data_25324 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 25324 _Entry.PDB_ID 2MWH 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 25324 _Entity_delta_chem_shifts.ID 1 loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Conformer_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 1 . 1 1 3 3 LEU N N 3 123.202 123.202 121.711 1.491 25324 2 1 1 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.199 -0.042 25324 3 1 1 . 1 1 3 3 LEU C C 3 175.786 175.786 175.865 -0.079 25324 4 1 1 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.835 0.449 25324 5 1 1 . 1 1 3 3 LEU CB C 3 43.330 43.330 42.992 0.338 25324 6 1 1 . 1 1 3 3 LEU H H 3 8.711 8.711 8.569 0.142 25324 7 1 1 . 1 1 4 4 TYR N N 4 120.906 120.906 126.762 -5.856 25324 8 1 1 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.045 -0.021 25324 9 1 1 . 1 1 4 4 TYR C C 4 175.953 175.953 175.133 0.820 25324 10 1 1 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.829 -0.452 25324 11 1 1 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.612 -0.957 25324 12 1 1 . 1 1 4 4 TYR H H 4 9.142 9.142 9.595 -0.453 25324 13 1 1 . 1 1 5 5 ASN N N 5 120.496 120.496 120.014 0.482 25324 14 1 1 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.959 0.157 25324 15 1 1 . 1 1 5 5 ASN C C 5 174.953 174.953 173.798 1.155 25324 16 1 1 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.157 -0.210 25324 17 1 1 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.628 -1.737 25324 18 1 1 . 1 1 5 5 ASN H H 5 8.787 8.787 9.160 -0.373 25324 19 1 1 . 1 1 6 6 VAL N N 6 127.428 127.428 123.386 4.042 25324 20 1 1 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.326 0.036 25324 21 1 1 . 1 1 6 6 VAL C C 6 174.955 174.955 174.456 0.499 25324 22 1 1 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.631 0.802 25324 23 1 1 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.566 0.764 25324 24 1 1 . 1 1 6 6 VAL H H 6 8.806 8.806 8.564 0.242 25324 25 1 1 . 1 1 7 7 GLU N N 7 124.355 124.355 126.647 -2.292 25324 26 1 1 . 1 1 7 7 GLU HA H 7 4.982 4.982 5.007 -0.025 25324 27 1 1 . 1 1 7 7 GLU C C 7 174.551 174.551 174.905 -0.354 25324 28 1 1 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.657 -0.868 25324 29 1 1 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.093 1.474 25324 30 1 1 . 1 1 7 7 GLU H H 7 8.800 8.800 8.875 -0.075 25324 31 1 1 . 1 1 8 8 ASN N N 8 116.231 116.231 121.321 -5.090 25324 32 1 1 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.917 0.124 25324 33 1 1 . 1 1 8 8 ASN C C 8 172.709 172.709 173.799 -1.090 25324 34 1 1 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.593 -0.976 25324 35 1 1 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.331 2.254 25324 36 1 1 . 1 1 8 8 ASN H H 8 9.320 9.320 9.335 -0.015 25324 37 1 1 . 1 1 9 9 GLN N N 9 120.762 120.762 121.875 -1.113 25324 38 1 1 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.554 -0.380 25324 39 1 1 . 1 1 9 9 GLN C C 9 173.454 173.454 174.185 -0.731 25324 40 1 1 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.372 -0.412 25324 41 1 1 . 1 1 9 9 GLN CB C 9 30.691 30.691 30.880 -0.189 25324 42 1 1 . 1 1 9 9 GLN H H 9 6.887 6.887 8.659 -1.772 25324 43 1 1 . 1 1 10 10 TRP N N 10 127.775 127.775 124.662 3.113 25324 44 1 1 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.065 -0.077 25324 45 1 1 . 1 1 10 10 TRP C C 10 175.281 175.281 175.450 -0.169 25324 46 1 1 . 1 1 10 10 TRP CA C 10 56.293 56.293 57.101 -0.808 25324 47 1 1 . 1 1 10 10 TRP CB C 10 29.742 29.742 29.963 -0.221 25324 48 1 1 . 1 1 10 10 TRP H H 10 8.518 8.518 8.170 0.348 25324 49 1 1 . 1 1 11 11 GLY N N 11 107.838 107.838 108.018 -0.180 25324 50 1 1 . 1 1 11 11 GLY C C 11 174.733 174.733 174.075 0.658 25324 51 1 1 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.422 0.414 25324 52 1 1 . 