 . 1 1 5 5 ILE H H 5 9.319 9.319 8.472 0.847 19504 648 1 10 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.976 -0.620 19504 649 1 10 . 1 1 6 6 TRP H H 6 8.606 8.606 8.382 0.224 19504 650 1 10 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.474 0.054 19504 651 1 10 . 1 1 7 7 LEU H H 7 7.784 7.784 7.850 -0.066 19504 652 1 10 . 1 1 8 8 SER HA H 8 4.275 4.275 4.153 0.122 19504 653 1 10 . 1 1 8 8 SER H H 8 8.678 8.678 7.890 0.788 19504 654 1 10 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.192 -0.017 19504 655 1 10 . 1 1 9 9 ASP H H 9 9.066 9.066 8.587 0.479 19504 656 1 10 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.050 -0.092 19504 657 1 10 . 1 1 10 10 GLN H H 10 8.689 8.689 8.014 0.675 19504 658 1 10 . 1 1 11 11 THR HA H 11 4.045 4.045 4.426 -0.381 19504 659 1 10 . 1 1 11 11 THR H H 11 8.000 8.000 7.549 0.451 19504 660 1 10 . 1 1 12 12 LEU HA H 12 3.832 3.832 3.969 -0.137 19504 661 1 10 . 1 1 12 12 LEU H H 12 8.482 8.482 7.858 0.624 19504 662 1 10 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.966 0.065 19504 663 1 10 . 1 1 13 13 GLU H H 13 8.242 8.242 8.095 0.147 19504 664 1 10 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.387 -0.003 19504 665 1 10 . 1 1 14 14 ASP H H 14 8.128 8.128 7.943 0.185 19504 666 1 10 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.225 -0.207 19504 667 1 10 . 1 1 15 15 LEU H H 15 8.721 8.721 7.589 1.132 19504 668 1 10 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.344 -0.425 19504 669 1 10 . 1 1 16 16 GLU H H 16 8.468 8.468 8.237 0.231 19504 670 1 10 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.168 -0.180 19504 671 1 10 . 1 1 17 17 LYS H H 17 8.128 8.128 7.471 0.657 19504 672 1 10 . 1 1 18 18 MET HA H 18 4.115 4.115 4.515 -0.400 19504 673 1 10 . 1 1 18 18 MET H H 18 8.403 8.403 7.600 0.803 19504 674 1 10 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.923 -0.140 19504 675 1 10 . 1 1 19 19 ALA H H 19 8.719 8.719 8.038 0.681 19504 676 1 10 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.076 0.045 19504 677 1 10 . 1 1 20 20 ARG H H 20 7.889 7.889 7.686 0.203 19504 678 1 10 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.112 -0.032 19504 679 1 10 . 1 1 21 21 ARG H H 21 7.968 7.968 7.836 0.132 19504 680 1 10 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.322 0.067 19504 681 1 10 . 1 1 22 22 GLU H H 22 8.035 8.035 8.270 -0.235 19504 682 1 10 . 1 1 23 23 GLY H H 23 7.912 7.912 8.079 -0.167 19504 683 1 10 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.596 0.244 19504 684 1 10 . 1 1 24 24 LEU H H 24 8.149 8.149 7.981 0.168 19504 685 1 10 . 1 1 25 25 SER HA H 25 4.563 4.563 4.755 -0.192 19504 686 1 10 . 1 1 25 25 SER H H 25 8.182 8.182 8.109 0.073 19504 687 1 10 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.992 -0.295 19504 688 1 10 . 1 1 26 26 LYS H H 26 9.270 9.270 8.845 0.425 19504 689 1 10 . 1 1 27 27 SER HA H 27 3.972 3.972 4.385 -0.413 19504 690 1 10 . 1 1 27 27 SER H H 27 8.615 8.615 7.646 0.969 19504 691 1 10 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.101 0.068 19504 692 1 10 . 1 1 28 28 GLU H H 28 7.969 7.969 7.672 0.297 19504 693 1 10 . 1 1 29 29 MET HA H 29 4.239 4.239 4.394 -0.155 19504 694 1 10 . 1 1 29 29 MET H H 29 8.768 8.768 8.358 0.410 19504 695 1 10 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.780 -0.405 19504 696 1 10 . 1 1 30 30 ILE H H 30 7.966 7.966 7.367 0.599 19504 697 1 10 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.493 -0.257 19504 698 1 10 . 1 1 31 31 ASN H H 31 7.862 7.862 8.614 -0.752 19504 699 1 10 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.802 -0.094 19504 700 1 10 . 1 1 32 32 VAL H H 32 8.463 8.463 7.439 1.024 19504 701 1 10 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.133 -0.318 19504 702 1 10 . 1 1 33 33 ALA H H 33 8.285 8.285 7.794 0.491 19504 703 1 10 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.246 -0.294 19504 704 1 10 . 1 1 34 34 LEU H H 34 8.506 8.506 7.503 1.003 19504 705 1 10 . 1 1 35 35 GLN HA H 35 3.999 3.999 3.991 0.008 19504 706 1 10 . 1 1 35 35 GLN H H 35 8.340 8.340 7.877 0.463 19504 707 1 10 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.774 -0.249 19504 708 1 10 . 1 1 36 36 HIS H H 36 7.859 7.859 7.594 0.265 19504 709 1 10 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.521 -0.223 19504 710 1 10 . 1 1 37 37 TYR H H 37 7.655 7.655 7.630 0.025 19504 711 1 11 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.770 0.318 19504 712 1 11 . 1 1 2 2 TRP H H 2 9.010 9.010 8.351 0.659 19504 713 1 11 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.698 -0.008 19504 714 1 11 . 1 1 3 3 LEU H H 3 9.506 9.506 8.575 0.931 19504 715 1 11 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.903 0.902 19504 716 1 11 . 1 1 4 4 CYS H H 4 8.997 8.997 8.698 0.299 19504 717 1 11 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.666 0.109 19504 718 1 11 . 1 1 5 5 ILE H H 5 9.319 9.319 8.401 0.918 19504 719 1 11 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.968 -0.612 19504 720 1 11 . 1 1 6 6 TRP H H 6 8.606 8.606 8.402 0.204 19504 721 1 11 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.437 0.091 19504 722 1 11 . 1 1 7 7 LEU H H 7 7.784 7.784 7.918 -0.134 19504 723 1 11 . 1 1 8 8 SER HA H 8 4.275 4.275 3.935 0.340 19504 724 1 11 . 1 1 8 8 SER H H 8 8.678 8.678 8.330 0.348 19504 725 1 11 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.551 -0.376 19504 726 1 11 . 1 1 9 9 ASP H H 9 9.066 9.066 8.347 0.719 19504 727 1 11 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.279 -0.321 19504 728 1 11 . 1 1 10 10 GLN H H 10 8.689 8.689 8.147 0.542 19504 729 1 11 . 1 1 11 11 THR HA H 11 4.045 4.045 4.332 -0.287 19504 730 1 11 . 1 1 11 11 THR H H 11 8.000 8.000 8.285 -0.285 19504 731 1 11 . 1 1 12 12 LEU HA H 12 3.832 3.832 3.933 -0.101 19504 732 1 11 . 1 1 12 12 LEU H H 12 8.482 8.482 8.051 0.431 19504 733 1 11 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.964 0.067 19504 734 1 11 . 1 1 13 13 GLU H H 13 8.242 8.242 7.612 0.630 19504 735 1 11 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.382 0.002 19504 736 1 11 . 1 1 14 14 ASP H H 14 8.128 8.128 8.164 -0.036 19504 737 1 11 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.282 -0.264 19504 738 1 11 . 1 1 15 15 LEU H H 15 8.721 8.721 7.227 1.494 19504 739 1 11 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.385 -0.466 19504 740 1 11 . 1 1 16 16 GLU H H 16 8.468 8.468 8.137 0.331 19504 741 1 11 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.225 -0.237 19504 742 1 11 . 1 1 17 17 LYS H H 17 8.128 8.128 8.296 -0.168 19504 743 1 11 . 1 1 18 18 MET HA H 18 4.115 4.115 4.472 -0.357 19504 744 1 11 . 1 1 18 18 MET H H 18 8.403 8.403 7.650 0.753 19504 745 1 11 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.094 -0.311 19504 746 1 11 . 1 1 19 19 ALA H H 19 8.719 8.719 8.247 0.472 19504 747 1 11 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.174 -0.053 19504 748 1 11 . 1 1 20 20 ARG H H 20 7.889 7.889 7.652 0.237 19504 749 1 11 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.092 -0.012 19504 750 1 11 . 1 1 21 21 ARG H H 21 7.968 7.968 8.696 -0.728 19504 751 1 11 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.496 -0.107 19504 752 1 11 . 1 1 22 22 GLU H H 22 8.035 8.035 7.916 0.119 19504 753 1 11 . 1 1 23 23 GLY H H 23 7.912 7.912 8.130 -0.218 19504 754 1 11 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.911 0.929 19504 755 1 11 . 1 1 24 24 LEU H H 24 8.149 8.149 7.651 0.498 19504 756 1 11 . 1 1 25 25 SER HA H 25 4.563 4.563 4.384 0.179 19504 757 1 11 . 1 1 25 25 SER H H 25 8.182 8.182 8.257 -0.075 19504 758 1 11 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.944 -0.247 19504 759 1 11 . 1 1 26 26 LYS H H 26 9.270 9.270 8.848 0.422 19504 760 1 11 . 1 1 27 27 SER HA H 27 3.972 3.972 4.283 -0.311 19504 761 1 11 . 1 1 27 27 SER H H 27 8.615 8.615 8.241 0.374 19504 762 1 11 . 1 1 28 28 GLU HA H 28 4.169 4.169 3.962 0.207 19504 763 1 11 . 1 1 28 28 GLU H H 28 7.969 7.969 7.601 0.368 19504 764 1 11 . 1 1 29 29 MET HA H 29 4.239 4.239 4.326 -0.087 19504 765 1 11 . 1 1 29 29 MET H H 29 8.768 8.768 8.711 0.057 19504 766 1 11 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.767 -0.392 19504 767 1 11 . 1 1 30 30 ILE H H 30 7.966 7.966 7.575 0.391 19504 768 1 11 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.538 -0.302 19504 769 1 11 . 1 1 31 31 ASN H H 31 7.862 7.862 7.724 0.138 19504 770 1 11 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.392 0.316 19504 771 1 11 . 1 1 32 32 VAL H H 32 8.463 8.463 7.807 0.656 19504 772 1 11 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.062 -0.247 19504 773 1 11 . 1 1 33 33 ALA H H 33 8.285 8.285 7.574 0.711 19504 774 1 11 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.293 -0.341 19504 775 1 11 . 1 1 34 34 LEU H H 34 8.506 8.506 7.535 0.971 19504 776 1 11 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.259 -0.260 19504 777 1 11 . 1 1 35 35 GLN H H 35 8.340 8.340 7.909 0.431 19504 778 1 11 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.757 -0.232 19504 779 1 11 . 1 1 36 36 HIS H H 36 7.859 7.859 8.335 -0.476 19504 780 1 11 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.606 -0.308 19504 781 1 11 . 1 1 37 37 TYR H H 37 7.655 7.655 7.786 -0.131 19504 782 1 12 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.952 0.136 19504 783 1 12 . 1 1 2 2 TRP H H 2 9.010 9.010 8.269 0.741 19504 784 1 12 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.780 -0.090 19504 785 1 12 . 1 1 3 3 LEU H H 3 9.506 9.506 8.401 1.105 19504 786 1 12 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.966 0.839 19504 787 1 12 . 1 1 4 4 CYS H H 4 8.997 8.997 8.686 0.311 19504 788 1 12 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.597 0.178 19504 789 1 12 . 1 1 5 5 ILE H H 5 9.319 9.319 8.432 0.887 19504 790 1 12 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.980 -0.624 19504 791 1 12 . 1 1 6 6 TRP H H 6 8.606 8.606 8.422 0.184 19504 792 1 12 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.472 0.056 19504 793 1 12 . 1 1 7 7 LEU H H 7 7.784 7.784 7.883 -0.099 19504 794 1 12 . 1 1 8 8 SER HA H 8 4.275 4.275 4.099 0.176 19504 795 1 12 . 1 1 8 8 SER H H 8 8.678 8.678 7.913 0.765 19504 796 1 12 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.191 -0.016 19504 797 1 12 . 1 1 9 9 ASP H H 9 9.066 9.066 8.586 0.480 19504 798 1 12 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.017 -0.059 19504 799 1 12 . 1 1 10 10 GLN H H 10 8.689 8.689 8.134 0.555 19504 800 1 12 . 1 1 11 11 THR HA H 11 4.045 4.045 4.348 -0.303 19504 801 1 12 . 1 1 11 11 THR H H 11 8.000 8.000 7.461 0.539 19504 802 1 12 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.039 -0.207 19504 803 1 12 . 1 1 12 12 LEU H H 12 8.482 8.482 7.748 0.734 19504 804 1 12 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.296 -0.265 19504 805 1 12 . 1 1 13 13 GLU H H 13 8.242 8.242 8.463 -0.221 19504 806 1 12 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.390 -0.006 19504 807 1 12 . 1 1 14 14 ASP H H 14 8.128 8.128 7.609 0.519 19504 808 1 12 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.295 -0.277 19504 809 1 12 . 1 1 15 15 LEU H H 15 8.721 8.721 7.678 1.043 19504 810 1 12 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.336 -0.417 19504 811 1 12 . 1 1 16 16 GLU H H 16 8.468 8.468 8.283 0.185 19504 812 1 12 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.122 -0.134 19504 813 1 12 . 1 1 17 17 LYS H H 17 8.128 8.128 7.407 0.721 19504 814 1 12 . 1 1 18 18 MET HA H 18 4.115 4.115 4.375 -0.260 19504 815 1 12 . 1 1 18 18 MET H H 18 8.403 8.403 7.494 0.909 19504 816 1 12 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.058 -0.275 19504 817 1 12 . 1 1 19 19 ALA H H 19 8.719 8.719 8.095 0.624 19504 818 1 12 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.074 0.047 19504 819 1 12 . 1 1 20 20 ARG H H 20 7.889 7.889 7.768 0.121 19504 820 1 12 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.110 -0.030 19504 821 1 12 . 1 1 21 21 ARG H H 21 7.968 7.968 8.649 -0.681 19504 822 1 12 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.496 -0.107 19504 823 1 12 . 1 1 22 22 GLU H H 22 8.035 8.035 8.063 -0.028 19504 824 1 12 . 1 1 23 23 GLY H H 23 7.912 7.912 7.838 0.074 19504 825 1 12 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.906 0.934 19504 826 1 12 . 1 1 24 24 LEU H H 24 8.149 8.149 7.550 0.599 19504 827 1 12 . 1 1 25 25 SER HA H 25 4.563 4.563 4.407 0.156 19504 828 1 12 . 1 1 25 25 SER H H 25 8.182 8.182 8.313 -0.131 19504 829 1 12 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.983 -0.286 19504 830 1 12 . 1 1 26 26 LYS H H 26 9.270 9.270 8.973 0.297 19504 831 1 12 . 1 1 27 27 SER HA H 27 3.972 3.972 4.408 -0.436 19504 832 1 12 . 1 1 27 27 SER H H 27 8.615 8.615 8.184 0.431 19504 833 1 12 . 1 1 28 28 GLU HA H 28 4.169 4.169 3.996 0.173 19504 834 1 12 . 1 1 28 28 GLU H H 28 7.969 7.969 7.569 0.400 19504 835 1 12 . 1 1 29 29 MET HA H 29 4.239 4.239 4.283 -0.044 19504 836 1 12 . 1 1 29 29 MET H H 29 8.768 8.768 8.681 0.087 19504 837 1 12 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.773 -0.398 19504 838 1 12 . 1 1 30 30 ILE H H 30 7.966 7.966 7.399 0.567 19504 839 1 12 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.451 -0.215 19504 840 1 12 . 1 1 31 31 ASN H H 31 7.862 7.862 8.525 -0.663 19504 841 1 12 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.768 -0.060 19504 842 1 12 . 1 1 32 32 VAL H H 32 8.463 8.463 7.866 0.597 19504 843 1 12 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.120 -0.305 19504 844 1 12 . 1 1 33 33 ALA H H 33 8.285 8.285 7.754 0.531 19504 845 1 12 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.155 -0.203 19504 846 1 12 . 1 1 34 34 LEU H H 34 8.506 8.506 7.602 0.904 19504 847 1 12 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.078 -0.079 19504 848 1 12 . 1 1 35 35 GLN H H 35 8.340 8.340 7.847 0.493 19504 849 1 12 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.620 -0.095 19504 850 1 12 . 1 1 36 36 HIS H H 36 7.859 7.859 7.677 0.182 19504 851 1 12 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.065 0.233 19504 852 1 12 . 1 1 37 37 TYR H H 37 7.655 7.655 8.138 -0.483 19504 853 1 13 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.892 0.196 19504 854 1 13 . 1 1 2 2 TRP H H 2 9.010 9.010 8.353 0.657 19504 855 1 13 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.699 -0.009 19504 856 1 13 . 1 1 3 3 LEU H H 3 9.506 9.506 8.570 0.936 19504 857 1 13 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.925 0.880 19504 858 1 13 . 1 1 4 4 CYS H H 4 8.997 8.997 8.645 0.352 19504 859 1 13 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.629 0.146 19504 860 1 13 . 1 1 5 5 ILE H H 5 9.319 9.319 8.462 0.857 19504 861 1 13 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.965 -0.609 19504 862 1 13 . 1 1 6 6 TRP H H 6 8.606 8.606 8.449 0.157 19504 863 1 13 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.570 -0.042 19504 864 1 13 . 1 1 7 7 LEU H H 7 7.784 7.784 7.892 -0.108 19504 865 1 13 . 1 1 8 8 SER HA H 8 4.275 4.275 4.124 0.151 19504 866 1 13 . 1 1 8 8 SER H H 8 8.678 8.678 8.343 0.335 19504 867 1 13 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.344 -0.169 19504 868 1 13 . 1 1 9 9 ASP H H 9 9.066 9.066 8.067 0.999 19504 869 1 13 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.966 -0.008 19504 870 1 13 . 1 1 10 10 GLN H H 10 8.689 8.689 8.668 0.021 19504 871 1 13 . 1 1 11 11 THR HA H 11 4.045 4.045 4.224 -0.179 19504 872 1 13 . 1 1 11 11 THR H H 11 8.000 8.000 7.777 0.223 19504 873 1 13 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.095 -0.263 19504 874 1 13 . 1 1 12 12 LEU H H 12 8.482 8.482 7.990 0.492 19504 875 1 13 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.007 0.024 19504 876 1 13 . 1 1 13 13 GLU H H 13 8.242 8.242 8.089 0.153 19504 877 1 13 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.364 0.020 19504 878 1 13 . 1 1 14 14 ASP H H 14 8.128 8.128 8.476 -0.348 19504 879 1 13 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.307 -0.289 19504 880 1 13 . 1 1 15 15 LEU H H 15 8.721 8.721 7.416 1.305 19504 881 1 13 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.149 -0.230 19504 882 1 13 . 1 1 16 16 GLU H H 16 8.468 8.468 7.565 0.903 19504 883 1 13 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.404 -0.416 19504 884 1 13 . 1 1 17 17 LYS H H 17 8.128 8.128 8.366 -0.238 19504 885 1 13 . 1 1 18 18 MET HA H 18 4.115 4.115 4.454 -0.339 19504 886 1 13 . 1 1 18 18 MET H H 18 8.403 8.403 7.762 0.641 19504 887 1 13 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.115 -0.332 19504 888 1 13 . 1 1 19 19 ALA H H 19 8.719 8.719 8.340 0.379 19504 889 1 13 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.104 0.017 19504 890 1 13 . 1 1 20 20 ARG H H 20 7.889 7.889 8.047 -0.158 19504 891 1 13 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.097 -0.017 19504 892 1 13 . 1 1 21 21 ARG H H 21 7.968 7.968 8.535 -0.567 19504 893 1 13 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.502 -0.113 19504 894 1 13 . 1 1 22 22 GLU H H 22 8.035 8.035 8.084 -0.049 19504 895 1 13 . 1 1 23 23 GLY H H 23 7.912 7.912 7.735 0.177 19504 896 1 13 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.884 0.956 19504 897 1 13 . 1 1 24 24 LEU H H 24 8.149 8.149 7.489 0.660 19504 898 1 13 . 1 1 25 25 SER HA H 25 4.563 4.563 4.486 0.077 19504 899 1 13 . 1 1 25 25 SER H H 25 8.182 8.182 8.131 0.051 19504 900 1 13 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.987 -0.290 19504 901 1 13 . 1 1 26 26 LYS H H 26 9.270 9.270 8.967 0.303 19504 902 1 13 . 1 1 27 27 SER HA H 27 3.972 3.972 4.381 -0.409 19504 903 1 13 . 1 1 27 27 SER H H 27 8.615 8.615 8.131 0.484 19504 904 1 13 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.079 0.090 19504 905 1 13 . 1 1 28 28 GLU H H 28 7.969 7.969 8.305 -0.336 19504 906 1 13 . 1 1 29 29 MET HA H 29 4.239 4.239 4.321 -0.082 19504 907 1 13 . 1 1 29 29 MET H H 29 8.768 8.768 8.982 -0.214 19504 908 1 13 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.826 -0.451 19504 909 1 13 . 1 1 30 30 ILE H H 30 7.966 7.966 7.612 0.354 19504 910 1 13 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.523 -0.287 19504 911 1 13 . 1 1 31 31 ASN H H 31 7.862 7.862 7.821 0.041 19504 912 1 13 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.742 -0.034 19504 913 1 13 . 1 1 32 32 VAL H H 32 8.463 8.463 8.027 0.436 19504 914 1 13 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.090 -0.275 19504 915 1 13 . 1 1 33 33 ALA H H 33 8.285 8.285 7.888 0.397 19504 916 1 13 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.402 -0.450 19504 917 1 13 . 1 1 34 34 LEU H H 34 8.506 8.506 7.747 0.759 19504 918 1 13 . 1 1 35 35 GLN HA H 35 3.999 3.999 3.963 0.036 19504 919 1 13 . 1 1 35 35 GLN H H 35 8.340 8.340 7.795 0.545 19504 920 1 13 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.753 -0.228 19504 921 1 13 . 1 1 36 36 HIS H H 36 7.859 7.859 7.607 0.252 19504 922 1 13 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.510 -0.211 19504 923 1 13 . 1 1 37 37 TYR H H 37 7.655 7.655 7.708 -0.053 19504 924 1 14 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.961 0.127 19504 925 1 14 . 1 1 2 2 TRP H H 2 9.010 9.010 8.256 0.754 19504 926 1 14 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.783 -0.093 19504 927 1 14 . 1 1 3 3 LEU H H 3 9.506 9.506 8.460 1.046 19504 928 1 14 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.993 0.812 19504 929 1 14 . 1 1 4 4 CYS H H 4 8.997 8.997 8.719 0.278 19504 930 1 14 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.656 0.119 19504 931 1 14 . 1 1 5 5 ILE H H 5 9.319 9.319 8.454 0.865 19504 932 1 14 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.957 -0.601 19504 933 1 14 . 1 1 6 6 TRP H H 6 8.606 8.606 8.392 0.214 19504 934 1 14 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.545 -0.017 19504 935 1 14 . 1 1 7 7 LEU H H 7 7.784 7.784 7.908 -0.124 19504 936 1 14 . 1 1 8 8 SER HA H 8 4.275 4.275 3.978 0.297 19504 937 1 14 . 1 1 8 8 SER H H 8 8.678 8.678 8.193 0.485 19504 938 1 14 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.591 -0.416 19504 939 1 14 . 1 1 9 9 ASP H H 9 9.066 9.066 8.194 0.872 19504 940 1 14 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.060 -0.102 19504 941 1 14 . 1 1 10 10 GLN H H 10 8.689 8.689 8.765 -0.076 19504 942 1 14 . 1 1 11 11 THR HA H 11 4.045 4.045 4.251 -0.206 19504 943 1 14 . 1 1 11 11 THR H H 11 8.000 8.000 7.827 0.173 19504 944 1 14 . 1 1 12 12 LEU HA H 12 3.832 3.832 3.948 -0.116 19504 945 1 14 . 1 1 12 12 LEU H H 12 8.482 8.482 8.261 0.221 19504 946 1 14 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.959 0.072 19504 947 1 14 . 1 1 13 13 GLU H H 13 8.242 8.242 8.281 -0.039 19504 948 1 14 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.391 -0.007 19504 949 1 14 . 1 1 14 14 ASP H H 14 8.128 8.128 8.562 -0.434 19504 950 1 14 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.173 -0.155 19504 951 1 14 . 1 1 15 15 LEU H H 15 8.721 8.721 7.187 1.534 19504 952 1 14 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.127 -0.208 19504 953 1 14 . 1 1 16 16 GLU H H 16 8.468 8.468 7.993 0.475 19504 954 1 14 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.257 -0.269 19504 955 1 14 . 1 1 17 17 LYS H H 17 8.128 8.128 7.938 0.190 19504 956 1 14 . 1 1 18 18 MET HA H 18 4.115 4.115 4.403 -0.288 19504 957 1 14 . 1 1 18 18 MET H H 18 8.403 8.403 7.565 0.838 19504 958 1 14 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.292 -0.509 19504 959 1 14 . 1 1 19 19 ALA H H 19 8.719 8.719 7.533 1.186 19504 960 1 14 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.002 0.119 19504 961 1 14 . 1 1 20 20 ARG H H 20 7.889 7.889 7.769 0.120 19504 962 1 14 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.048 0.032 19504 963 1 14 . 1 1 21 21 ARG H H 21 7.968 7.968 7.995 -0.027 19504 964 1 14 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.228 0.161 19504 965 1 14 . 1 1 22 22 GLU H H 22 8.035 8.035 8.153 -0.118 19504 966 1 14 . 1 1 23 23 GLY H H 23 7.912 7.912 8.099 -0.187 19504 967 1 14 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.783 0.057 19504 968 1 14 . 1 1 24 24 LEU H H 24 8.149 8.149 7.433 0.716 19504 969 1 14 . 1 1 25 25 SER HA H 25 4.563 4.563 4.715 -0.152 19504 970 1 14 . 1 1 25 25 SER H H 25 8.182 8.182 8.265 -0.083 19504 971 1 14 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.967 -0.270 19504 972 1 14 . 1 1 26 26 LYS H H 26 9.270 9.270 8.736 0.534 19504 973 1 14 . 1 1 27 27 SER HA H 27 3.972 3.972 4.347 -0.375 19504 974 1 14 . 1 1 27 27 SER H H 27 8.615 8.615 8.148 0.467 19504 975 1 14 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.092 0.077 19504 976 1 14 . 1 1 28 28 GLU H H 28 7.969 7.969 8.575 -0.606 19504 977 1 14 . 1 1 29 29 MET HA H 29 4.239 4.239 4.290 -0.051 19504 978 1 14 . 1 1 29 29 MET H H 29 8.768 8.768 8.448 0.320 19504 979 1 14 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.737 -0.362 19504 980 1 14 . 1 1 30 30 ILE H H 30 7.966 7.966 7.689 0.277 19504 981 1 14 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.476 -0.240 19504 982 1 14 . 1 1 31 31 ASN H H 31 7.862 7.862 8.643 -0.781 19504 983 1 14 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.801 -0.093 19504 984 1 14 . 1 1 32 32 VAL H H 32 8.463 8.463 7.630 0.833 19504 985 1 14 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.189 -0.374 19504 986 1 14 . 1 1 33 33 ALA H H 33 8.285 8.285 7.777 0.508 19504 987 1 14 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.284 -0.332 19504 988 1 14 . 1 1 34 34 LEU H H 34 8.506 8.506 7.533 0.973 19504 989 1 14 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.069 -0.070 19504 990 1 14 . 1 1 35 35 GLN H H 35 8.340 8.340 7.709 0.631 19504 991 1 14 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.755 -0.230 19504 992 1 14 . 1 1 36 36 HIS H H 36 7.859 7.859 7.668 0.191 19504 993 1 14 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.443 -0.145 19504 994 1 14 . 1 1 37 37 TYR H H 37 7.655 7.655 7.536 0.119 19504 995 1 15 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.704 0.384 19504 996 1 15 . 1 1 2 2 TRP H H 2 9.010 9.010 8.296 0.714 19504 997 1 15 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.755 -0.065 19504 998 1 15 . 1 1 3 3 LEU H H 3 9.506 9.506 8.369 1.137 19504 999 1 15 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.985 0.820 19504 1000 1 15 . 1 1 4 4 CYS H H 4 8.997 8.997 8.686 0.311 19504 1001 1 15 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.619 0.156 19504 1002 1 15 . 1 1 5 5 ILE H H 5 9.319 9.319 8.417 0.902 19504 1003 1 15 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.993 -0.637 19504 1004 1 15 . 1 1 6 6 TRP H H 6 8.606 8.606 8.359 0.247 19504 1005 1 15 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.452 0.076 19504 1006 1 15 . 1 1 7 7 LEU H H 7 7.784 7.784 7.888 -0.104 19504 1007 1 15 . 1 1 8 8 SER HA H 8 4.275 4.275 4.049 0.226 19504 1008 1 15 . 1 1 8 8 SER H H 8 8.678 8.678 7.891 0.787 19504 1009 1 15 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.218 -0.043 19504 1010 1 15 . 1 1 9 9 ASP H H 9 9.066 9.066 8.688 0.378 19504 1011 1 15 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.007 -0.049 19504 1012 1 15 . 1 1 10 10 GLN H H 10 8.689 8.689 8.630 0.059 19504 1013 1 15 . 1 1 11 11 THR HA H 11 4.045 4.045 4.269 -0.224 19504 1014 1 15 . 1 1 11 11 THR H H 11 8.000 8.000 7.606 0.394 19504 1015 1 15 . 1 1 12 12 LEU HA H 12 3.832 3.832 3.870 -0.038 19504 1016 1 15 . 1 1 12 12 LEU H H 12 8.482 8.482 8.103 0.379 19504 1017 1 15 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.926 0.105 19504 1018 1 15 . 1 1 13 13 GLU H H 13 8.242 8.242 8.373 -0.131 19504 1019 1 15 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.401 -0.017 19504 1020 1 15 . 1 1 14 14 ASP H H 14 8.128 8.128 7.539 0.589 19504 1021 1 15 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.215 -0.197 19504 1022 1 15 . 1 1 15 15 LEU H H 15 8.721 8.721 8.162 0.559 19504 1023 1 15 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.427 -0.508 19504 1024 1 15 . 1 1 16 16 GLU H H 16 8.468 8.468 7.808 0.660 19504 1025 1 15 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.250 -0.262 19504 1026 1 15 . 1 1 17 17 LYS H H 17 8.128 8.128 7.595 0.533 19504 1027 1 15 . 1 1 18 18 MET HA H 18 4.115 4.115 4.620 -0.505 19504 1028 1 15 . 1 1 18 18 MET H H 18 8.403 8.403 7.868 0.535 19504 1029 1 15 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.437 -0.654 19504 1030 1 15 . 1 1 19 19 ALA H H 19 8.719 8.719 7.285 1.434 19504 1031 1 15 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.181 -0.060 19504 1032 1 15 . 1 1 20 20 ARG H H 20 7.889 7.889 7.664 0.225 19504 1033 1 15 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.091 -0.011 19504 1034 1 15 . 1 1 21 21 ARG H H 21 7.968 7.968 8.400 -0.432 19504 1035 1 15 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.257 0.132 19504 1036 1 15 . 1 1 22 22 GLU H H 22 8.035 8.035 8.195 -0.160 19504 1037 1 15 . 1 1 23 23 GLY H H 23 7.912 7.912 7.991 -0.079 19504 1038 1 15 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.725 0.115 19504 1039 1 15 . 1 1 24 24 LEU H H 24 8.149 8.149 7.859 0.290 19504 1040 1 15 . 1 1 25 25 SER HA H 25 4.563 4.563 4.777 -0.214 19504 1041 1 15 . 1 1 25 25 SER H H 25 8.182 8.182 8.261 -0.079 19504 1042 1 15 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.963 -0.266 19504 1043 1 15 . 1 1 26 26 LYS H H 26 9.270 9.270 8.912 0.358 19504 1044 1 15 . 1 1 27 27 SER HA H 27 3.972 3.972 4.329 -0.357 19504 1045 1 15 . 1 1 27 27 SER H H 27 8.615 8.615 8.072 0.543 19504 1046 1 15 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.073 0.096 19504 1047 1 15 . 1 1 28 28 GLU H H 28 7.969 7.969 8.429 -0.460 19504 1048 1 15 . 1 1 29 29 MET HA H 29 4.239 4.239 4.336 -0.097 19504 1049 1 15 . 1 1 29 29 MET H H 29 8.768 8.768 8.493 0.275 19504 1050 1 15 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.791 -0.416 19504 1051 1 15 . 1 1 30 30 ILE H H 30 7.966 7.966 7.479 0.487 19504 1052 1 15 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.587 -0.351 19504 1053 1 15 . 1 1 31 31 ASN H H 31 7.862 7.862 7.613 0.249 19504 1054 1 15 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.586 0.122 19504 1055 1 15 . 1 1 32 32 VAL H H 32 8.463 8.463 7.653 0.810 19504 1056 1 15 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.518 0.297 19504 1057 1 15 . 1 1 33 33 ALA H H 33 8.285 8.285 7.907 0.378 19504 1058 1 15 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.095 -0.143 19504 1059 1 15 . 1 1 34 34 LEU H H 34 8.506 8.506 7.800 0.706 19504 1060 1 15 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.034 -0.035 19504 1061 1 15 . 1 1 35 35 GLN H H 35 8.340 8.340 7.804 0.536 19504 1062 1 15 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.650 -0.125 19504 1063 1 15 . 1 1 36 36 HIS H H 36 7.859 7.859 7.908 -0.049 19504 1064 1 15 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.179 0.119 19504 1065 1 15 . 1 1 37 37 TYR H H 37 7.655 7.655 7.462 0.193 19504 1066 1 16 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.807 0.281 19504 1067 1 16 . 1 1 2 2 TRP H H 2 9.010 9.010 8.288 0.722 19504 1068 1 16 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.782 -0.092 19504 1069 1 16 . 1 1 3 3 LEU H H 3 9.506 9.506 8.434 1.072 19504 1070 1 16 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.960 0.845 19504 1071 1 16 . 1 1 4 4 CYS H H 4 8.997 8.997 8.708 0.289 19504 1072 1 16 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.528 0.247 19504 1073 1 16 . 1 1 5 5 ILE H H 5 9.319 9.319 8.384 0.935 19504 1074 1 16 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.995 -0.639 19504 1075 1 16 . 1 1 6 6 TRP H H 6 8.606 8.606 8.363 0.243 19504 1076 1 16 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.559 -0.031 19504 1077 1 16 . 1 1 7 7 LEU H H 7 7.784 7.784 8.018 -0.234 19504 1078 1 16 . 1 1 8 8 SER HA H 8 4.275 4.275 4.128 0.147 19504 1079 1 16 . 1 1 8 8 SER H H 8 8.678 8.678 8.309 0.369 19504 1080 1 16 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.438 -0.263 19504 1081 1 16 . 1 1 9 9 ASP H H 9 9.066 9.066 8.151 0.915 19504 1082 1 16 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.977 -0.019 19504 1083 1 16 . 1 1 10 10 GLN H H 10 8.689 8.689 8.729 -0.040 19504 1084 1 16 . 1 1 11 11 THR HA H 11 4.045 4.045 4.261 -0.216 19504 1085 1 16 . 1 1 11 11 THR H H 11 8.000 8.000 7.713 0.287 19504 1086 1 16 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.065 -0.233 19504 1087 1 16 . 1 1 12 12 LEU H H 12 8.482 8.482 7.687 0.795 19504 1088 1 16 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.027 0.004 19504 1089 1 16 . 1 1 13 13 GLU H H 13 8.242 8.242 8.180 0.062 19504 1090 1 16 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.416 -0.032 19504 1091 1 16 . 1 1 14 14 ASP H H 14 8.128 8.128 8.376 -0.248 19504 1092 1 16 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.401 -0.383 19504 1093 1 16 . 1 1 15 15 LEU H H 15 8.721 8.721 7.568 1.153 19504 1094 1 16 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.182 -0.263 19504 1095 1 16 . 1 1 16 16 GLU H H 16 8.468 8.468 7.645 0.823 19504 1096 1 16 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.348 -0.360 19504 1097 1 16 . 1 1 17 17 LYS H H 17 8.128 8.128 8.385 -0.257 19504 1098 1 16 . 1 1 18 18 MET HA H 18 4.115 4.115 4.644 -0.529 19504 1099 1 16 . 1 1 18 18 MET H H 18 8.403 8.403 7.541 0.862 19504 1100 1 16 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.915 -0.132 19504 1101 1 16 . 1 1 19 19 ALA H H 19 8.719 8.719 8.272 0.447 19504 1102 1 16 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.036 0.085 19504 1103 1 16 . 1 1 20 20 ARG H H 20 7.889 7.889 8.368 -0.479 19504 1104 1 16 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.104 -0.024 19504 1105 1 16 . 1 1 21 21 ARG H H 21 7.968 7.968 8.281 -0.313 19504 1106 1 16 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.349 0.040 19504 1107 1 16 . 1 1 22 22 GLU H H 22 8.035 8.035 8.302 -0.267 19504 1108 1 16 . 1 1 23 23 GLY H H 23 7.912 7.912 8.084 -0.172 19504 1109 1 16 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.566 0.274 19504 1110 1 16 . 1 1 24 24 LEU H H 24 8.149 8.149 7.907 0.242 19504 1111 1 16 . 1 1 25 25 SER HA H 25 4.563 4.563 4.745 -0.182 19504 1112 1 16 . 