1 1 11 11 GLY H H 11 8.461 8.461 8.081 0.380 25324 53 1 1 . 1 1 12 12 GLY N N 12 109.696 109.696 107.746 1.950 25324 54 1 1 . 1 1 12 12 GLY C C 12 174.133 174.133 175.049 -0.916 25324 55 1 1 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.195 -0.406 25324 56 1 1 . 1 1 12 12 GLY H H 12 8.138 8.138 7.164 0.974 25324 57 1 1 . 1 1 13 13 SER N N 13 111.308 111.308 115.701 -4.393 25324 58 1 1 . 1 1 13 13 SER HA H 13 4.092 4.092 4.052 0.040 25324 59 1 1 . 1 1 13 13 SER C C 13 175.622 175.622 175.393 0.229 25324 60 1 1 . 1 1 13 13 SER CA C 13 60.494 60.494 60.562 -0.068 25324 61 1 1 . 1 1 13 13 SER CB C 13 63.028 63.028 63.255 -0.227 25324 62 1 1 . 1 1 13 13 SER H H 13 8.215 8.215 8.632 -0.417 25324 63 1 1 . 1 1 14 14 SER N N 14 115.290 115.290 114.770 0.520 25324 64 1 1 . 1 1 14 14 SER HA H 14 4.566 4.566 4.374 0.192 25324 65 1 1 . 1 1 14 14 SER C C 14 173.532 173.532 173.681 -0.149 25324 66 1 1 . 1 1 14 14 SER CA C 14 57.317 57.317 58.967 -1.650 25324 67 1 1 . 1 1 14 14 SER CB C 14 63.230 63.230 63.147 0.083 25324 68 1 1 . 1 1 14 14 SER H H 14 8.213 8.213 8.146 0.067 25324 69 1 1 . 1 1 15 15 ALA N N 15 126.470 126.470 125.110 1.360 25324 70 1 1 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.579 -0.176 25324 71 1 1 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.266 1.198 25324 72 1 1 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.950 -0.721 25324 73 1 1 . 1 1 15 15 ALA H H 15 7.308 7.308 7.413 -0.105 25324 74 1 1 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.308 0.101 25324 75 1 1 . 1 1 16 16 PRO C C 16 175.627 175.627 175.511 0.116 25324 76 1 1 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.080 0.312 25324 77 1 1 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.773 -0.636 25324 78 1 1 . 1 1 17 17 TRP N N 17 120.228 120.228 116.966 3.262 25324 79 1 1 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.671 -0.353 25324 80 1 1 . 1 1 17 17 TRP C C 17 175.951 175.951 176.230 -0.279 25324 81 1 1 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.873 0.042 25324 82 1 1 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.950 -1.541 25324 83 1 1 . 1 1 17 17 TRP H H 17 8.380 8.380 8.102 0.278 25324 84 1 1 . 1 1 18 18 ASN N N 18 120.663 120.663 122.289 -1.626 25324 85 1 1 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.039 0.047 25324 86 1 1 . 1 1 18 18 ASN C C 18 174.793 174.793 174.193 0.600 25324 87 1 1 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.106 -0.505 25324 88 1 1 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.216 1.432 25324 89 1 1 . 1 1 18 18 ASN H H 18 9.094 9.094 9.088 0.006 25324 90 1 1 . 1 1 19 19 GLU N N 19 122.202 122.202 125.275 -3.073 25324 91 1 1 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.792 -0.653 25324 92 1 1 . 1 1 19 19 GLU C C 19 176.869 176.869 177.025 -0.156 25324 93 1 1 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.666 1.934 25324 94 1 1 . 1 1 19 19 GLU CB C 19 29.382 29.382 30.389 -1.007 25324 95 1 1 . 1 1 19 19 GLU H H 19 9.013 9.013 9.058 -0.045 25324 96 1 1 . 1 1 20 20 GLY N N 20 112.893 112.893 114.372 -1.479 25324 97 1 1 . 1 1 20 20 GLY C C 20 174.878 174.878 173.025 1.853 25324 98 1 1 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.884 0.111 25324 99 1 1 . 1 1 20 20 GLY H H 20 8.926 8.926 8.485 0.441 25324 100 1 1 . 1 1 21 21 GLY N N 21 110.354 110.354 107.168 3.186 25324 101 1 1 . 1 1 21 21 GLY C C 21 171.623 171.623 171.758 -0.135 25324 102 1 1 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.032 -0.634 25324 103 1 1 . 1 1 21 21 GLY H H 21 8.258 8.258 7.529 0.729 25324 104 1 1 . 