1 1 25 25 SER H H 25 8.182 8.182 8.053 0.129 19504 1113 1 16 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.918 -0.221 19504 1114 1 16 . 1 1 26 26 LYS H H 26 9.270 9.270 8.794 0.476 19504 1115 1 16 . 1 1 27 27 SER HA H 27 3.972 3.972 4.384 -0.412 19504 1116 1 16 . 1 1 27 27 SER H H 27 8.615 8.615 8.151 0.464 19504 1117 1 16 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.167 0.002 19504 1118 1 16 . 1 1 28 28 GLU H H 28 7.969 7.969 8.592 -0.623 19504 1119 1 16 . 1 1 29 29 MET HA H 29 4.239 4.239 4.420 -0.181 19504 1120 1 16 . 1 1 29 29 MET H H 29 8.768 8.768 8.279 0.489 19504 1121 1 16 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.760 -0.385 19504 1122 1 16 . 1 1 30 30 ILE H H 30 7.966 7.966 7.488 0.478 19504 1123 1 16 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.446 -0.210 19504 1124 1 16 . 1 1 31 31 ASN H H 31 7.862 7.862 8.693 -0.831 19504 1125 1 16 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.810 -0.102 19504 1126 1 16 . 1 1 32 32 VAL H H 32 8.463 8.463 7.499 0.964 19504 1127 1 16 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.053 -0.238 19504 1128 1 16 . 1 1 33 33 ALA H H 33 8.285 8.285 7.751 0.534 19504 1129 1 16 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.168 -0.216 19504 1130 1 16 . 1 1 34 34 LEU H H 34 8.506 8.506 7.477 1.029 19504 1131 1 16 . 1 1 35 35 GLN HA H 35 3.999 3.999 3.997 0.002 19504 1132 1 16 . 1 1 35 35 GLN H H 35 8.340 8.340 7.794 0.546 19504 1133 1 16 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.762 -0.237 19504 1134 1 16 . 1 1 36 36 HIS H H 36 7.859 7.859 7.675 0.184 19504 1135 1 16 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.446 -0.148 19504 1136 1 16 . 1 1 37 37 TYR H H 37 7.655 7.655 7.722 -0.067 19504 1137 1 17 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.697 0.391 19504 1138 1 17 . 1 1 2 2 TRP H H 2 9.010 9.010 8.275 0.735 19504 1139 1 17 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.753 -0.063 19504 1140 1 17 . 1 1 3 3 LEU H H 3 9.506 9.506 8.336 1.170 19504 1141 1 17 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.985 0.820 19504 1142 1 17 . 1 1 4 4 CYS H H 4 8.997 8.997 8.680 0.317 19504 1143 1 17 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.644 0.131 19504 1144 1 17 . 1 1 5 5 ILE H H 5 9.319 9.319 8.427 0.892 19504 1145 1 17 . 1 1 6 6 TRP HA H 6 4.356 4.356 5.009 -0.653 19504 1146 1 17 . 1 1 6 6 TRP H H 6 8.606 8.606 8.348 0.258 19504 1147 1 17 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.430 0.098 19504 1148 1 17 . 1 1 7 7 LEU H H 7 7.784 7.784 7.918 -0.134 19504 1149 1 17 . 1 1 8 8 SER HA H 8 4.275 4.275 4.082 0.193 19504 1150 1 17 . 1 1 8 8 SER H H 8 8.678 8.678 8.043 0.635 19504 1151 1 17 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.294 -0.119 19504 1152 1 17 . 1 1 9 9 ASP H H 9 9.066 9.066 8.722 0.344 19504 1153 1 17 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.302 -0.344 19504 1154 1 17 . 1 1 10 10 GLN H H 10 8.689 8.689 8.185 0.504 19504 1155 1 17 . 1 1 11 11 THR HA H 11 4.045 4.045 4.272 -0.227 19504 1156 1 17 . 1 1 11 11 THR H H 11 8.000 8.000 8.094 -0.094 19504 1157 1 17 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.131 -0.299 19504 1158 1 17 . 1 1 12 12 LEU H H 12 8.482 8.482 8.505 -0.023 19504 1159 1 17 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.276 -0.245 19504 1160 1 17 . 1 1 13 13 GLU H H 13 8.242 8.242 7.451 0.791 19504 1161 1 17 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.346 0.038 19504 1162 1 17 . 1 1 14 14 ASP H H 14 8.128 8.128 7.891 0.237 19504 1163 1 17 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.058 -0.040 19504 1164 1 17 . 1 1 15 15 LEU H H 15 8.721 8.721 7.808 0.913 19504 1165 1 17 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.061 -0.142 19504 1166 1 17 . 1 1 16 16 GLU H H 16 8.468 8.468 8.631 -0.163 19504 1167 1 17 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.114 -0.126 19504 1168 1 17 . 1 1 17 17 LYS H H 17 8.128 8.128 7.798 0.330 19504 1169 1 17 . 1 1 18 18 MET HA H 18 4.115 4.115 4.497 -0.382 19504 1170 1 17 . 1 1 18 18 MET H H 18 8.403 8.403 7.383 1.020 19504 1171 1 17 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.940 -0.157 19504 1172 1 17 . 1 1 19 19 ALA H H 19 8.719 8.719 8.057 0.662 19504 1173 1 17 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.016 0.105 19504 1174 1 17 . 1 1 20 20 ARG H H 20 7.889 7.889 7.789 0.100 19504 1175 1 17 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.089 -0.009 19504 1176 1 17 . 1 1 21 21 ARG H H 21 7.968 7.968 7.912 0.056 19504 1177 1 17 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.348 0.041 19504 1178 1 17 . 1 1 22 22 GLU H H 22 8.035 8.035 8.282 -0.247 19504 1179 1 17 . 1 1 23 23 GLY H H 23 7.912 7.912 8.111 -0.199 19504 1180 1 17 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.430 0.410 19504 1181 1 17 . 1 1 24 24 LEU H H 24 8.149 8.149 7.808 0.341 19504 1182 1 17 . 1 1 25 25 SER HA H 25 4.563 4.563 4.644 -0.081 19504 1183 1 17 . 1 1 25 25 SER H H 25 8.182 8.182 8.165 0.017 19504 1184 1 17 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.942 -0.245 19504 1185 1 17 . 1 1 26 26 LYS H H 26 9.270 9.270 8.745 0.525 19504 1186 1 17 . 1 1 27 27 SER HA H 27 3.972 3.972 4.410 -0.438 19504 1187 1 17 . 1 1 27 27 SER H H 27 8.615 8.615 8.096 0.519 19504 1188 1 17 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.124 0.045 19504 1189 1 17 . 1 1 28 28 GLU H H 28 7.969 7.969 8.704 -0.735 19504 1190 1 17 . 1 1 29 29 MET HA H 29 4.239 4.239 4.451 -0.212 19504 1191 1 17 . 1 1 29 29 MET H H 29 8.768 8.768 8.406 0.362 19504 1192 1 17 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.739 -0.364 19504 1193 1 17 . 1 1 30 30 ILE H H 30 7.966 7.966 7.509 0.457 19504 1194 1 17 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.493 -0.257 19504 1195 1 17 . 1 1 31 31 ASN H H 31 7.862 7.862 8.334 -0.472 19504 1196 1 17 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.442 0.266 19504 1197 1 17 . 1 1 32 32 VAL H H 32 8.463 8.463 7.319 1.144 19504 1198 1 17 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.935 -0.120 19504 1199 1 17 . 1 1 33 33 ALA H H 33 8.285 8.285 7.593 0.692 19504 1200 1 17 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.224 -0.272 19504 1201 1 17 . 1 1 34 34 LEU H H 34 8.506 8.506 7.469 1.037 19504 1202 1 17 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.244 -0.245 19504 1203 1 17 . 1 1 35 35 GLN H H 35 8.340 8.340 7.489 0.851 19504 1204 1 17 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.727 -0.202 19504 1205 1 17 . 1 1 36 36 HIS H H 36 7.859 7.859 8.213 -0.354 19504 1206 1 17 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.508 -0.210 19504 1207 1 17 . 1 1 37 37 TYR H H 37 7.655 7.655 7.650 0.005 19504 1208 1 18 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.838 0.250 19504 1209 1 18 . 1 1 2 2 TRP H H 2 9.010 9.010 8.317 0.693 19504 1210 1 18 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.702 -0.012 19504 1211 1 18 . 1 1 3 3 LEU H H 3 9.506 9.506 8.559 0.947 19504 1212 1 18 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.905 0.900 19504 1213 1 18 . 1 1 4 4 CYS H H 4 8.997 8.997 8.654 0.343 19504 1214 1 18 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.655 0.120 19504 1215 1 18 . 1 1 5 5 ILE H H 5 9.319 9.319 8.396 0.923 19504 1216 1 18 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.990 -0.634 19504 1217 1 18 . 1 1 6 6 TRP H H 6 8.606 8.606 8.363 0.243 19504 1218 1 18 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.459 0.069 19504 1219 1 18 . 1 1 7 7 LEU H H 7 7.784 7.784 7.911 -0.127 19504 1220 1 18 . 1 1 8 8 SER HA H 8 4.275 4.275 4.067 0.208 19504 1221 1 18 . 1 1 8 8 SER H H 8 8.678 8.678 7.949 0.729 19504 1222 1 18 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.221 -0.046 19504 1223 1 18 . 1 1 9 9 ASP H H 9 9.066 9.066 8.639 0.427 19504 1224 1 18 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.989 -0.031 19504 1225 1 18 . 1 1 10 10 GLN H H 10 8.689 8.689 8.459 0.230 19504 1226 1 18 . 1 1 11 11 THR HA H 11 4.045 4.045 4.272 -0.227 19504 1227 1 18 . 1 1 11 11 THR H H 11 8.000 8.000 7.470 0.530 19504 1228 1 18 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.032 -0.200 19504 1229 1 18 . 1 1 12 12 LEU H H 12 8.482 8.482 7.763 0.719 19504 1230 1 18 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.036 -0.005 19504 1231 1 18 . 1 1 13 13 GLU H H 13 8.242 8.242 8.276 -0.034 19504 1232 1 18 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.404 -0.020 19504 1233 1 18 . 1 1 14 14 ASP H H 14 8.128 8.128 7.634 0.494 19504 1234 1 18 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.363 -0.345 19504 1235 1 18 . 1 1 15 15 LEU H H 15 8.721 8.721 7.563 1.158 19504 1236 1 18 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.367 -0.448 19504 1237 1 18 . 1 1 16 16 GLU H H 16 8.468 8.468 8.226 0.242 19504 1238 1 18 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.387 -0.399 19504 1239 1 18 . 1 1 17 17 LYS H H 17 8.128 8.128 7.530 0.598 19504 1240 1 18 . 1 1 18 18 MET HA H 18 4.115 4.115 4.639 -0.524 19504 1241 1 18 . 1 1 18 18 MET H H 18 8.403 8.403 7.574 0.829 19504 1242 1 18 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.441 -0.658 19504 1243 1 18 . 1 1 19 19 ALA H H 19 8.719 8.719 7.776 0.943 19504 1244 1 18 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.040 0.081 19504 1245 1 18 . 1 1 20 20 ARG H H 20 7.889 7.889 7.760 0.130 19504 1246 1 18 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.091 -0.011 19504 1247 1 18 . 1 1 21 21 ARG H H 21 7.968 7.968 8.637 -0.669 19504 1248 1 18 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.429 -0.040 19504 1249 1 18 . 1 1 22 22 GLU H H 22 8.035 8.035 8.438 -0.403 19504 1250 1 18 . 1 1 23 23 GLY H H 23 7.912 7.912 7.914 -0.002 19504 1251 1 18 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.871 0.969 19504 1252 1 18 . 1 1 24 24 LEU H H 24 8.149 8.149 8.045 0.104 19504 1253 1 18 . 1 1 25 25 SER HA H 25 4.563 4.563 4.333 0.230 19504 1254 1 18 . 1 1 25 25 SER H H 25 8.182 8.182 8.269 -0.087 19504 1255 1 18 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.948 -0.251 19504 1256 1 18 . 1 1 26 26 LYS H H 26 9.270 9.270 8.850 0.420 19504 1257 1 18 . 1 1 27 27 SER HA H 27 3.972 3.972 4.333 -0.361 19504 1258 1 18 . 1 1 27 27 SER H H 27 8.615 8.615 8.186 0.429 19504 1259 1 18 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.021 0.148 19504 1260 1 18 . 1 1 28 28 GLU H H 28 7.969 7.969 8.230 -0.261 19504 1261 1 18 . 1 1 29 29 MET HA H 29 4.239 4.239 4.348 -0.109 19504 1262 1 18 . 1 1 29 29 MET H H 29 8.768 8.768 8.809 -0.041 19504 1263 1 18 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.811 -0.436 19504 1264 1 18 . 1 1 30 30 ILE H H 30 7.966 7.966 7.630 0.336 19504 1265 1 18 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.570 -0.334 19504 1266 1 18 . 1 1 31 31 ASN H H 31 7.862 7.862 7.498 0.364 19504 1267 1 18 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.533 0.175 19504 1268 1 18 . 1 1 32 32 VAL H H 32 8.463 8.463 7.844 0.619 19504 1269 1 18 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.245 0.570 19504 1270 1 18 . 1 1 33 33 ALA H H 33 8.285 8.285 7.637 0.648 19504 1271 1 18 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.204 -0.252 19504 1272 1 18 . 1 1 34 34 LEU H H 34 8.506 8.506 7.355 1.151 19504 1273 1 18 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.261 -0.262 19504 1274 1 18 . 1 1 35 35 GLN H H 35 8.340 8.340 8.002 0.338 19504 1275 1 18 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.742 -0.217 19504 1276 1 18 . 1 1 36 36 HIS H H 36 7.859 7.859 8.040 -0.181 19504 1277 1 18 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.673 -0.375 19504 1278 1 18 . 1 1 37 37 TYR H H 37 7.655 7.655 7.668 -0.013 19504 1279 1 19 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.933 0.155 19504 1280 1 19 . 1 1 2 2 TRP H H 2 9.010 9.010 8.280 0.730 19504 1281 1 19 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.778 -0.088 19504 1282 1 19 . 1 1 3 3 LEU H H 3 9.506 9.506 8.447 1.059 19504 1283 1 19 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.980 0.825 19504 1284 1 19 . 1 1 4 4 CYS H H 4 8.997 8.997 8.717 0.280 19504 1285 1 19 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.621 0.154 19504 1286 1 19 . 1 1 5 5 ILE H H 5 9.319 9.319 8.434 0.885 19504 1287 1 19 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.970 -0.614 19504 1288 1 19 . 1 1 6 6 TRP H H 6 8.606 8.606 8.450 0.156 19504 1289 1 19 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.564 -0.036 19504 1290 1 19 . 1 1 7 7 LEU H H 7 7.784 7.784 7.905 -0.121 19504 1291 1 19 . 1 1 8 8 SER HA H 8 4.275 4.275 4.045 0.230 19504 1292 1 19 . 1 1 8 8 SER H H 8 8.678 8.678 8.158 0.520 19504 1293 1 19 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.468 -0.293 19504 1294 1 19 . 1 1 9 9 ASP H H 9 9.066 9.066 8.190 0.876 19504 1295 1 19 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.136 -0.177 19504 1296 1 19 . 1 1 10 10 GLN H H 10 8.689 8.689 8.696 -0.007 19504 1297 1 19 . 1 1 11 11 THR HA H 11 4.045 4.045 4.266 -0.221 19504 1298 1 19 . 1 1 11 11 THR H H 11 8.000 8.000 7.872 0.128 19504 1299 1 19 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.121 -0.289 19504 1300 1 19 . 1 1 12 12 LEU H H 12 8.482 8.482 7.700 0.782 19504 1301 1 19 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.042 -0.011 19504 1302 1 19 . 1 1 13 13 GLU H H 13 8.242 8.242 8.465 -0.223 19504 1303 1 19 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.422 -0.038 19504 1304 1 19 . 1 1 14 14 ASP H H 14 8.128 8.128 8.361 -0.233 19504 1305 1 19 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.327 -0.309 19504 1306 1 19 . 1 1 15 15 LEU H H 15 8.721 8.721 7.560 1.161 19504 1307 1 19 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.231 -0.312 19504 1308 1 19 . 1 1 16 16 GLU H H 16 8.468 8.468 7.965 0.503 19504 1309 1 19 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.385 -0.397 19504 1310 1 19 . 1 1 17 17 LYS H H 17 8.128 8.128 8.185 -0.057 19504 1311 1 19 . 1 1 18 18 MET HA H 18 4.115 4.115 4.640 -0.525 19504 1312 1 19 . 1 1 18 18 MET H H 18 8.403 8.403 7.538 0.865 19504 1313 1 19 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.898 -0.115 19504 1314 1 19 . 1 1 19 19 ALA H H 19 8.719 8.719 8.342 0.377 19504 1315 1 19 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.047 0.074 19504 1316 1 19 . 1 1 20 20 ARG H H 20 7.889 7.889 8.365 -0.476 19504 1317 1 19 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.100 -0.020 19504 1318 1 19 . 1 1 21 21 ARG H H 21 7.968 7.968 8.268 -0.300 19504 1319 1 19 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.372 0.017 19504 1320 1 19 . 1 1 22 22 GLU H H 22 8.035 8.035 8.442 -0.407 19504 1321 1 19 . 1 1 23 23 GLY H H 23 7.912 7.912 8.053 -0.141 19504 1322 1 19 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.603 0.237 19504 1323 1 19 . 1 1 24 24 LEU H H 24 8.149 8.149 8.039 0.110 19504 1324 1 19 . 1 1 25 25 SER HA H 25 4.563 4.563 4.704 -0.141 19504 1325 1 19 . 1 1 25 25 SER H H 25 8.182 8.182 8.132 0.050 19504 1326 1 19 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.958 -0.261 19504 1327 1 19 . 1 1 26 26 LYS H H 26 9.270 9.270 8.864 0.406 19504 1328 1 19 . 1 1 27 27 SER HA H 27 3.972 3.972 4.366 -0.394 19504 1329 1 19 . 1 1 27 27 SER H H 27 8.615 8.615 8.146 0.469 19504 1330 1 19 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.133 0.036 19504 1331 1 19 . 1 1 28 28 GLU H H 28 7.969 7.969 8.424 -0.455 19504 1332 1 19 . 1 1 29 29 MET HA H 29 4.239 4.239 4.429 -0.190 19504 1333 1 19 . 1 1 29 29 MET H H 29 8.768 8.768 8.546 0.222 19504 1334 1 19 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.809 -0.434 19504 1335 1 19 . 1 1 30 30 ILE H H 30 7.966 7.966 7.600 0.366 19504 1336 1 19 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.565 -0.329 19504 1337 1 19 . 1 1 31 31 ASN H H 31 7.862 7.862 7.734 0.128 19504 1338 1 19 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.638 0.070 19504 1339 1 19 . 1 1 32 32 VAL H H 32 8.463 8.463 7.591 0.872 19504 1340 1 19 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.246 0.569 19504 1341 1 19 . 1 1 33 33 ALA H H 33 8.285 8.285 7.922 0.363 19504 1342 1 19 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.066 -0.114 19504 1343 1 19 . 1 1 34 34 LEU H H 34 8.506 8.506 8.057 0.449 19504 1344 1 19 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.082 -0.083 19504 1345 1 19 . 1 1 35 35 GLN H H 35 8.340 8.340 7.975 0.365 19504 1346 1 19 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.585 -0.060 19504 1347 1 19 . 1 1 36 36 HIS H H 36 7.859 7.859 8.095 -0.236 19504 1348 1 19 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.153 0.145 19504 1349 1 19 . 1 1 37 37 TYR H H 37 7.655 7.655 7.468 0.187 19504 1350 1 20 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.945 0.143 19504 1351 1 20 . 1 1 2 2 TRP H H 2 9.010 9.010 8.290 0.720 19504 1352 1 20 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.777 -0.087 19504 1353 1 20 . 1 1 3 3 LEU H H 3 9.506 9.506 8.414 1.092 19504 1354 1 20 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.961 0.844 19504 1355 1 20 . 1 1 4 4 CYS H H 4 8.997 8.997 8.708 0.289 19504 1356 1 20 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.578 0.197 19504 1357 1 20 . 1 1 5 5 ILE H H 5 9.319 9.319 8.459 0.860 19504 1358 1 20 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.969 -0.613 19504 1359 1 20 . 1 1 6 6 TRP H H 6 8.606 8.606 8.431 0.175 19504 1360 1 20 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.477 0.051 19504 1361 1 20 . 1 1 7 7 LEU H H 7 7.784 7.784 7.775 0.009 19504 1362 1 20 . 1 1 8 8 SER HA H 8 4.275 4.275 4.049 0.226 19504 1363 1 20 . 1 1 8 8 SER H H 8 8.678 8.678 7.969 0.709 19504 1364 1 20 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.357 -0.182 19504 1365 1 20 . 1 1 9 9 ASP H H 9 9.066 9.066 8.637 0.429 19504 1366 1 20 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.242 -0.284 19504 1367 1 20 . 1 1 10 10 GLN H H 10 8.689 8.689 7.934 0.755 19504 1368 1 20 . 1 1 11 11 THR HA H 11 4.045 4.045 4.238 -0.193 19504 1369 1 20 . 1 1 11 11 THR H H 11 8.000 8.000 8.211 -0.211 19504 1370 1 20 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.292 -0.460 19504 1371 1 20 . 1 1 12 12 LEU H H 12 8.482 8.482 7.726 0.756 19504 1372 1 20 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.278 -0.247 19504 1373 1 20 . 1 1 13 13 GLU H H 13 8.242 8.242 7.682 0.560 19504 1374 1 20 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.353 0.031 19504 1375 1 20 . 1 1 14 14 ASP H H 14 8.128 8.128 7.917 0.211 19504 1376 1 20 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.660 -0.642 19504 1377 1 20 . 1 1 15 15 LEU H H 15 8.721 8.721 7.322 1.399 19504 1378 1 20 . 1 1 16 16 GLU HA H 16 3.919 3.919 3.811 0.108 19504 1379 1 20 . 1 1 16 16 GLU H H 16 8.468 8.468 8.000 0.468 19504 1380 1 20 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.091 -0.103 19504 1381 1 20 . 1 1 17 17 LYS H H 17 8.128 8.128 8.305 -0.177 19504 1382 1 20 . 1 1 18 18 MET HA H 18 4.115 4.115 4.177 -0.062 19504 1383 1 20 . 1 1 18 18 MET H H 18 8.403 8.403 7.502 0.901 19504 1384 1 20 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.239 -0.456 19504 1385 1 20 . 1 1 19 19 ALA H H 19 8.719 8.719 7.812 0.907 19504 1386 1 20 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.076 0.045 19504 1387 1 20 . 1 1 20 20 ARG H H 20 7.889 7.889 8.389 -0.500 19504 1388 1 20 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.066 0.014 19504 1389 1 20 . 1 1 21 21 ARG H H 21 7.968 7.968 7.695 0.273 19504 1390 1 20 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.371 0.018 19504 1391 1 20 . 1 1 22 22 GLU H H 22 8.035 8.035 7.870 0.165 19504 1392 1 20 . 1 1 23 23 GLY H H 23 7.912 7.912 8.117 -0.205 19504 1393 1 20 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.401 0.440 19504 1394 1 20 . 1 1 24 24 LEU H H 24 8.149 8.149 7.706 0.443 19504 1395 1 20 . 1 1 25 25 SER HA H 25 4.563 4.563 4.761 -0.198 19504 1396 1 20 . 1 1 25 25 SER H H 25 8.182 8.182 8.067 0.115 19504 1397 1 20 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.978 -0.281 19504 1398 1 20 . 1 1 26 26 LYS H H 26 9.270 9.270 8.819 0.451 19504 1399 1 20 . 1 1 27 27 SER HA H 27 3.972 3.972 4.358 -0.386 19504 1400 1 20 . 1 1 27 27 SER H H 27 8.615 8.615 7.790 0.825 19504 1401 1 20 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.043 0.126 19504 1402 1 20 . 1 1 28 28 GLU H H 28 7.969 7.969 7.912 0.057 19504 1403 1 20 . 1 1 29 29 MET HA H 29 4.239 4.239 4.459 -0.220 19504 1404 1 20 . 1 1 29 29 MET H H 29 8.768 8.768 8.087 0.681 19504 1405 1 20 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.767 -0.392 19504 1406 1 20 . 1 1 30 30 ILE H H 30 7.966 7.966 7.324 0.642 19504 1407 1 20 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.380 -0.144 19504 1408 1 20 . 1 1 31 31 ASN H H 31 7.862 7.862 8.726 -0.864 19504 1409 1 20 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.704 0.004 19504 1410 1 20 . 1 1 32 32 VAL H H 32 8.463 8.463 7.496 0.967 19504 1411 1 20 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.210 -0.395 19504 1412 1 20 . 1 1 33 33 ALA H H 33 8.285 8.285 7.498 0.787 19504 1413 1 20 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.252 -0.300 19504 1414 1 20 . 1 1 34 34 LEU H H 34 8.506 8.506 7.585 0.921 19504 1415 1 20 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.096 -0.097 19504 1416 1 20 . 1 1 35 35 GLN H H 35 8.340 8.340 7.559 0.781 19504 1417 1 20 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.827 -0.301 19504 1418 1 20 . 1 1 36 36 HIS H H 36 7.859 7.859 7.783 0.076 19504 1419 1 20 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.440 -0.142 19504 1420 1 20 . 1 1 37 37 TYR H H 37 7.655 7.655 7.375 0.280 19504 1421 1 21 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.895 0.193 19504 1422 1 21 . 1 1 2 2 TRP H H 2 9.010 9.010 8.342 0.668 19504 1423 1 21 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.701 -0.011 19504 1424 1 21 . 1 1 3 3 LEU H H 3 9.506 9.506 8.556 0.950 19504 1425 1 21 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.907 0.898 19504 1426 1 21 . 1 1 4 4 CYS H H 4 8.997 8.997 8.643 0.354 19504 1427 1 21 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.629 0.146 19504 1428 1 21 . 1 1 5 5 ILE H H 5 9.319 9.319 8.427 0.892 19504 1429 1 21 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.973 -0.617 19504 1430 1 21 . 1 1 6 6 TRP H H 6 8.606 8.606 8.416 0.190 19504 1431 1 21 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.539 -0.011 19504 1432 1 21 . 1 1 7 7 LEU H H 7 7.784 7.784 7.894 -0.110 19504 1433 1 21 . 1 1 8 8 SER HA H 8 4.275 4.275 4.088 0.187 19504 1434 1 21 . 1 1 8 8 SER H H 8 8.678 8.678 8.275 0.403 19504 1435 1 21 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.410 -0.235 19504 1436 1 21 . 1 1 9 9 ASP H H 9 9.066 9.066 8.082 0.984 19504 1437 1 21 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.126 -0.168 19504 1438 1 21 . 1 1 10 10 GLN H H 10 8.689 8.689 8.709 -0.020 19504 1439 1 21 . 1 1 11 11 THR HA H 11 4.045 4.045 4.264 -0.219 19504 1440 1 21 . 1 1 11 11 THR H H 11 8.000 8.000 7.801 0.199 19504 1441 1 21 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.119 -0.287 19504 1442 1 21 . 1 1 12 12 LEU H H 12 8.482 8.482 7.998 0.484 19504 1443 1 21 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.054 -0.023 19504 1444 1 21 . 1 1 13 13 GLU H H 13 8.242 8.242 8.200 0.042 19504 1445 1 21 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.346 0.038 19504 1446 1 21 . 1 1 14 14 ASP H H 14 8.128 8.128 8.703 -0.575 19504 1447 1 21 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.265 -0.247 19504 1448 1 21 . 1 1 15 15 LEU H H 15 8.721 8.721 7.585 1.136 19504 1449 1 21 . 1 1 16 16 GLU HA H 16 3.919 3.919 3.973 -0.054 19504 1450 1 21 . 1 1 16 16 GLU H H 16 8.468 8.468 7.973 0.495 19504 1451 1 21 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.391 -0.403 19504 1452 1 21 . 1 1 17 17 LYS H H 17 8.128 8.128 7.865 0.263 19504 1453 1 21 . 1 1 18 18 MET HA H 18 4.115 4.115 4.680 -0.565 19504 1454 1 21 . 1 1 18 18 MET H H 18 8.403 8.403 7.898 0.505 19504 1455 1 21 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.317 -0.534 19504 1456 1 21 . 1 1 19 19 ALA H H 19 8.719 8.719 7.619 1.100 19504 1457 1 21 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.167 -0.046 19504 1458 1 21 . 1 1 20 20 ARG H H 20 7.889 7.889 7.716 0.173 19504 1459 1 21 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.064 0.016 19504 1460 1 21 . 1 1 21 21 ARG H H 21 7.968 7.968 8.598 -0.630 19504 1461 1 21 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.402 -0.013 19504 1462 1 21 . 1 1 22 22 GLU H H 22 8.035 8.035 8.518 -0.483 19504 1463 1 21 . 1 1 23 23 GLY H H 23 7.912 7.912 7.815 0.097 19504 1464 1 21 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.863 0.977 19504 1465 1 21 . 1 1 24 24 LEU H H 24 8.149 8.149 8.052 0.097 19504 1466 1 21 . 1 1 25 25 SER HA H 25 4.563 4.563 4.347 0.216 19504 1467 1 21 . 1 1 25 25 SER H H 25 8.182 8.182 8.343 -0.161 19504 1468 1 21 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.983 -0.286 19504 1469 1 21 . 1 1 26 26 LYS H H 26 9.270 9.270 8.891 0.379 19504 1470 1 21 . 1 1 27 27 SER HA H 27 3.972 3.972 4.370 -0.398 19504 1471 1 21 . 1 1 27 27 SER H H 27 8.615 8.615 8.205 0.410 19504 1472 1 21 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.020 0.149 19504 1473 1 21 . 1 1 28 28 GLU H H 28 7.969 7.969 8.392 -0.423 19504 1474 1 21 . 1 1 29 29 MET HA H 29 4.239 4.239 4.224 0.015 19504 1475 1 21 . 1 1 29 29 MET H H 29 8.768 8.768 8.728 0.040 19504 1476 1 21 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.747 -0.372 19504 1477 1 21 . 1 1 30 30 ILE H H 30 7.966 7.966 7.498 0.468 19504 1478 1 21 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.482 -0.246 19504 1479 1 21 . 1 1 31 31 ASN H H 31 7.862 7.862 8.228 -0.366 19504 1480 1 21 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.853 -0.145 19504 1481 1 21 . 1 1 32 32 VAL H H 32 8.463 8.463 8.134 0.329 19504 1482 1 21 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.049 -0.234 19504 1483 1 21 . 1 1 33 33 ALA H H 33 8.285 8.285 7.950 0.335 19504 1484 1 21 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.114 -0.162 19504 1485 1 21 . 1 1 34 34 LEU H H 34 8.506 8.506 7.670 0.836 19504 1486 1 21 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.003 -0.004 19504 1487 1 21 . 1 1 35 35 GLN H H 35 8.340 8.340 7.937 0.403 19504 1488 1 21 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.683 -0.158 19504 1489 1 21 . 1 1 36 36 HIS H H 36 7.859 7.859 7.612 0.247 19504 1490 1 21 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.245 0.053 19504 1491 1 21 . 1 1 37 37 TYR H H 37 7.655 7.655 7.813 -0.158 19504 1492 1 22 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.738 0.350 19504 1493 1 22 . 1 1 2 2 TRP H H 2 9.010 9.010 8.382 0.628 19504 1494 1 22 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.474 0.216 19504 1495 1 22 . 1 1 3 3 LEU H H 3 9.506 9.506 8.342 1.164 19504 1496 1 22 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.130 0.675 19504 1497 1 22 . 1 1 4 4 CYS H H 4 8.997 8.997 8.350 0.647 19504 1498 1 22 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.596 0.179 19504 1499 1 22 . 1 1 5 5 ILE H H 5 9.319 9.319 8.401 0.918 19504 1500 1 22 . 1 1 6 6 TRP HA H 6 4.356 4.356 5.023 -0.667 19504 1501 1 22 . 1 1 6 6 TRP H H 6 8.606 8.606 8.351 0.255 19504 1502 1 22 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.393 0.135 19504 1503 1 22 . 1 1 7 7 LEU H H 7 7.784 7.784 8.047 -0.263 19504 1504 1 22 . 1 1 8 8 SER HA H 8 4.275 4.275 4.007 0.268 19504 1505 1 22 . 1 1 8 8 SER H H 8 8.678 8.678 8.164 0.514 19504 1506 1 22 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.553 -0.378 19504 1507 1 22 . 1 1 9 9 ASP H H 9 9.066 9.066 8.439 0.627 19504 1508 1 22 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.214 -0.256 19504 1509 1 22 . 1 1 10 10 GLN H H 10 8.689 8.689 8.641 0.048 19504 1510 1 22 . 1 1 11 11 THR HA H 11 4.045 4.045 4.317 -0.272 19504 1511 1 22 . 1 1 11 11 THR H H 11 8.000 8.000 8.340 -0.340 19504 1512 1 22 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.008 -0.176 19504 1513 1 22 . 1 1 12 12 LEU H H 12 8.482 8.482 7.986 0.496 19504 1514 1 22 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.955 0.076 19504 1515 1 22 . 1 1 13 13 GLU H H 13 8.242 8.242 7.538 0.704 19504 1516 1 22 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.385 -0.001 19504 1517 1 22 . 1 1 14 14 ASP H H 14 8.128 8.128 8.096 0.032 19504 1518 1 22 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.288 -0.270 19504 1519 1 22 . 1 1 15 15 LEU H H 15 8.721 8.721 7.859 0.862 19504 1520 1 22 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.440 -0.521 19504 1521 1 22 . 1 1 16 16 GLU H H 16 8.468 8.468 7.941 0.527 19504 1522 1 22 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.261 -0.273 19504 1523 1 22 . 1 1 17 17 LYS H H 17 8.128 8.128 8.100 0.028 19504 1524 1 22 . 1 1 18 18 MET HA H 18 4.115 4.115 4.733 -0.618 19504 1525 1 22 . 1 1 18 18 MET H H 18 8.403 8.403 7.778 0.625 19504 1526 1 22 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.424 -0.641 19504 1527 1 22 . 1 1 19 19 ALA H H 19 8.719 8.719 7.278 1.441 19504 1528 1 22 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.104 0.017 19504 1529 1 22 . 1 1 20 20 ARG H H 20 7.889 7.889 7.704 0.185 19504 1530 1 22 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.075 0.005 19504 1531 1 22 . 1 1 21 21 ARG H H 21 7.968 7.968 8.619 -0.651 19504 1532 1 22 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.395 -0.006 19504 1533 1 22 . 1 1 22 22 GLU H H 22 8.035 8.035 8.547 -0.512 19504 1534 1 22 . 1 1 23 23 GLY H H 23 7.912 7.912 7.885 0.027 19504 1535 1 22 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.833 1.007 19504 1536 1 22 . 1 1 24 24 LEU H H 24 8.149 8.149 7.944 0.205 19504 1537 1 22 . 1 1 25 25 SER HA H 25 4.563 4.563 4.380 0.183 19504 1538 1 22 . 1 1 25 25 SER H H 25 8.182 8.182 8.161 0.021 19504 1539 1 22 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.005 -0.308 19504 1540 1 22 . 1 1 26 26 LYS H H 26 9.270 9.270 8.915 0.355 19504 1541 1 22 . 1 1 27 27 SER HA H 27 3.972 3.972 4.365 -0.393 19504 1542 1 22 . 1 1 27 27 SER H H 27 8.615 8.615 8.263 0.352 19504 1543 1 22 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.079 0.090 19504 1544 1 22 . 1 1 28 28 GLU H H 28 7.969 7.969 8.091 -0.122 19504 1545 1 22 . 1 1 29 29 MET HA H 29 4.239 4.239 4.347 -0.108 19504 1546 1 22 . 1 1 29 29 MET H H 29 8.768 8.768 8.905 -0.137 19504 1547 1 22 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.865 -0.490 19504 1548 1 22 . 1 1 30 30 ILE H H 30 7.966 7.966 7.584 0.382 19504 1549 1 22 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.615 -0.380 19504 1550 1 22 . 1 1 31 31 ASN H H 31 7.862 7.862 7.650 0.212 19504 1551 1 22 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.544 0.164 19504 1552 1 22 . 1 1 32 32 VAL H H 32 8.463 8.463 7.906 0.557 19504 1553 1 22 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.333 0.482 19504 1554 1 22 . 1 1 33 33 ALA H H 33 8.285 8.285 7.603 0.682 19504 1555 1 22 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.158 -0.206 19504 1556 1 22 . 1 1 34 34 LEU H H 34 8.506 8.506 7.426 1.080 19504 1557 1 22 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.189 -0.190 19504 1558 1 22 . 1 1 35 35 GLN H H 35 8.340 8.340 7.755 0.585 19504 1559 1 22 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.735 -0.210 19504 1560 1 22 . 1 1 36 36 HIS H H 36 7.859 7.859 8.156 -0.297 19504 1561 1 22 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.509 -0.211 19504 1562 1 22 . 1 1 37 37 TYR H H 37 7.655 7.655 7.656 -0.001 19504 1563 1 23 . 1 1 2 2 TRP HA H 2 5.088 5.088 5.237 -0.149 19504 1564 1 23 . 1 1 2 2 TRP H H 2 9.010 9.010 8.624 0.386 19504 1565 1 23 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.574 0.116 19504 1566 1 23 . 1 1 3 3 LEU H H 3 9.506 9.506 8.447 1.059 19504 1567 1 23 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.148 0.657 19504 1568 1 23 . 1 1 4 4 CYS H H 4 8.997 8.997 8.413 0.584 19504 1569 1 23 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.578 0.197 19504 1570 1 23 . 1 1 5 5 ILE H H 5 9.319 9.319 8.430 0.889 19504 1571 1 23 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.860 -0.504 19504 1572 1 23 . 