1 1 22 22 GLN N N 22 117.541 117.541 119.624 -2.083 25324 105 1 1 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.191 0.486 25324 106 1 1 . 1 1 22 22 GLN C C 22 175.957 175.957 175.103 0.854 25324 107 1 1 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.798 0.146 25324 108 1 1 . 1 1 22 22 GLN CB C 22 31.085 31.085 33.245 -2.160 25324 109 1 1 . 1 1 22 22 GLN H H 22 8.564 8.564 8.556 0.008 25324 110 1 1 . 1 1 23 23 TRP N N 23 127.208 127.208 121.144 6.064 25324 111 1 1 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.054 0.145 25324 112 1 1 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.650 -0.119 25324 113 1 1 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.751 -1.068 25324 114 1 1 . 1 1 23 23 TRP H H 23 9.347 9.347 9.220 0.127 25324 115 1 1 . 1 1 24 24 GLU N N 24 123.504 123.504 121.151 2.353 25324 116 1 1 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.538 -0.030 25324 117 1 1 . 1 1 24 24 GLU C C 24 174.222 174.222 175.393 -1.171 25324 118 1 1 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.251 0.340 25324 119 1 1 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.846 -2.231 25324 120 1 1 . 1 1 24 24 GLU H H 24 9.296 9.296 8.664 0.632 25324 121 1 1 . 1 1 25 25 ILE N N 25 123.447 123.447 126.468 -3.021 25324 122 1 1 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.561 -0.125 25324 123 1 1 . 1 1 25 25 ILE C C 25 175.790 175.790 175.172 0.618 25324 124 1 1 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.982 -0.355 25324 125 1 1 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.924 0.028 25324 126 1 1 . 1 1 25 25 ILE H H 25 8.635 8.635 8.891 -0.256 25324 127 1 1 . 1 1 26 26 GLY N N 26 111.544 111.544 111.976 -0.432 25324 128 1 1 . 1 1 26 26 GLY C C 26 172.122 172.122 175.392 -3.270 25324 129 1 1 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.782 -0.705 25324 130 1 1 . 1 1 26 26 GLY H H 26 3.381 3.381 7.084 -3.703 25324 131 1 1 . 1 1 27 27 SER N N 27 112.279 112.279 115.088 -2.809 25324 132 1 1 . 1 1 27 27 SER HA H 27 4.876 4.876 4.293 0.583 25324 133 1 1 . 1 1 27 27 SER C C 27 174.113 174.113 175.190 -1.077 25324 134 1 1 . 1 1 27 27 SER CA C 27 56.954 56.954 59.004 -2.050 25324 135 1 1 . 1 1 27 27 SER CB C 27 64.554 64.554 62.904 1.650 25324 136 1 1 . 1 1 27 27 SER H H 27 8.212 8.212 8.169 0.043 25324 137 1 1 . 1 1 28 28 ARG N N 28 120.872 120.872 121.693 -0.821 25324 138 1 1 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.773 -0.010 25324 139 1 1 . 1 1 28 28 ARG C C 28 176.119 176.119 176.090 0.029 25324 140 1 1 . 1 1 28 28 ARG CA C 28 55.117 55.117 56.122 -1.005 25324 141 1 1 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.441 1.389 25324 142 1 1 . 1 1 28 28 ARG H H 28 7.849 7.849 8.327 -0.478 25324 143 1 1 . 1 1 29 29 SER N N 29 118.985 118.985 114.486 4.499 25324 144 1 1 . 1 1 29 29 SER HA H 29 4.192 4.192 4.168 0.024 25324 145 1 1 . 1 1 29 29 SER C C 29 174.622 174.622 174.650 -0.028 25324 146 1 1 . 1 1 29 29 SER CA C 29 60.072 60.072 61.079 -1.007 25324 147 1 1 . 1 1 29 29 SER CB C 29 62.876 62.876 61.565 1.312 25324 148 1 1 . 1 1 29 29 SER H H 29 8.892 8.892 8.006 0.886 25324 149 1 1 . 1 1 30 30 ASP N N 30 117.632 117.632 122.676 -5.044 25324 150 1 1 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.734 -0.116 25324 151 1 1 . 1 1 30 30 ASP C C 30 175.101 175.101 175.468 -0.367 25324 152 1 1 . 1 1 30 30 ASP CA C 30 53.052 53.052 54.990 -1.938 25324 153 1 1 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.611 -1.088 25324 154 1 1 . 1 1 30 30 ASP H H 30 8.441 8.441 8.281 0.160 25324 155 1 1 . 1 1 31 31 GLN N N 31 118.273 118.273 118.059 0.214 25324 156 1 1 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.585 -0.100 25324 157 1 1 . 