1 1 6 6 TRP H H 6 8.606 8.606 8.344 0.262 19504 1573 1 23 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.453 0.075 19504 1574 1 23 . 1 1 7 7 LEU H H 7 7.784 7.784 7.863 -0.079 19504 1575 1 23 . 1 1 8 8 SER HA H 8 4.275 4.275 4.233 0.042 19504 1576 1 23 . 1 1 8 8 SER H H 8 8.678 8.678 7.934 0.744 19504 1577 1 23 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.207 -0.032 19504 1578 1 23 . 1 1 9 9 ASP H H 9 9.066 9.066 8.699 0.367 19504 1579 1 23 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.037 -0.079 19504 1580 1 23 . 1 1 10 10 GLN H H 10 8.689 8.689 8.668 0.021 19504 1581 1 23 . 1 1 11 11 THR HA H 11 4.045 4.045 4.509 -0.464 19504 1582 1 23 . 1 1 11 11 THR H H 11 8.000 8.000 7.729 0.271 19504 1583 1 23 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.039 -0.207 19504 1584 1 23 . 1 1 12 12 LEU H H 12 8.482 8.482 7.936 0.546 19504 1585 1 23 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.912 0.119 19504 1586 1 23 . 1 1 13 13 GLU H H 13 8.242 8.242 8.300 -0.058 19504 1587 1 23 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.376 0.008 19504 1588 1 23 . 1 1 14 14 ASP H H 14 8.128 8.128 7.624 0.504 19504 1589 1 23 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.314 -0.296 19504 1590 1 23 . 1 1 15 15 LEU H H 15 8.721 8.721 7.486 1.235 19504 1591 1 23 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.034 -0.115 19504 1592 1 23 . 1 1 16 16 GLU H H 16 8.468 8.468 8.333 0.135 19504 1593 1 23 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.298 -0.310 19504 1594 1 23 . 1 1 17 17 LYS H H 17 8.128 8.128 7.804 0.324 19504 1595 1 23 . 1 1 18 18 MET HA H 18 4.115 4.115 4.461 -0.346 19504 1596 1 23 . 1 1 18 18 MET H H 18 8.403 8.403 7.464 0.939 19504 1597 1 23 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.996 -0.213 19504 1598 1 23 . 1 1 19 19 ALA H H 19 8.719 8.719 8.237 0.482 19504 1599 1 23 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.003 0.118 19504 1600 1 23 . 1 1 20 20 ARG H H 20 7.889 7.889 7.677 0.212 19504 1601 1 23 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.058 0.022 19504 1602 1 23 . 1 1 21 21 ARG H H 21 7.968 7.968 8.282 -0.314 19504 1603 1 23 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.236 0.153 19504 1604 1 23 . 1 1 22 22 GLU H H 22 8.035 8.035 8.114 -0.079 19504 1605 1 23 . 1 1 23 23 GLY H H 23 7.912 7.912 8.136 -0.224 19504 1606 1 23 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.799 0.041 19504 1607 1 23 . 1 1 24 24 LEU H H 24 8.149 8.149 7.438 0.711 19504 1608 1 23 . 1 1 25 25 SER HA H 25 4.563 4.563 4.631 -0.068 19504 1609 1 23 . 1 1 25 25 SER H H 25 8.182 8.182 7.967 0.215 19504 1610 1 23 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.003 -0.306 19504 1611 1 23 . 1 1 26 26 LYS H H 26 9.270 9.270 8.858 0.412 19504 1612 1 23 . 1 1 27 27 SER HA H 27 3.972 3.972 4.283 -0.311 19504 1613 1 23 . 1 1 27 27 SER H H 27 8.615 8.615 7.719 0.896 19504 1614 1 23 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.000 0.169 19504 1615 1 23 . 1 1 28 28 GLU H H 28 7.969 7.969 7.580 0.389 19504 1616 1 23 . 1 1 29 29 MET HA H 29 4.239 4.239 4.456 -0.217 19504 1617 1 23 . 1 1 29 29 MET H H 29 8.768 8.768 7.738 1.030 19504 1618 1 23 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.828 -0.453 19504 1619 1 23 . 1 1 30 30 ILE H H 30 7.966 7.966 7.544 0.422 19504 1620 1 23 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.522 -0.286 19504 1621 1 23 . 1 1 31 31 ASN H H 31 7.862 7.862 8.357 -0.495 19504 1622 1 23 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.716 -0.008 19504 1623 1 23 . 1 1 32 32 VAL H H 32 8.463 8.463 7.523 0.940 19504 1624 1 23 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.252 -0.437 19504 1625 1 23 . 1 1 33 33 ALA H H 33 8.285 8.285 7.779 0.506 19504 1626 1 23 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.105 -0.153 19504 1627 1 23 . 1 1 34 34 LEU H H 34 8.506 8.506 7.596 0.910 19504 1628 1 23 . 1 1 35 35 GLN HA H 35 3.999 3.999 3.963 0.036 19504 1629 1 23 . 1 1 35 35 GLN H H 35 8.340 8.340 7.758 0.582 19504 1630 1 23 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.361 0.164 19504 1631 1 23 . 1 1 36 36 HIS H H 36 7.859 7.859 7.243 0.616 19504 1632 1 23 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.231 0.067 19504 1633 1 23 . 1 1 37 37 TYR H H 37 7.655 7.655 7.471 0.184 19504 1634 1 24 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.989 0.099 19504 1635 1 24 . 1 1 2 2 TRP H H 2 9.010 9.010 8.365 0.645 19504 1636 1 24 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.836 -0.146 19504 1637 1 24 . 1 1 3 3 LEU H H 3 9.506 9.506 8.611 0.895 19504 1638 1 24 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.060 0.745 19504 1639 1 24 . 1 1 4 4 CYS H H 4 8.997 8.997 8.417 0.580 19504 1640 1 24 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.647 0.128 19504 1641 1 24 . 1 1 5 5 ILE H H 5 9.319 9.319 8.426 0.893 19504 1642 1 24 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.995 -0.639 19504 1643 1 24 . 1 1 6 6 TRP H H 6 8.606 8.606 8.405 0.201 19504 1644 1 24 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.564 -0.036 19504 1645 1 24 . 1 1 7 7 LEU H H 7 7.784 7.784 7.982 -0.198 19504 1646 1 24 . 1 1 8 8 SER HA H 8 4.275 4.275 4.081 0.194 19504 1647 1 24 . 1 1 8 8 SER H H 8 8.678 8.678 8.396 0.282 19504 1648 1 24 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.358 -0.183 19504 1649 1 24 . 1 1 9 9 ASP H H 9 9.066 9.066 8.092 0.974 19504 1650 1 24 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.032 -0.074 19504 1651 1 24 . 1 1 10 10 GLN H H 10 8.689 8.689 8.650 0.039 19504 1652 1 24 . 1 1 11 11 THR HA H 11 4.045 4.045 4.212 -0.167 19504 1653 1 24 . 1 1 11 11 THR H H 11 8.000 8.000 7.746 0.254 19504 1654 1 24 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.028 -0.196 19504 1655 1 24 . 1 1 12 12 LEU H H 12 8.482 8.482 7.783 0.699 19504 1656 1 24 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.997 0.034 19504 1657 1 24 . 1 1 13 13 GLU H H 13 8.242 8.242 8.275 -0.033 19504 1658 1 24 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.376 0.008 19504 1659 1 24 . 1 1 14 14 ASP H H 14 8.128 8.128 8.418 -0.290 19504 1660 1 24 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.126 -0.108 19504 1661 1 24 . 1 1 15 15 LEU H H 15 8.721 8.721 7.576 1.145 19504 1662 1 24 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.004 -0.085 19504 1663 1 24 . 1 1 16 16 GLU H H 16 8.468 8.468 8.315 0.153 19504 1664 1 24 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.168 -0.180 19504 1665 1 24 . 1 1 17 17 LYS H H 17 8.128 8.128 7.979 0.149 19504 1666 1 24 . 1 1 18 18 MET HA H 18 4.115 4.115 4.445 -0.330 19504 1667 1 24 . 1 1 18 18 MET H H 18 8.403 8.403 7.423 0.980 19504 1668 1 24 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.298 -0.515 19504 1669 1 24 . 1 1 19 19 ALA H H 19 8.719 8.719 8.026 0.693 19504 1670 1 24 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.995 0.126 19504 1671 1 24 . 1 1 20 20 ARG H H 20 7.889 7.889 7.763 0.126 19504 1672 1 24 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.071 0.009 19504 1673 1 24 . 1 1 21 21 ARG H H 21 7.968 7.968 7.718 0.250 19504 1674 1 24 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.383 0.006 19504 1675 1 24 . 1 1 22 22 GLU H H 22 8.035 8.035 7.734 0.301 19504 1676 1 24 . 1 1 23 23 GLY H H 23 7.912 7.912 8.083 -0.171 19504 1677 1 24 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.396 0.444 19504 1678 1 24 . 1 1 24 24 LEU H H 24 8.149 8.149 7.812 0.337 19504 1679 1 24 . 1 1 25 25 SER HA H 25 4.563 4.563 4.765 -0.202 19504 1680 1 24 . 1 1 25 25 SER H H 25 8.182 8.182 8.067 0.115 19504 1681 1 24 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.920 -0.223 19504 1682 1 24 . 1 1 26 26 LYS H H 26 9.270 9.270 8.827 0.443 19504 1683 1 24 . 1 1 27 27 SER HA H 27 3.972 3.972 4.347 -0.375 19504 1684 1 24 . 1 1 27 27 SER H H 27 8.615 8.615 7.812 0.803 19504 1685 1 24 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.055 0.114 19504 1686 1 24 . 1 1 28 28 GLU H H 28 7.969 7.969 7.644 0.325 19504 1687 1 24 . 1 1 29 29 MET HA H 29 4.239 4.239 4.390 -0.151 19504 1688 1 24 . 1 1 29 29 MET H H 29 8.768 8.768 8.387 0.381 19504 1689 1 24 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.708 -0.333 19504 1690 1 24 . 1 1 30 30 ILE H H 30 7.966 7.966 7.503 0.463 19504 1691 1 24 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.421 -0.185 19504 1692 1 24 . 1 1 31 31 ASN H H 31 7.862 7.862 8.763 -0.901 19504 1693 1 24 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.809 -0.101 19504 1694 1 24 . 1 1 32 32 VAL H H 32 8.463 8.463 7.522 0.941 19504 1695 1 24 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.171 -0.356 19504 1696 1 24 . 1 1 33 33 ALA H H 33 8.285 8.285 7.650 0.635 19504 1697 1 24 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.173 -0.221 19504 1698 1 24 . 1 1 34 34 LEU H H 34 8.506 8.506 7.420 1.086 19504 1699 1 24 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.065 -0.066 19504 1700 1 24 . 1 1 35 35 GLN H H 35 8.340 8.340 7.590 0.750 19504 1701 1 24 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.726 -0.201 19504 1702 1 24 . 1 1 36 36 HIS H H 36 7.859 7.859 7.768 0.091 19504 1703 1 24 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.335 -0.037 19504 1704 1 24 . 1 1 37 37 TYR H H 37 7.655 7.655 7.662 -0.007 19504 1705 1 25 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.986 0.102 19504 1706 1 25 . 1 1 2 2 TRP H H 2 9.010 9.010 8.362 0.648 19504 1707 1 25 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.818 -0.128 19504 1708 1 25 . 1 1 3 3 LEU H H 3 9.506 9.506 8.601 0.905 19504 1709 1 25 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.027 0.778 19504 1710 1 25 . 1 1 4 4 CYS H H 4 8.997 8.997 8.392 0.605 19504 1711 1 25 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.547 0.228 19504 1712 1 25 . 1 1 5 5 ILE H H 5 9.319 9.319 8.388 0.931 19504 1713 1 25 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.890 -0.534 19504 1714 1 25 . 1 1 6 6 TRP H H 6 8.606 8.606 8.401 0.205 19504 1715 1 25 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.518 0.010 19504 1716 1 25 . 1 1 7 7 LEU H H 7 7.784 7.784 7.675 0.109 19504 1717 1 25 . 1 1 8 8 SER HA H 8 4.275 4.275 4.041 0.234 19504 1718 1 25 . 1 1 8 8 SER H H 8 8.678 8.678 7.645 1.033 19504 1719 1 25 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.219 -0.044 19504 1720 1 25 . 1 1 9 9 ASP H H 9 9.066 9.066 8.605 0.461 19504 1721 1 25 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.008 -0.050 19504 1722 1 25 . 1 1 10 10 GLN H H 10 8.689 8.689 8.361 0.328 19504 1723 1 25 . 1 1 11 11 THR HA H 11 4.045 4.045 4.665 -0.620 19504 1724 1 25 . 1 1 11 11 THR H H 11 8.000 8.000 7.497 0.503 19504 1725 1 25 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.035 -0.203 19504 1726 1 25 . 1 1 12 12 LEU H H 12 8.482 8.482 7.625 0.857 19504 1727 1 25 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.122 -0.091 19504 1728 1 25 . 1 1 13 13 GLU H H 13 8.242 8.242 7.922 0.320 19504 1729 1 25 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.400 -0.016 19504 1730 1 25 . 1 1 14 14 ASP H H 14 8.128 8.128 7.884 0.244 19504 1731 1 25 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.209 -0.191 19504 1732 1 25 . 1 1 15 15 LEU H H 15 8.721 8.721 7.683 1.038 19504 1733 1 25 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.277 -0.358 19504 1734 1 25 . 1 1 16 16 GLU H H 16 8.468 8.468 8.010 0.458 19504 1735 1 25 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.190 -0.202 19504 1736 1 25 . 1 1 17 17 LYS H H 17 8.128 8.128 7.665 0.463 19504 1737 1 25 . 1 1 18 18 MET HA H 18 4.115 4.115 4.114 0.001 19504 1738 1 25 . 1 1 18 18 MET H H 18 8.403 8.403 7.712 0.691 19504 1739 1 25 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.944 -0.161 19504 1740 1 25 . 1 1 19 19 ALA H H 19 8.719 8.719 8.464 0.255 19504 1741 1 25 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.003 0.118 19504 1742 1 25 . 1 1 20 20 ARG H H 20 7.889 7.889 7.589 0.300 19504 1743 1 25 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.062 0.018 19504 1744 1 25 . 1 1 21 21 ARG H H 21 7.968 7.968 7.675 0.293 19504 1745 1 25 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.274 0.115 19504 1746 1 25 . 1 1 22 22 GLU H H 22 8.035 8.035 8.408 -0.373 19504 1747 1 25 . 1 1 23 23 GLY H H 23 7.912 7.912 7.980 -0.068 19504 1748 1 25 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.645 0.195 19504 1749 1 25 . 1 1 24 24 LEU H H 24 8.149 8.149 8.054 0.095 19504 1750 1 25 . 1 1 25 25 SER HA H 25 4.563 4.563 4.842 -0.279 19504 1751 1 25 . 1 1 25 25 SER H H 25 8.182 8.182 8.243 -0.061 19504 1752 1 25 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.917 -0.220 19504 1753 1 25 . 1 1 26 26 LYS H H 26 9.270 9.270 8.773 0.497 19504 1754 1 25 . 1 1 27 27 SER HA H 27 3.972 3.972 4.332 -0.360 19504 1755 1 25 . 1 1 27 27 SER H H 27 8.615 8.615 8.175 0.440 19504 1756 1 25 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.067 0.102 19504 1757 1 25 . 1 1 28 28 GLU H H 28 7.969 7.969 8.453 -0.484 19504 1758 1 25 . 1 1 29 29 MET HA H 29 4.239 4.239 4.316 -0.077 19504 1759 1 25 . 1 1 29 29 MET H H 29 8.768 8.768 8.487 0.281 19504 1760 1 25 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.765 -0.390 19504 1761 1 25 . 1 1 30 30 ILE H H 30 7.966 7.966 7.428 0.538 19504 1762 1 25 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.472 -0.236 19504 1763 1 25 . 1 1 31 31 ASN H H 31 7.862 7.862 7.978 -0.116 19504 1764 1 25 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.688 0.020 19504 1765 1 25 . 1 1 32 32 VAL H H 32 8.463 8.463 7.599 0.864 19504 1766 1 25 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.096 -0.281 19504 1767 1 25 . 1 1 33 33 ALA H H 33 8.285 8.285 7.934 0.351 19504 1768 1 25 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.168 -0.216 19504 1769 1 25 . 1 1 34 34 LEU H H 34 8.506 8.506 7.732 0.774 19504 1770 1 25 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.071 -0.072 19504 1771 1 25 . 1 1 35 35 GLN H H 35 8.340 8.340 8.075 0.265 19504 1772 1 25 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.550 -0.025 19504 1773 1 25 . 1 1 36 36 HIS H H 36 7.859 7.859 7.609 0.250 19504 1774 1 25 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.119 0.179 19504 1775 1 25 . 1 1 37 37 TYR H H 37 7.655 7.655 8.003 -0.348 19504 1776 1 26 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.906 0.182 19504 1777 1 26 . 1 1 2 2 TRP H H 2 9.010 9.010 8.264 0.746 19504 1778 1 26 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.781 -0.091 19504 1779 1 26 . 1 1 3 3 LEU H H 3 9.506 9.506 8.456 1.050 19504 1780 1 26 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.961 0.844 19504 1781 1 26 . 1 1 4 4 CYS H H 4 8.997 8.997 8.727 0.270 19504 1782 1 26 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.560 0.215 19504 1783 1 26 . 1 1 5 5 ILE H H 5 9.319 9.319 8.355 0.964 19504 1784 1 26 . 1 1 6 6 TRP HA H 6 4.356 4.356 5.044 -0.688 19504 1785 1 26 . 1 1 6 6 TRP H H 6 8.606 8.606 8.295 0.311 19504 1786 1 26 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.439 0.089 19504 1787 1 26 . 1 1 7 7 LEU H H 7 7.784 7.784 7.939 -0.155 19504 1788 1 26 . 1 1 8 8 SER HA H 8 4.275 4.275 4.073 0.202 19504 1789 1 26 . 1 1 8 8 SER H H 8 8.678 8.678 8.195 0.483 19504 1790 1 26 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.267 -0.092 19504 1791 1 26 . 1 1 9 9 ASP H H 9 9.066 9.066 8.364 0.702 19504 1792 1 26 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.995 -0.037 19504 1793 1 26 . 1 1 10 10 GLN H H 10 8.689 8.689 8.703 -0.014 19504 1794 1 26 . 1 1 11 11 THR HA H 11 4.045 4.045 4.192 -0.147 19504 1795 1 26 . 1 1 11 11 THR H H 11 8.000 8.000 7.624 0.376 19504 1796 1 26 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.171 -0.339 19504 1797 1 26 . 1 1 12 12 LEU H H 12 8.482 8.482 7.660 0.822 19504 1798 1 26 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.141 -0.110 19504 1799 1 26 . 1 1 13 13 GLU H H 13 8.242 8.242 8.175 0.067 19504 1800 1 26 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.363 0.021 19504 1801 1 26 . 1 1 14 14 ASP H H 14 8.128 8.128 8.408 -0.280 19504 1802 1 26 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.201 -0.183 19504 1803 1 26 . 1 1 15 15 LEU H H 15 8.721 8.721 7.557 1.164 19504 1804 1 26 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.360 -0.441 19504 1805 1 26 . 1 1 16 16 GLU H H 16 8.468 8.468 8.011 0.457 19504 1806 1 26 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.228 -0.240 19504 1807 1 26 . 1 1 17 17 LYS H H 17 8.128 8.128 7.545 0.583 19504 1808 1 26 . 1 1 18 18 MET HA H 18 4.115 4.115 4.338 -0.223 19504 1809 1 26 . 1 1 18 18 MET H H 18 8.403 8.403 7.690 0.713 19504 1810 1 26 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.081 -0.298 19504 1811 1 26 . 1 1 19 19 ALA H H 19 8.719 8.719 8.333 0.386 19504 1812 1 26 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.125 -0.004 19504 1813 1 26 . 1 1 20 20 ARG H H 20 7.889 7.889 7.745 0.144 19504 1814 1 26 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.111 -0.031 19504 1815 1 26 . 1 1 21 21 ARG H H 21 7.968 7.968 8.645 -0.677 19504 1816 1 26 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.486 -0.097 19504 1817 1 26 . 1 1 22 22 GLU H H 22 8.035 8.035 7.980 0.055 19504 1818 1 26 . 1 1 23 23 GLY H H 23 7.912 7.912 7.710 0.202 19504 1819 1 26 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.864 0.976 19504 1820 1 26 . 1 1 24 24 LEU H H 24 8.149 8.149 7.526 0.623 19504 1821 1 26 . 1 1 25 25 SER HA H 25 4.563 4.563 4.401 0.162 19504 1822 1 26 . 1 1 25 25 SER H H 25 8.182 8.182 8.145 0.037 19504 1823 1 26 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.044 -0.347 19504 1824 1 26 . 1 1 26 26 LYS H H 26 9.270 9.270 8.872 0.398 19504 1825 1 26 . 1 1 27 27 SER HA H 27 3.972 3.972 4.398 -0.426 19504 1826 1 26 . 1 1 27 27 SER H H 27 8.615 8.615 8.202 0.413 19504 1827 1 26 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.119 0.050 19504 1828 1 26 . 1 1 28 28 GLU H H 28 7.969 7.969 8.476 -0.507 19504 1829 1 26 . 1 1 29 29 MET HA H 29 4.239 4.239 4.336 -0.097 19504 1830 1 26 . 1 1 29 29 MET H H 29 8.768 8.768 8.495 0.273 19504 1831 1 26 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.849 -0.474 19504 1832 1 26 . 1 1 30 30 ILE H H 30 7.966 7.966 7.367 0.599 19504 1833 1 26 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.537 -0.301 19504 1834 1 26 . 1 1 31 31 ASN H H 31 7.862 7.862 8.243 -0.381 19504 1835 1 26 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.794 -0.086 19504 1836 1 26 . 1 1 32 32 VAL H H 32 8.463 8.463 8.041 0.422 19504 1837 1 26 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.086 -0.271 19504 1838 1 26 . 1 1 33 33 ALA H H 33 8.285 8.285 7.732 0.553 19504 1839 1 26 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.276 -0.324 19504 1840 1 26 . 1 1 34 34 LEU H H 34 8.506 8.506 7.562 0.944 19504 1841 1 26 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.086 -0.087 19504 1842 1 26 . 1 1 35 35 GLN H H 35 8.340 8.340 7.692 0.647 19504 1843 1 26 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.722 -0.197 19504 1844 1 26 . 1 1 36 36 HIS H H 36 7.859 7.859 7.668 0.191 19504 1845 1 26 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.508 -0.210 19504 1846 1 26 . 1 1 37 37 TYR H H 37 7.655 7.655 7.477 0.178 19504 1847 1 27 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.887 0.201 19504 1848 1 27 . 1 1 2 2 TRP H H 2 9.010 9.010 8.373 0.637 19504 1849 1 27 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.702 -0.012 19504 1850 1 27 . 1 1 3 3 LEU H H 3 9.506 9.506 8.533 0.973 19504 1851 1 27 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.879 0.926 19504 1852 1 27 . 1 1 4 4 CYS H H 4 8.997 8.997 8.614 0.383 19504 1853 1 27 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.588 0.187 19504 1854 1 27 . 1 1 5 5 ILE H H 5 9.319 9.319 8.347 0.972 19504 1855 1 27 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.945 -0.589 19504 1856 1 27 . 1 1 6 6 TRP H H 6 8.606 8.606 8.375 0.231 19504 1857 1 27 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.406 0.122 19504 1858 1 27 . 1 1 7 7 LEU H H 7 7.784 7.784 7.774 0.010 19504 1859 1 27 . 1 1 8 8 SER HA H 8 4.275 4.275 4.107 0.168 19504 1860 1 27 . 1 1 8 8 SER H H 8 8.678 8.678 7.879 0.799 19504 1861 1 27 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.258 -0.083 19504 1862 1 27 . 1 1 9 9 ASP H H 9 9.066 9.066 8.610 0.456 19504 1863 1 27 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.045 -0.087 19504 1864 1 27 . 1 1 10 10 GLN H H 10 8.689 8.689 8.711 -0.022 19504 1865 1 27 . 1 1 11 11 THR HA H 11 4.045 4.045 4.340 -0.295 19504 1866 1 27 . 1 1 11 11 THR H H 11 8.000 8.000 7.492 0.508 19504 1867 1 27 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.203 -0.371 19504 1868 1 27 . 1 1 12 12 LEU H H 12 8.482 8.482 7.537 0.945 19504 1869 1 27 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.116 -0.085 19504 1870 1 27 . 1 1 13 13 GLU H H 13 8.242 8.242 8.276 -0.034 19504 1871 1 27 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.402 -0.018 19504 1872 1 27 . 1 1 14 14 ASP H H 14 8.128 8.128 7.651 0.477 19504 1873 1 27 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.310 -0.292 19504 1874 1 27 . 1 1 15 15 LEU H H 15 8.721 8.721 7.469 1.252 19504 1875 1 27 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.255 -0.336 19504 1876 1 27 . 1 1 16 16 GLU H H 16 8.468 8.468 7.427 1.041 19504 1877 1 27 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.325 -0.337 19504 1878 1 27 . 1 1 17 17 LYS H H 17 8.128 8.128 7.441 0.687 19504 1879 1 27 . 1 1 18 18 MET HA H 18 4.115 4.115 4.490 -0.375 19504 1880 1 27 . 1 1 18 18 MET H H 18 8.403 8.403 7.714 0.689 19504 1881 1 27 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.348 -0.565 19504 1882 1 27 . 1 1 19 19 ALA H H 19 8.719 8.719 8.076 0.643 19504 1883 1 27 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.086 0.035 19504 1884 1 27 . 1 1 20 20 ARG H H 20 7.889 7.889 7.622 0.267 19504 1885 1 27 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.072 0.008 19504 1886 1 27 . 1 1 21 21 ARG H H 21 7.968 7.968 8.611 -0.643 19504 1887 1 27 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.385 0.004 19504 1888 1 27 . 1 1 22 22 GLU H H 22 8.035 8.035 8.540 -0.505 19504 1889 1 27 . 1 1 23 23 GLY H H 23 7.912 7.912 7.987 -0.075 19504 1890 1 27 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.868 0.972 19504 1891 1 27 . 1 1 24 24 LEU H H 24 8.149 8.149 7.890 0.259 19504 1892 1 27 . 1 1 25 25 SER HA H 25 4.563 4.563 4.363 0.200 19504 1893 1 27 . 1 1 25 25 SER H H 25 8.182 8.182 8.335 -0.153 19504 1894 1 27 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.973 -0.276 19504 1895 1 27 . 1 1 26 26 LYS H H 26 9.270 9.270 8.856 0.414 19504 1896 1 27 . 1 1 27 27 SER HA H 27 3.972 3.972 4.324 -0.352 19504 1897 1 27 . 1 1 27 27 SER H H 27 8.615 8.615 8.200 0.415 19504 1898 1 27 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.042 0.127 19504 1899 1 27 . 1 1 28 28 GLU H H 28 7.969 7.969 8.123 -0.154 19504 1900 1 27 . 1 1 29 29 MET HA H 29 4.239 4.239 4.331 -0.092 19504 1901 1 27 . 1 1 29 29 MET H H 29 8.768 8.768 8.770 -0.002 19504 1902 1 27 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.819 -0.444 19504 1903 1 27 . 1 1 30 30 ILE H H 30 7.966 7.966 7.601 0.365 19504 1904 1 27 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.542 -0.306 19504 1905 1 27 . 1 1 31 31 ASN H H 31 7.862 7.862 7.362 0.500 19504 1906 1 27 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.588 0.120 19504 1907 1 27 . 1 1 32 32 VAL H H 32 8.463 8.463 7.923 0.540 19504 1908 1 27 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.391 0.424 19504 1909 1 27 . 1 1 33 33 ALA H H 33 8.285 8.285 7.617 0.668 19504 1910 1 27 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.155 -0.203 19504 1911 1 27 . 1 1 34 34 LEU H H 34 8.506 8.506 7.465 1.041 19504 1912 1 27 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.163 -0.164 19504 1913 1 27 . 1 1 35 35 GLN H H 35 8.340 8.340 7.605 0.735 19504 1914 1 27 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.667 -0.142 19504 1915 1 27 . 1 1 36 36 HIS H H 36 7.859 7.859 8.196 -0.337 19504 1916 1 27 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.526 -0.228 19504 1917 1 27 . 1 1 37 37 TYR H H 37 7.655 7.655 7.629 0.026 19504 1918 1 28 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.940 0.148 19504 1919 1 28 . 1 1 2 2 TRP H H 2 9.010 9.010 8.257 0.753 19504 1920 1 28 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.765 -0.075 19504 1921 1 28 . 1 1 3 3 LEU H H 3 9.506 9.506 8.488 1.018 19504 1922 1 28 . 1 1 4 4 CYS HA H 4 5.805 5.805 5.004 0.801 19504 1923 1 28 . 1 1 4 4 CYS H H 4 8.997 8.997 8.727 0.270 19504 1924 1 28 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.622 0.153 19504 1925 1 28 . 1 1 5 5 ILE H H 5 9.319 9.319 8.426 0.893 19504 1926 1 28 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.974 -0.618 19504 1927 1 28 . 1 1 6 6 TRP H H 6 8.606 8.606 8.390 0.216 19504 1928 1 28 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.436 0.092 19504 1929 1 28 . 1 1 7 7 LEU H H 7 7.784 7.784 7.811 -0.027 19504 1930 1 28 . 1 1 8 8 SER HA H 8 4.275 4.275 3.931 0.344 19504 1931 1 28 . 1 1 8 8 SER H H 8 8.678 8.678 8.155 0.522 19504 1932 1 28 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.244 -0.069 19504 1933 1 28 . 1 1 9 9 ASP H H 9 9.066 9.066 8.681 0.385 19504 1934 1 28 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.228 -0.270 19504 1935 1 28 . 1 1 10 10 GLN H H 10 8.689 8.689 8.357 0.332 19504 1936 1 28 . 1 1 11 11 THR HA H 11 4.045 4.045 4.257 -0.212 19504 1937 1 28 . 1 1 11 11 THR H H 11 8.000 8.000 7.950 0.050 19504 1938 1 28 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.122 -0.290 19504 1939 1 28 . 1 1 12 12 LEU H H 12 8.482 8.482 7.825 0.657 19504 1940 1 28 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.153 -0.122 19504 1941 1 28 . 1 1 13 13 GLU H H 13 8.242 8.242 7.514 0.728 19504 1942 1 28 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.354 0.030 19504 1943 1 28 . 1 1 14 14 ASP H H 14 8.128 8.128 7.915 0.213 19504 1944 1 28 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.109 -0.091 19504 1945 1 28 . 1 1 15 15 LEU H H 15 8.721 8.721 7.531 1.190 19504 1946 1 28 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.152 -0.233 19504 1947 1 28 . 1 1 16 16 GLU H H 16 8.468 8.468 7.948 0.520 19504 1948 1 28 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.167 -0.179 19504 1949 1 28 . 1 1 17 17 LYS H H 17 8.128 8.128 7.482 0.646 19504 1950 1 28 . 1 1 18 18 MET HA H 18 4.115 4.115 4.488 -0.373 19504 1951 1 28 . 1 1 18 18 MET H H 18 8.403 8.403 7.731 0.672 19504 1952 1 28 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.284 -0.501 19504 1953 1 28 . 1 1 19 19 ALA H H 19 8.719 8.719 7.586 1.133 19504 1954 1 28 . 1 1 20 20 ARG HA H 20 4.121 4.121 3.988 0.133 19504 1955 1 28 . 1 1 20 20 ARG H H 20 7.889 7.889 7.813 0.076 19504 1956 1 28 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.065 0.015 19504 1957 1 28 . 1 1 21 21 ARG H H 21 7.968 7.968 7.764 0.204 19504 1958 1 28 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.316 0.073 19504 1959 1 28 . 1 1 22 22 GLU H H 22 8.035 8.035 7.970 0.065 19504 1960 1 28 . 1 1 23 23 GLY H H 23 7.912 7.912 8.217 -0.305 19504 1961 1 28 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.382 0.458 19504 1962 1 28 . 1 1 24 24 LEU H H 24 8.149 8.149 7.713 0.436 19504 1963 1 28 . 1 1 25 25 SER HA H 25 4.563 4.563 4.596 -0.033 19504 1964 1 28 . 1 1 25 25 SER H H 25 8.182 8.182 8.117 0.065 19504 1965 1 28 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.010 -0.313 19504 1966 1 28 . 1 1 26 26 LYS H H 26 9.270 9.270 8.720 0.550 19504 1967 1 28 . 1 1 27 27 SER HA H 27 3.972 3.972 4.417 -0.445 19504 1968 1 28 . 1 1 27 27 SER H H 27 8.615 8.615 8.033 0.582 19504 1969 1 28 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.125 0.044 19504 1970 1 28 . 1 1 28 28 GLU H H 28 7.969 7.969 8.808 -0.839 19504 1971 1 28 . 1 1 29 29 MET HA H 29 4.239 4.239 4.434 -0.195 19504 1972 1 28 . 1 1 29 29 MET H H 29 8.768 8.768 7.924 0.844 19504 1973 1 28 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.712 -0.337 19504 1974 1 28 . 1 1 30 30 ILE H H 30 7.966 7.966 7.434 0.532 19504 1975 1 28 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.425 -0.189 19504 1976 1 28 . 1 1 31 31 ASN H H 31 7.862 7.862 8.631 -0.769 19504 1977 1 28 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.685 0.023 19504 1978 1 28 . 1 1 32 32 VAL H H 32 8.463 8.463 7.532 0.931 19504 1979 1 28 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.124 -0.309 19504 1980 1 28 . 1 1 33 33 ALA H H 33 8.285 8.285 7.649 0.636 19504 1981 1 28 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.166 -0.214 19504 1982 1 28 . 1 1 34 34 LEU H H 34 8.506 8.506 7.404 1.102 19504 1983 1 28 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.058 -0.059 19504 1984 1 28 . 1 1 35 35 GLN H H 35 8.340 8.340 7.543 0.797 19504 1985 1 28 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.658 -0.133 19504 1986 1 28 . 1 1 36 36 HIS H H 36 7.859 7.859 7.835 0.024 19504 1987 1 28 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.307 -0.009 19504 1988 1 28 . 1 1 37 37 TYR H H 37 7.655 7.655 7.623 0.032 19504 1989 1 29 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.679 0.409 19504 1990 1 29 . 1 1 2 2 TRP H H 2 9.010 9.010 8.276 0.734 19504 1991 1 29 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.750 -0.060 19504 1992 1 29 . 1 1 3 3 LEU H H 3 9.506 9.506 8.413 1.093 19504 1993 1 29 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.985 0.820 19504 1994 1 29 . 1 1 4 4 CYS H H 4 8.997 8.997 8.751 0.246 19504 1995 1 29 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.697 0.078 19504 1996 1 29 . 1 1 5 5 ILE H H 5 9.319 9.319 8.460 0.859 19504 1997 1 29 . 1 1 6 6 TRP HA H 6 4.356 4.356 5.016 -0.660 19504 1998 1 29 . 1 1 6 6 TRP H H 6 8.606 8.606 8.344 0.262 19504 1999 1 29 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.346 0.182 19504 2000 1 29 . 1 1 7 7 LEU H H 7 7.784 7.784 7.953 -0.169 19504 2001 1 29 . 1 1 8 8 SER HA H 8 4.275 4.275 4.074 0.201 19504 2002 1 29 . 1 1 8 8 SER H H 8 8.678 8.678 8.007 0.671 19504 2003 1 29 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.397 -0.222 19504 2004 1 29 . 1 1 9 9 ASP H H 9 9.066 9.066 8.291 0.775 19504 2005 1 29 . 1 1 10 10 GLN HA H 10 3.958 3.958 3.976 -0.018 19504 2006 1 29 . 1 1 10 10 GLN H H 10 8.689 8.689 8.865 -0.176 19504 2007 1 29 . 1 1 11 11 THR HA H 11 4.045 4.045 4.212 -0.167 19504 2008 1 29 . 1 1 11 11 THR H H 11 8.000 8.000 7.628 0.372 19504 2009 1 29 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.138 -0.306 19504 2010 1 29 . 1 1 12 12 LEU H H 12 8.482 8.482 7.698 0.784 19504 2011 1 29 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.028 0.003 19504 2012 1 29 . 1 1 13 13 GLU H H 13 8.242 8.242 8.098 0.144 19504 2013 1 29 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.336 0.048 19504 2014 1 29 . 1 1 14 14 ASP H H 14 8.128 8.128 8.521 -0.393 19504 2015 1 29 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.161 -0.143 19504 2016 1 29 . 1 1 15 15 LEU H H 15 8.721 8.721 7.425 1.296 19504 2017 1 29 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.218 -0.299 19504 2018 1 29 . 1 1 16 16 GLU H H 16 8.468 8.468 7.873 0.595 19504 2019 1 29 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.259 -0.271 19504 2020 1 29 . 1 1 17 17 LYS H H 17 8.128 8.128 7.482 0.646 19504 2021 1 29 . 1 1 18 18 MET HA H 18 4.115 4.115 4.367 -0.252 19504 2022 1 29 . 1 1 18 18 MET H H 18 8.403 8.403 7.448 0.955 19504 2023 1 29 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.266 -0.483 19504 2024 1 29 . 1 1 19 19 ALA H H 19 8.719 8.719 7.908 0.811 19504 2025 1 29 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.034 0.087 19504 2026 1 29 . 1 1 20 20 ARG H H 20 7.889 7.889 7.644 0.245 19504 2027 1 29 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.077 0.003 19504 2028 1 29 . 1 1 21 21 ARG H H 21 7.968 7.968 8.306 -0.338 19504 2029 1 29 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.328 0.061 19504 2030 1 29 . 1 1 22 22 GLU H H 22 8.035 8.035 8.013 0.022 19504 2031 1 29 . 1 1 23 23 GLY H H 23 7.912 7.912 7.917 -0.005 19504 2032 1 29 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.831 0.009 19504 2033 1 29 . 1 1 24 24 LEU H H 24 8.149 8.149 7.874 0.275 19504 2034 1 29 . 1 1 25 25 SER HA H 25 4.563 4.563 4.734 -0.171 19504 2035 1 29 . 1 1 25 25 SER H H 25 8.182 8.182 8.317 -0.135 19504 2036 1 29 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.042 -0.345 19504 2037 1 29 . 1 1 26 26 LYS H H 26 9.270 9.270 8.819 0.451 19504 2038 1 29 . 1 1 27 27 SER HA H 27 3.972 3.972 4.305 -0.333 19504 2039 1 29 . 1 1 27 27 SER H H 27 8.615 8.615 7.751 0.864 19504 2040 1 29 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.061 0.108 19504 2041 1 29 . 1 1 28 28 GLU H H 28 7.969 7.969 7.625 0.344 19504 2042 1 29 . 1 1 29 29 MET HA H 29 4.239 4.239 4.329 -0.090 19504 2043 1 29 . 1 1 29 29 MET H H 29 8.768 8.768 8.405 0.363 19504 2044 1 29 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.721 -0.346 19504 2045 1 29 . 1 1 30 30 ILE H H 30 7.966 7.966 7.411 0.555 19504 2046 1 29 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.479 -0.243 19504 2047 1 29 . 1 1 31 31 ASN H H 31 7.862 7.862 8.445 -0.583 19504 2048 1 29 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.631 0.077 19504 2049 1 29 . 1 1 32 32 VAL H H 32 8.463 8.463 7.637 0.826 19504 2050 1 29 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.108 -0.293 19504 2051 1 29 . 1 1 33 33 ALA H H 33 8.285 8.285 7.766 0.519 19504 2052 1 29 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.201 -0.249 19504 2053 1 29 . 1 1 34 34 LEU H H 34 8.506 8.506 7.617 0.889 19504 2054 1 29 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.093 -0.094 19504 2055 1 29 . 1 1 35 35 GLN H H 35 8.340 8.340 7.689 0.651 19504 2056 1 29 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.703 -0.178 19504 2057 1 29 . 1 1 36 36 HIS H H 36 7.859 7.859 7.654 0.205 19504 2058 1 29 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.584 -0.286 19504 2059 1 29 . 1 1 37 37 TYR H H 37 7.655 7.655 7.550 0.105 19504 2060 1 30 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.902 0.186 19504 2061 1 30 . 1 1 2 2 TRP H H 2 9.010 9.010 8.235 0.775 19504 2062 1 30 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.773 -0.083 19504 2063 1 30 . 1 1 3 3 LEU H H 3 9.506 9.506 8.457 1.049 19504 2064 1 30 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.991 0.814 19504 2065 1 30 . 1 1 4 4 CYS H H 4 8.997 8.997 8.714 0.283 19504 2066 1 30 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.602 0.173 19504 2067 1 30 . 1 1 5 5 ILE H H 5 9.319 9.319 8.451 0.868 19504 2068 1 30 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.966 -0.610 19504 2069 1 30 . 1 1 6 6 TRP H H 6 8.606 8.606 8.402 0.204 19504 2070 1 30 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.502 0.026 19504 2071 1 30 . 1 1 7 7 LEU H H 7 7.784 7.784 7.864 -0.080 19504 2072 1 30 . 1 1 8 8 SER HA H 8 4.275 4.275 4.018 0.257 19504 2073 1 30 . 1 1 8 8 SER H H 8 8.678 8.678 8.182 0.496 19504 2074 1 30 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.590 -0.415 19504 2075 1 30 . 1 1 9 9 ASP H H 9 9.066 9.066 8.125 0.941 19504 2076 1 30 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.021 -0.063 19504 2077 1 30 . 1 1 10 10 GLN H H 10 8.689 8.689 8.758 -0.069 19504 2078 1 30 . 1 1 11 11 THR HA H 11 4.045 4.045 4.218 -0.173 19504 2079 1 30 . 1 1 11 11 THR H H 11 8.000 8.000 7.861 0.139 19504 2080 1 30 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.003 -0.171 19504 2081 1 30 . 1 1 12 12 LEU H H 12 8.482 8.482 8.130 0.352 19504 2082 1 30 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.990 0.041 19504 2083 1 30 . 1 1 13 13 GLU H H 13 8.242 8.242 8.180 0.062 19504 2084 1 30 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.373 0.011 19504 2085 1 30 . 1 1 14 14 ASP H H 14 8.128 8.128 8.572 -0.444 19504 2086 1 30 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.038 -0.020 19504 2087 1 30 . 1 1 15 15 LEU H H 15 8.721 8.721 7.449 1.272 19504 2088 1 30 . 1 1 16 16 GLU HA H 16 3.919 3.919 3.975 -0.056 19504 2089 1 30 . 1 1 16 16 GLU H H 16 8.468 8.468 8.156 0.312 19504 2090 1 30 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.226 -0.238 19504 2091 1 30 . 1 1 17 17 LYS H H 17 8.128 8.128 7.661 0.467 19504 2092 1 30 . 1 1 18 18 MET HA H 18 4.115 4.115 4.470 -0.355 19504 2093 1 30 . 1 1 18 18 MET H H 18 8.403 8.403 7.497 0.906 19504 2094 1 30 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.343 -0.560 19504 2095 1 30 . 1 1 19 19 ALA H H 19 8.719 8.719 8.092 0.627 19504 2096 1 30 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.047 0.074 19504 2097 1 30 . 1 1 20 20 ARG H H 20 7.889 7.889 7.779 0.110 19504 2098 1 30 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.069 0.011 19504 2099 1 30 . 1 1 21 21 ARG H H 21 7.968 7.968 8.196 -0.228 19504 2100 1 30 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.283 0.106 19504 2101 1 30 . 1 1 22 22 GLU H H 22 8.035 8.035 8.152 -0.117 19504 2102 1 30 . 1 1 23 23 GLY H H 23 7.912 7.912 7.861 0.051 19504 2103 1 30 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.799 0.041 19504 2104 1 30 . 1 1 24 24 LEU H H 24 8.149 8.149 7.806 0.343 19504 2105 1 30 . 1 1 25 25 SER HA H 25 4.563 4.563 4.755 -0.192 19504 2106 1 30 . 1 1 25 25 SER H H 25 8.182 8.182 8.307 -0.125 19504 2107 1 30 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.945 -0.248 19504 2108 1 30 . 1 1 26 26 LYS H H 26 9.270 9.270 8.841 0.429 19504 2109 1 30 . 1 1 27 27 SER HA H 27 3.972 3.972 4.364 -0.392 19504 2110 1 30 . 1 1 27 27 SER H H 27 8.615 8.615 8.193 0.422 19504 2111 1 30 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.270 -0.101 19504 2112 1 30 . 1 1 28 28 GLU H H 28 7.969 7.969 8.534 -0.565 19504 2113 1 30 . 1 1 29 29 MET HA H 29 4.239 4.239 4.329 -0.090 19504 2114 1 30 . 1 1 29 29 MET H H 29 8.768 8.768 8.590 0.178 19504 2115 1 30 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.754 -0.379 19504 2116 1 30 . 1 1 30 30 ILE H H 30 7.966 7.966 7.653 0.313 19504 2117 1 30 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.429 -0.193 19504 2118 1 30 . 1 1 31 31 ASN H H 31 7.862 7.862 8.375 -0.513 19504 2119 1 30 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.720 -0.012 19504 2120 1 30 . 1 1 32 32 VAL H H 32 8.463 8.463 7.474 0.989 19504 2121 1 30 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.249 -0.434 19504 2122 1 30 . 1 1 33 33 ALA H H 33 8.285 8.285 7.637 0.648 19504 2123 1 30 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.150 -0.198 19504 2124 1 30 . 1 1 34 34 LEU H H 34 8.506 8.506 7.255 1.251 19504 2125 1 30 . 1 1 35 35 GLN HA H 35 3.999 3.999 3.985 0.014 19504 2126 1 30 . 1 1 35 35 GLN H H 35 8.340 8.340 7.235 1.105 19504 2127 1 30 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.403 0.122 19504 2128 1 30 . 1 1 36 36 HIS H H 36 7.859 7.859 6.960 0.898 19504 2129 1 30 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.314 -0.016 19504 2130 1 30 . 1 1 37 37 TYR H H 37 7.655 7.655 8.136 -0.481 19504 2131 1 31 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.759 0.329 19504 2132 1 31 . 1 1 2 2 TRP H H 2 9.010 9.010 8.339 0.671 19504 2133 1 31 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.772 -0.082 19504 2134 1 31 . 1 1 3 3 LEU H H 3 9.506 9.506 8.419 1.087 19504 2135 1 31 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.983 0.822 19504 2136 1 31 . 1 1 4 4 CYS H H 4 8.997 8.997 8.718 0.279 19504 2137 1 31 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.603 0.172 19504 2138 1 31 . 1 1 5 5 ILE H H 5 9.319 9.319 8.433 0.886 19504 2139 1 31 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.945 -0.589 19504 2140 1 31 . 1 1 6 6 TRP H H 6 8.606 8.606 8.455 0.151 19504 2141 1 31 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.479 0.049 19504 2142 1 31 . 1 1 7 7 LEU H H 7 7.784 7.784 7.790 -0.006 19504 2143 1 31 . 1 1 8 8 SER HA H 8 4.275 4.275 3.978 0.297 19504 2144 1 31 . 1 1 8 8 SER H H 8 8.678 8.678 8.263 0.415 19504 2145 1 31 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.512 -0.337 19504 2146 1 31 . 1 1 9 9 ASP H H 9 9.066 9.066 8.407 0.659 19504 2147 1 31 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.302 -0.344 19504 2148 1 31 . 1 1 10 10 GLN H H 10 8.689 8.689 8.126 0.563 19504 2149 1 31 . 1 1 11 11 THR HA H 11 4.045 4.045 4.307 -0.262 19504 2150 1 31 . 1 1 11 11 THR H H 11 8.000 8.000 8.171 -0.171 19504 2151 1 31 . 1 1 12 12 LEU HA H 12 3.832 3.832 3.958 -0.126 19504 2152 1 31 . 1 1 12 12 LEU H H 12 8.482 8.482 7.896 0.586 19504 2153 1 31 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.011 0.020 19504 2154 1 31 . 1 1 13 13 GLU H H 13 8.242 8.242 7.660 0.582 19504 2155 1 31 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.394 -0.010 19504 2156 1 31 . 1 1 14 14 ASP H H 14 8.128 8.128 8.100 0.028 19504 2157 1 31 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.189 -0.171 19504 2158 1 31 . 1 1 15 15 LEU H H 15 8.721 8.721 7.803 0.918 19504 2159 1 31 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.036 -0.117 19504 2160 1 31 . 1 1 16 16 GLU H H 16 8.468 8.468 8.379 0.089 19504 2161 1 31 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.349 -0.361 19504 2162 1 31 . 1 1 17 17 LYS H H 17 8.128 8.128 7.576 0.552 19504 2163 1 31 . 1 1 18 18 MET HA H 18 4.115 4.115 4.475 -0.360 19504 2164 1 31 . 1 1 18 18 MET H H 18 8.403 8.403 7.428 0.975 19504 2165 1 31 . 1 1 19 19 ALA HA H 19 3.783 3.783 3.923 -0.140 19504 2166 1 31 . 1 1 19 19 ALA H H 19 8.719 8.719 8.169 0.550 19504 2167 1 31 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.157 -0.036 19504 2168 1 31 . 1 1 20 20 ARG H H 20 7.889 7.889 8.165 -0.276 19504 2169 1 31 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.122 -0.042 19504 2170 1 31 . 1 1 21 21 ARG H H 21 7.968 7.968 8.560 -0.592 19504 2171 1 31 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.539 -0.150 19504 2172 1 31 . 1 1 22 22 GLU H H 22 8.035 8.035 8.304 -0.269 19504 2173 1 31 . 1 1 23 23 GLY H H 23 7.912 7.912 8.087 -0.175 19504 2174 1 31 . 1 1 24 24 LEU HA H 24 4.840 4.840 3.878 0.962 19504 2175 1 31 . 1 1 24 24 LEU H H 24 8.149 8.149 8.199 -0.050 19504 2176 1 31 . 1 1 25 25 SER HA H 25 4.563 4.563 4.336 0.227 19504 2177 1 31 . 1 1 25 25 SER H H 25 8.182 8.182 8.039 0.143 19504 2178 1 31 . 1 1 26 26 LYS HA H 26 3.697 3.697 4.054 -0.357 19504 2179 1 31 . 1 1 26 26 LYS H H 26 9.270 9.270 8.670 0.600 19504 2180 1 31 . 1 1 27 27 SER HA H 27 3.972 3.972 4.310 -0.338 19504 2181 1 31 . 1 1 27 27 SER H H 27 8.615 8.615 8.557 0.058 19504 2182 1 31 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.122 0.047 19504 2183 1 31 . 1 1 28 28 GLU H H 28 7.969 7.969 8.444 -0.475 19504 2184 1 31 . 1 1 29 29 MET HA H 29 4.239 4.239 4.318 -0.079 19504 2185 1 31 . 1 1 29 29 MET H H 29 8.768 8.768 8.071 0.697 19504 2186 1 31 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.787 -0.412 19504 2187 1 31 . 1 1 30 30 ILE H H 30 7.966 7.966 7.660 0.306 19504 2188 1 31 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.542 -0.306 19504 2189 1 31 . 1 1 31 31 ASN H H 31 7.862 7.862 7.413 0.449 19504 2190 1 31 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.467 0.241 19504 2191 1 31 . 1 1 32 32 VAL H H 32 8.463 8.463 7.627 0.836 19504 2192 1 31 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.418 0.397 19504 2193 1 31 . 1 1 33 33 ALA H H 33 8.285 8.285 7.566 0.719 19504 2194 1 31 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.117 -0.165 19504 2195 1 31 . 1 1 34 34 LEU H H 34 8.506 8.506 7.593 0.913 19504 2196 1 31 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.140 -0.141 19504 2197 1 31 . 1 1 35 35 GLN H H 35 8.340 8.340 7.687 0.653 19504 2198 1 31 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.742 -0.217 19504 2199 1 31 . 1 1 36 36 HIS H H 36 7.859 7.859 8.141 -0.282 19504 2200 1 31 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.362 -0.065 19504 2201 1 31 . 1 1 37 37 TYR H H 37 7.655 7.655 7.733 -0.078 19504 2202 1 32 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.821 0.267 19504 2203 1 32 . 1 1 2 2 TRP H H 2 9.010 9.010 8.293 0.717 19504 2204 1 32 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.705 -0.015 19504 2205 1 32 . 1 1 3 3 LEU H H 3 9.506 9.506 8.554 0.952 19504 2206 1 32 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.908 0.897 19504 2207 1 32 . 1 1 4 4 CYS H H 4 8.997 8.997 8.640 0.356 19504 2208 1 32 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.653 0.122 19504 2209 1 32 . 1 1 5 5 ILE H H 5 9.319 9.319 8.432 0.887 19504 2210 1 32 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.982 -0.626 19504 2211 1 32 . 1 1 6 6 TRP H H 6 8.606 8.606 8.416 0.190 19504 2212 1 32 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.556 -0.028 19504 2213 1 32 . 1 1 7 7 LEU H H 7 7.784 7.784 7.923 -0.139 19504 2214 1 32 . 1 1 8 8 SER HA H 8 4.275 4.275 4.012 0.263 19504 2215 1 32 . 1 1 8 8 SER H H 8 8.678 8.678 8.182 0.496 19504 2216 1 32 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.525 -0.350 19504 2217 1 32 . 1 1 9 9 ASP H H 9 9.066 9.066 8.110 0.956 19504 2218 1 32 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.025 -0.067 19504 2219 1 32 . 1 1 10 10 GLN H H 10 8.689 8.689 8.837 -0.148 19504 2220 1 32 . 1 1 11 11 THR HA H 11 4.045 4.045 4.203 -0.158 19504 2221 1 32 . 1 1 11 11 THR H H 11 8.000 8.000 7.776 0.224 19504 2222 1 32 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.078 -0.246 19504 2223 1 32 . 1 1 12 12 LEU H H 12 8.482 8.482 7.931 0.551 19504 2224 1 32 . 1 1 13 13 GLU HA H 13 4.031 4.031 3.994 0.037 19504 2225 1 32 . 1 1 13 13 GLU H H 13 8.242 8.242 8.272 -0.030 19504 2226 1 32 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.390 -0.006 19504 2227 1 32 . 1 1 14 14 ASP H H 14 8.128 8.128 8.530 -0.402 19504 2228 1 32 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.227 -0.209 19504 2229 1 32 . 1 1 15 15 LEU H H 15 8.721 8.721 7.269 1.452 19504 2230 1 32 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.186 -0.267 19504 2231 1 32 . 1 1 16 16 GLU H H 16 8.468 8.468 7.812 0.656 19504 2232 1 32 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.184 -0.196 19504 2233 1 32 . 1 1 17 17 LYS H H 17 8.128 8.128 8.295 -0.167 19504 2234 1 32 . 1 1 18 18 MET HA H 18 4.115 4.115 4.427 -0.312 19504 2235 1 32 . 1 1 18 18 MET H H 18 8.403 8.403 7.644 0.759 19504 2236 1 32 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.285 -0.502 19504 2237 1 32 . 1 1 19 19 ALA H H 19 8.719 8.719 7.483 1.236 19504 2238 1 32 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.051 0.070 19504 2239 1 32 . 1 1 20 20 ARG H H 20 7.889 7.889 8.040 -0.151 19504 2240 1 32 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.027 0.053 19504 2241 1 32 . 1 1 21 21 ARG H H 21 7.968 7.968 7.727 0.241 19504 2242 1 32 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.244 0.145 19504 2243 1 32 . 1 1 22 22 GLU H H 22 8.035 8.035 7.875 0.160 19504 2244 1 32 . 1 1 23 23 GLY H H 23 7.912 7.912 8.008 -0.096 19504 2245 1 32 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.797 0.043 19504 2246 1 32 . 1 1 24 24 LEU H H 24 8.149 8.149 7.528 0.621 19504 2247 1 32 . 1 1 25 25 SER HA H 25 4.563 4.563 4.688 -0.125 19504 2248 1 32 . 1 1 25 25 SER H H 25 8.182 8.182 8.224 -0.042 19504 2249 1 32 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.973 -0.276 19504 2250 1 32 . 1 1 26 26 LYS H H 26 9.270 9.270 8.766 0.504 19504 2251 1 32 . 1 1 27 27 SER HA H 27 3.972 3.972 4.259 -0.287 19504 2252 1 32 . 1 1 27 27 SER H H 27 8.615 8.615 7.712 0.903 19504 2253 1 32 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.097 0.072 19504 2254 1 32 . 1 1 28 28 GLU H H 28 7.969 7.969 7.969 -0.000 19504 2255 1 32 . 1 1 29 29 MET HA H 29 4.239 4.239 4.364 -0.125 19504 2256 1 32 . 1 1 29 29 MET H H 29 8.768 8.768 8.353 0.415 19504 2257 1 32 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.725 -0.350 19504 2258 1 32 . 1 1 30 30 ILE H H 30 7.966 7.966 7.931 0.035 19504 2259 1 32 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.454 -0.218 19504 2260 1 32 . 1 1 31 31 ASN H H 31 7.862 7.862 8.768 -0.906 19504 2261 1 32 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.780 -0.072 19504 2262 1 32 . 1 1 32 32 VAL H H 32 8.463 8.463 7.461 1.002 19504 2263 1 32 . 1 1 33 33 ALA HA H 33 3.815 3.815 4.091 -0.276 19504 2264 1 32 . 1 1 33 33 ALA H H 33 8.285 8.285 7.875 0.410 19504 2265 1 32 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.130 -0.178 19504 2266 1 32 . 1 1 34 34 LEU H H 34 8.506 8.506 7.683 0.823 19504 2267 1 32 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.045 -0.046 19504 2268 1 32 . 1 1 35 35 GLN H H 35 8.340 8.340 7.911 0.429 19504 2269 1 32 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.537 -0.012 19504 2270 1 32 . 1 1 36 36 HIS H H 36 7.859 7.859 7.629 0.230 19504 2271 1 32 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.116 0.182 19504 2272 1 32 . 1 1 37 37 TYR H H 37 7.655 7.655 8.061 -0.406 19504 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 19504 2 1 1 "Average Difference" HA 37 0.270 0.046 0.269 19504 3 1 1 "Average Difference" C 0 0.000 0.000 0.000 19504 4 1 1 "Average Difference" CA 0 0.000 0.000 0.000 19504 5 1 1 "Average Difference" CB 0 0.000 0.000 0.000 19504 6 1 1 "Average Difference" HN 36 0.536 -0.345 0.416 19504 7 1 2 "Average Difference" N 0 0.000 0.000 0.000 19504 8 1 2 "Average Difference" HA 37 0.285 0.074 0.279 19504 9 1 2 "Average Difference" C 0 0.000 0.000 0.000 19504 10 1 2 "Average Difference" CA 0 0.000 0.000 0.000 19504 11 1 2 "Average Difference" CB 0 0.000 0.000 0.000 19504 12 1 2 "Average Difference" HN 36 0.613 -0.425 0.448 19504 13 1 3 "Average Difference" N 0 0.000 0.000 0.000 19504 14 1 3 "Average Difference" HA 37 0.280 0.071 0.274 19504 15 1 3 "Average Difference" C 0 0.000 0.000 0.000 19504 16 1 3 "Average Difference" CA 0 0.000 0.000 0.000 19504 17 1 3 "Average Difference" CB 0 0.000 0.000 0.000 19504 18 1 3 "Average Difference" HN 36 0.570 -0.402 0.409 19504 19 1 4 "Average Difference" N 0 0.000 0.000 0.000 19504 20 1 4 "Average Difference" HA 37 0.324 0.094 0.315 19504 21 1 4 "Average Difference" C 0 0.000 0.000 0.000 19504 22 1 4 "Average Difference" CA 0 0.000 0.000 0.000 19504 23 1 4 "Average Difference" CB 0 0.000 0.000 0.000 19504 24 1 4 "Average Difference" HN 36 0.588 -0.369 0.464 19504 25 1 5 "Average Difference" N 0 0.000 0.000 0.000 19504 26 1 5 "Average Difference" HA 37 0.322 0.078 0.317 19504 27 1 5 "Average Difference" C 0 0.000 0.000 0.000 19504 28 1 5 "Average Difference" CA 0 0.000 0.000 0.000 19504 29 1 5 "Average Difference" CB 0 0.000 0.000 0.000 19504 30 1 5 "Average Difference" HN 36 0.566 -0.349 0.452 19504 31 1 6 "Average Difference" N 0 0.000 0.000 0.000 19504 32 1 6 "Average Difference" HA 37 0.331 0.097 0.321 19504 33 1 6 "Average Difference" C 0 0.000 0.000 0.000 19504 34 1 6 "Average Difference" CA 0 0.000 0.000 0.000 19504 35 1 6 "Average Difference" CB 0 0.000 0.000 0.000 19504 36 1 6 "Average Difference" HN 36 0.523 -0.326 0.415 19504 37 1 7 "Average Difference" N 0 0.000 0.000 0.000 19504 38 1 7 "Average Difference" HA 37 0.321 0.092 0.312 19504 39 1 7 "Average Difference" C 0 0.000 0.000 0.000 19504 40 1 7 "Average Difference" CA 0 0.000 0.000 0.000 19504 41 1 7 "Average Difference" CB 0 0.000 0.000 0.000 19504 42 1 7 "Average Difference" HN 36 0.598 -0.424 0.427 19504 43 1 8 "Average Difference" N 0 0.000 0.000 0.000 19504 44 1 8 "Average Difference" HA 37 0.316 0.071 0.312 19504 45 1 8 "Average Difference" C 0 0.000 0.000 0.000 19504 46 1 8 "Average Difference" CA 0 0.000 0.000 0.000 19504 47 1 8 "Average Difference" CB 0 0.000 0.000 0.000 19504 48 1 8 "Average Difference" HN 36 0.566 -0.402 0.404 19504 49 1 9 "Average Difference" N 0 0.000 0.000 0.000 19504 50 1 9 "Average Difference" HA 37 0.329 0.072 0.325 19504 51 1 9 "Average Difference" C 0 0.000 0.000 0.000 19504 52 1 9 "Average Difference" CA 0 0.000 0.000 0.000 19504 53 1 9 "Average Difference" CB 0 0.000 0.000 0.000 19504 54 1 9 "Average Difference" HN 36 0.585 -0.353 0.473 19504 55 1 10 "Average Difference" N 0 0.000 0.000 0.000 19504 56 1 10 "Average Difference" HA 37 0.287 0.077 0.281 19504 57 1 10 "Average Difference" C 0 0.000 0.000 0.000 19504 58 1 10 "Average Difference" CA 0 0.000 0.000 0.000 19504 59 1 10 "Average Difference" CB 0 0.000 0.000 0.000 19504 60 1 10 "Average Difference" HN 36 0.591 -0.428 0.414 19504 61 1 11 "Average Difference" N 0 0.000 0.000 0.000 19504 62 1 11 "Average Difference" HA 37 0.344 0.092 0.336 19504 63 1 11 "Average Difference" C 0 0.000 0.000 0.000 19504 64 1 11 "Average Difference" CA 0 0.000 0.000 0.000 19504 65 1 11 "Average Difference" CB 0 0.000 0.000 0.000 19504 66 1 11 "Average Difference" HN 36 0.550 -0.329 0.447 19504 67 1 12 "Average Difference" N 0 0.000 0.000 0.000 19504 68 1 12 "Average Difference" HA 37 0.312 0.077 0.307 19504 69 1 12 "Average Difference" C 0 0.000 0.000 0.000 19504 70 1 12 "Average Difference" CA 0 0.000 0.000 0.000 19504 71 1 12 "Average Difference" CB 0 0.000 0.000 0.000 19504 72 1 12 "Average Difference" HN 36 0.574 -0.369 0.446 19504 73 1 13 "Average Difference" N 0 0.000 0.000 0.000 19504 74 1 13 "Average Difference" HA 37 0.326 0.101 0.314 19504 75 1 13 "Average Difference" C 0 0.000 0.000 0.000 19504 76 1 13 "Average Difference" CA 0 0.000 0.000 0.000 19504 77 1 13 "Average Difference" CB 0 0.000 0.000 0.000 19504 78 1 13 "Average Difference" HN 36 0.516 -0.300 0.426 19504 79 1 14 "Average Difference" N 0 0.000 0.000 0.000 19504 80 1 14 "Average Difference" HA 37 0.278 0.087 0.268 19504 81 1 14 "Average Difference" C 0 0.000 0.000 0.000 19504 82 1 14 "Average Difference" CA 0 0.000 0.000 0.000 19504 83 1 14 "Average Difference" CB 0 0.000 0.000 0.000 19504 84 1 14 "Average Difference" HN 36 0.604 -0.343 0.504 19504 85 1 15 "Average Difference" N 0 0.000 0.000 0.000 19504 86 1 15 "Average Difference" HA 37 0.297 0.059 0.295 19504 87 1 15 "Average Difference" C 0 0.000 0.000 0.000 19504 88 1 15 "Average Difference" CA 0 0.000 0.000 0.000 19504 89 1 15 "Average Difference" CB 0 0.000 0.000 0.000 19504 90 1 15 "Average Difference" HN 36 0.542 -0.366 0.406 19504 91 1 16 "Average Difference" N 0 0.000 0.000 0.000 19504 92 1 16 "Average Difference" HA 37 0.295 0.081 0.287 19504 93 1 16 "Average Difference" C 0 0.000 0.000 0.000 19504 94 1 16 "Average Difference" CA 0 0.000 0.000 0.000 19504 95 1 16 "Average Difference" CB 0 0.000 0.000 0.000 19504 96 1 16 "Average Difference" HN 36 0.592 -0.305 0.515 19504 97 1 17 "Average Difference" N 0 0.000 0.000 0.000 19504 98 1 17 "Average Difference" HA 37 0.289 0.060 0.287 19504 99 1 17 "Average Difference" C 0 0.000 0.000 0.000 19504 100 1 17 "Average Difference" CA 0 0.000 0.000 0.000 19504 101 1 17 "Average Difference" CB 0 0.000 0.000 0.000 19504 102 1 17 "Average Difference" HN 36 0.587 -0.347 0.480 19504 103 1 18 "Average Difference" N 0 0.000 0.000 0.000 19504 104 1 18 "Average Difference" HA 37 0.369 0.084 0.364 19504 105 1 18 "Average Difference" C 0 0.000 0.000 0.000 19504 106 1 18 "Average Difference" CA 0 0.000 0.000 0.000 19504 107 1 18 "Average Difference" CB 0 0.000 0.000 0.000 19504 108 1 18 "Average Difference" HN 36 0.557 -0.355 0.435 19504 109 1 19 "Average Difference" N 0 0.000 0.000 0.000 19504 110 1 19 "Average Difference" HA 37 0.304 0.057 0.302 19504 111 1 19 "Average Difference" C 0 0.000 0.000 0.000 19504 112 1 19 "Average Difference" CA 0 0.000 0.000 0.000 19504 113 1 19 "Average Difference" CB 0 0.000 0.000 0.000 19504 114 1 19 "Average Difference" HN 36 0.512 -0.268 0.443 19504 115 1 20 "Average Difference" N 0 0.000 0.000 0.000 19504 116 1 20 "Average Difference" HA 37 0.313 0.087 0.305 19504 117 1 20 "Average Difference" C 0 0.000 0.000 0.000 19504 118 1 20 "Average Difference" CA 0 0.000 0.000 0.000 19504 119 1 20 "Average Difference" CB 0 0.000 0.000 0.000 19504 120 1 20 "Average Difference" HN 36 0.642 -0.437 0.477 19504 121 1 21 "Average Difference" N 0 0.000 0.000 0.000 19504 122 1 21 "Average Difference" HA 37 0.335 0.087 0.328 19504 123 1 21 "Average Difference" C 0 0.000 0.000 0.000 19504 124 1 21 "Average Difference" CA 0 0.000 0.000 0.000 19504 125 1 21 "Average Difference" CB 0 0.000 0.000 0.000 19504 126 1 21 "Average Difference" HN 36 0.523 -0.265 0.457 19504 127 1 22 "Average Difference" N 0 0.000 0.000 0.000 19504 128 1 22 "Average Difference" HA 37 0.372 0.094 0.365 19504 129 1 22 "Average Difference" C 0 0.000 0.000 0.000 19504 130 1 22 "Average Difference" CA 0 0.000 0.000 0.000 19504 131 1 22 "Average Difference" CB 0 0.000 0.000 0.000 19504 132 1 22 "Average Difference" HN 36 0.571 -0.329 0.474 19504 133 1 23 "Average Difference" N 0 0.000 0.000 0.000 19504 134 1 23 "Average Difference" HA 37 0.257 0.064 0.252 19504 135 1 23 "Average Difference" C 0 0.000 0.000 0.000 19504 136 1 23 "Average Difference" CA 0 0.000 0.000 0.000 19504 137 1 23 "Average Difference" CB 0 0.000 0.000 0.000 19504 138 1 23 "Average Difference" HN 36 0.592 -0.431 0.412 19504 139 1 24 "Average Difference" N 0 0.000 0.000 0.000 19504 140 1 24 "Average Difference" HA 37 0.275 0.063 0.272 19504 141 1 24 "Average Difference" C 0 0.000 0.000 0.000 19504 142 1 24 "Average Difference" CA 0 0.000 0.000 0.000 19504 143 1 24 "Average Difference" CB 0 0.000 0.000 0.000 19504 144 1 24 "Average Difference" HN 36 0.586 -0.390 0.444 19504 145 1 25 "Average Difference" N 0 0.000 0.000 0.000 19504 146 1 25 "Average Difference" HA 37 0.261 0.059 0.258 19504 147 1 25 "Average Difference" C 0 0.000 0.000 0.000 19504 148 1 25 "Average Difference" CA 0 0.000 0.000 0.000 19504 149 1 25 "Average Difference" CB 0 0.000 0.000 0.000 19504 150 1 25 "Average Difference" HN 36 0.533 -0.377 0.382 19504 151 1 26 "Average Difference" N 0 0.000 0.000 0.000 19504 152 1 26 "Average Difference" HA 37 0.327 0.099 0.316 19504 153 1 26 "Average Difference" C 0 0.000 0.000 0.000 19504 154 1 26 "Average Difference" CA 0 0.000 0.000 0.000 19504 155 1 26 "Average Difference" CB 0 0.000 0.000 0.000 19504 156 1 26 "Average Difference" HN 36 0.550 -0.354 0.427 19504 157 1 27 "Average Difference" N 0 0.000 0.000 0.000 19504 158 1 27 "Average Difference" HA 37 0.348 0.079 0.344 19504 159 1 27 "Average Difference" C 0 0.000 0.000 0.000 19504 160 1 27 "Average Difference" CA 0 0.000 0.000 0.000 19504 161 1 27 "Average Difference" CB 0 0.000 0.000 0.000 19504 162 1 27 "Average Difference" HN 36 0.596 -0.389 0.458 19504 163 1 28 "Average Difference" N 0 0.000 0.000 0.000 19504 164 1 28 "Average Difference" HA 37 0.291 0.058 0.289 19504 165 1 28 "Average Difference" C 0 0.000 0.000 0.000 19504 166 1 28 "Average Difference" CA 0 0.000 0.000 0.000 19504 167 1 28 "Average Difference" CB 0 0.000 0.000 0.000 19504 168 1 28 "Average Difference" HN 36 0.630 -0.420 0.476 19504 169 1 29 "Average Difference" N 0 0.000 0.000 0.000 19504 170 1 29 "Average Difference" HA 37 0.279 0.079 0.272 19504 171 1 29 "Average Difference" C 0 0.000 0.000 0.000 19504 172 1 29 "Average Difference" CA 0 0.000 0.000 0.000 19504 173 1 29 "Average Difference" CB 0 0.000 0.000 0.000 19504 174 1 29 "Average Difference" HN 36 0.601 -0.410 0.445 19504 175 1 30 "Average Difference" N 0 0.000 0.000 0.000 19504 176 1 30 "Average Difference" HA 37 0.272 0.071 0.267 19504 177 1 30 "Average Difference" C 0 0.000 0.000 0.000 19504 178 1 30 "Average Difference" CA 0 0.000 0.000 0.000 19504 179 1 30 "Average Difference" CB 0 0.000 0.000 0.000 19504 180 1 30 "Average Difference" HN 36 0.617 -0.357 0.510 19504 181 1 31 "Average Difference" N 0 0.000 0.000 0.000 19504 182 1 31 "Average Difference" HA 37 0.323 0.059 0.322 19504 183 1 31 "Average Difference" C 0 0.000 0.000 0.000 19504 184 1 31 "Average Difference" CA 0 0.000 0.000 0.000 19504 185 1 31 "Average Difference" CB 0 0.000 0.000 0.000 19504 186 1 31 "Average Difference" HN 36 0.554 -0.333 0.449 19504 187 1 32 "Average Difference" N 0 0.000 0.000 0.000 19504 188 1 32 "Average Difference" HA 37 0.274 0.060 0.271 19504 189 1 32 "Average Difference" C 0 0.000 0.000 0.000 19504 190 1 32 "Average Difference" CA 0 0.000 0.000 0.000 19504 191 1 32 "Average Difference" CB 0 0.000 0.000 0.000 19504 192 1 32 "Average Difference" HN 36 0.614 -0.353 0.509 19504 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 19504 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 2 2 TRP HA H 2 5.088 5.088 4.873 0.215 19504 2 1 . 1 1 2 2 TRP H H 2 9.010 9.010 8.338 0.673 19504 3 1 . 1 1 3 3 LEU HA H 3 4.690 4.690 4.725 -0.035 19504 4 1 . 1 1 3 3 LEU H H 3 9.506 9.506 8.458 1.048 19504 5 1 . 1 1 4 4 CYS HA H 4 5.805 5.805 4.984 0.821 19504 6 1 . 1 1 4 4 CYS H H 4 8.997 8.997 8.643 0.354 19504 7 1 . 1 1 5 5 ILE HA H 5 4.775 4.775 4.610 0.165 19504 8 1 . 1 1 5 5 ILE H H 5 9.319 9.319 8.418 0.901 19504 9 1 . 1 1 6 6 TRP HA H 6 4.356 4.356 4.973 -0.617 19504 10 1 . 1 1 6 6 TRP H H 6 8.606 8.606 8.390 0.216 19504 11 1 . 1 1 7 7 LEU HA H 7 4.528 4.528 4.484 0.044 19504 12 1 . 1 1 7 7 LEU H H 7 7.784 7.784 7.877 -0.093 19504 13 1 . 1 1 8 8 SER HA H 8 4.275 4.275 4.068 0.207 19504 14 1 . 1 1 8 8 SER H H 8 8.678 8.678 8.073 0.605 19504 15 1 . 1 1 9 9 ASP HA H 9 4.175 4.175 4.358 -0.183 19504 16 1 . 1 1 9 9 ASP H H 9 9.066 9.066 8.408 0.658 19504 17 1 . 1 1 10 10 GLN HA H 10 3.958 3.958 4.074 -0.116 19504 18 1 . 1 1 10 10 GLN H H 10 8.689 8.689 8.546 0.143 19504 19 1 . 1 1 11 11 THR HA H 11 4.045 4.045 4.293 -0.248 19504 20 1 . 1 1 11 11 THR H H 11 8.000 8.000 7.790 0.210 19504 21 1 . 1 1 12 12 LEU HA H 12 3.832 3.832 4.056 -0.224 19504 22 1 . 1 1 12 12 LEU H H 12 8.482 8.482 7.867 0.615 19504 23 1 . 1 1 13 13 GLU HA H 13 4.031 4.031 4.064 -0.033 19504 24 1 . 1 1 13 13 GLU H H 13 8.242 8.242 8.091 0.151 19504 25 1 . 1 1 14 14 ASP HA H 14 4.384 4.384 4.380 0.004 19504 26 1 . 1 1 14 14 ASP H H 14 8.128 8.128 8.098 0.030 19504 27 1 . 1 1 15 15 LEU HA H 15 4.018 4.018 4.245 -0.227 19504 28 1 . 1 1 15 15 LEU H H 15 8.721 8.721 7.586 1.135 19504 29 1 . 1 1 16 16 GLU HA H 16 3.919 3.919 4.197 -0.278 19504 30 1 . 1 1 16 16 GLU H H 16 8.468 8.468 8.022 0.446 19504 31 1 . 1 1 17 17 LYS HA H 17 3.988 3.988 4.253 -0.265 19504 32 1 . 1 1 17 17 LYS H H 17 8.128 8.128 7.801 0.327 19504 33 1 . 1 1 18 18 MET HA H 18 4.115 4.115 4.461 -0.346 19504 34 1 . 1 1 18 18 MET H H 18 8.403 8.403 7.638 0.765 19504 35 1 . 1 1 19 19 ALA HA H 19 3.783 3.783 4.146 -0.363 19504 36 1 . 1 1 19 19 ALA H H 19 8.719 8.719 7.976 0.743 19504 37 1 . 1 1 20 20 ARG HA H 20 4.121 4.121 4.056 0.065 19504 38 1 . 1 1 20 20 ARG H H 20 7.889 7.889 7.841 0.048 19504 39 1 . 1 1 21 21 ARG HA H 21 4.080 4.080 4.084 -0.004 19504 40 1 . 1 1 21 21 ARG H H 21 7.968 7.968 8.258 -0.290 19504 41 1 . 1 1 22 22 GLU HA H 22 4.389 4.389 4.386 0.003 19504 42 1 . 1 1 22 22 GLU H H 22 8.035 8.035 8.159 -0.124 19504 43 1 . 1 1 23 23 GLY H H 23 7.912 7.912 7.977 -0.065 19504 44 1 . 1 1 24 24 LEU HA H 24 4.840 4.840 4.271 0.569 19504 45 1 . 1 1 24 24 LEU H H 24 8.149 8.149 7.751 0.398 19504 46 1 . 1 1 25 25 SER HA H 25 4.563 4.563 4.568 -0.005 19504 47 1 . 1 1 25 25 SER H H 25 8.182 8.182 8.179 0.003 19504 48 1 . 1 1 26 26 LYS HA H 26 3.697 3.697 3.979 -0.282 19504 49 1 . 1 1 26 26 LYS H H 26 9.270 9.270 8.840 0.430 19504 50 1 . 1 1 27 27 SER HA H 27 3.972 3.972 4.352 -0.380 19504 51 1 . 1 1 27 27 SER H H 27 8.615 8.615 8.074 0.541 19504 52 1 . 1 1 28 28 GLU HA H 28 4.169 4.169 4.081 0.088 19504 53 1 . 1 1 28 28 GLU H H 28 7.969 7.969 8.094 -0.125 19504 54 1 . 1 1 29 29 MET HA H 29 4.239 4.239 4.355 -0.116 19504 55 1 . 1 1 29 29 MET H H 29 8.768 8.768 8.482 0.286 19504 56 1 . 1 1 30 30 ILE HA H 30 3.375 3.375 3.783 -0.408 19504 57 1 . 1 1 30 30 ILE H H 30 7.966 7.966 7.530 0.436 19504 58 1 . 1 1 31 31 ASN HA H 31 4.236 4.236 4.493 -0.257 19504 59 1 . 1 1 31 31 ASN H H 31 7.862 7.862 8.176 -0.314 19504 60 1 . 1 1 32 32 VAL HA H 32 3.708 3.708 3.698 0.010 19504 61 1 . 1 1 32 32 VAL H H 32 8.463 8.463 7.692 0.771 19504 62 1 . 1 1 33 33 ALA HA H 33 3.815 3.815 3.954 -0.139 19504 63 1 . 1 1 33 33 ALA H H 33 8.285 8.285 7.748 0.537 19504 64 1 . 1 1 34 34 LEU HA H 34 3.952 3.952 4.195 -0.243 19504 65 1 . 1 1 34 34 LEU H H 34 8.506 8.506 7.538 0.968 19504 66 1 . 1 1 35 35 GLN HA H 35 3.999 3.999 4.076 -0.077 19504 67 1 . 1 1 35 35 GLN H H 35 8.340 8.340 7.736 0.604 19504 68 1 . 1 1 36 36 HIS HA H 36 4.525 4.525 4.677 -0.152 19504 69 1 . 1 1 36 36 HIS H H 36 7.859 7.859 7.744 0.115 19504 70 1 . 1 1 37 37 TYR HA H 37 4.298 4.298 4.367 -0.069 19504 71 1 . 1 1 37 37 TYR H H 37 7.655 7.655 7.694 -0.039 19504 stop_ save_