1 1 31 31 GLN C C 31 173.453 173.453 174.339 -0.886 25324 158 1 1 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.620 0.248 25324 159 1 1 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.117 3.132 25324 160 1 1 . 1 1 31 31 GLN H H 31 7.029 7.029 7.974 -0.945 25324 161 1 1 . 1 1 32 32 ASN N N 32 120.865 120.865 121.497 -0.632 25324 162 1 1 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.935 0.185 25324 163 1 1 . 1 1 32 32 ASN C C 32 175.198 175.198 174.137 1.061 25324 164 1 1 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.778 -0.909 25324 165 1 1 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.192 -0.562 25324 166 1 1 . 1 1 32 32 ASN H H 32 8.713 8.713 8.826 -0.113 25324 167 1 1 . 1 1 33 33 VAL N N 33 122.111 122.111 122.440 -0.329 25324 168 1 1 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.193 -0.488 25324 169 1 1 . 1 1 33 33 VAL C C 33 174.950 174.950 176.010 -1.060 25324 170 1 1 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.215 1.631 25324 171 1 1 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.806 0.544 25324 172 1 1 . 1 1 33 33 VAL H H 33 8.542 8.542 8.868 -0.326 25324 173 1 1 . 1 1 34 34 VAL N N 34 113.282 113.282 118.667 -5.385 25324 174 1 1 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.465 0.180 25324 175 1 1 . 1 1 34 34 VAL C C 34 175.574 175.574 174.696 0.878 25324 176 1 1 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.718 -1.744 25324 177 1 1 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.142 -0.113 25324 178 1 1 . 1 1 34 34 VAL H H 34 8.744 8.744 8.817 -0.073 25324 179 1 1 . 1 1 35 35 ALA N N 35 122.102 122.102 121.400 0.702 25324 180 1 1 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.149 -0.346 25324 181 1 1 . 1 1 35 35 ALA C C 35 175.947 175.947 174.973 0.974 25324 182 1 1 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.027 2.223 25324 183 1 1 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.439 -0.811 25324 184 1 1 . 1 1 35 35 ALA H H 35 7.677 7.677 7.814 -0.137 25324 185 1 1 . 1 1 36 36 ILE N N 36 118.005 118.005 121.526 -3.521 25324 186 1 1 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.184 -0.156 25324 187 1 1 . 1 1 36 36 ILE C C 36 173.116 173.116 173.674 -0.558 25324 188 1 1 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.192 0.990 25324 189 1 1 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.388 1.097 25324 190 1 1 . 1 1 36 36 ILE H H 36 8.126 8.126 8.903 -0.777 25324 191 1 1 . 1 1 37 37 ASN N N 37 125.632 125.632 126.464 -0.832 25324 192 1 1 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.718 -0.037 25324 193 1 1 . 1 1 37 37 ASN C C 37 174.854 174.854 173.955 0.899 25324 194 1 1 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.423 0.106 25324 195 1 1 . 1 1 37 37 ASN CB C 37 38.853 38.853 40.812 -1.958 25324 196 1 1 . 1 1 37 37 ASN H H 37 8.577 8.577 8.891 -0.314 25324 197 1 1 . 1 1 38 38 VAL N N 38 114.223 114.223 116.959 -2.736 25324 198 1 1 . 1 1 38 38 VAL HA H 38 5.203 5.203 5.032 0.171 25324 199 1 1 . 1 1 38 38 VAL C C 38 174.854 174.854 173.450 1.404 25324 200 1 1 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.534 -1.554 25324 201 1 1 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.886 0.158 25324 202 1 1 . 1 1 38 38 VAL H H 38 8.874 8.874 8.673 0.201 25324 203 1 1 . 1 1 39 39 GLU N N 39 118.277 118.277 121.482 -3.205 25324 204 1 1 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.243 -0.161 25324 205 1 1 . 1 1 39 39 GLU C C 39 174.548 174.548 174.924 -0.376 25324 206 1 1 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.188 0.805 25324 207 1 1 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.625 -1.047 25324 208 1 1 . 1 1 39 39 GLU H H 39 8.761 8.761 9.065 -0.304 25324 209 1 1 . 1 1 40 40 SER N N 40 114.960 114.960 119.885 -4.925 25324 210 1 1 . 1 1 40 40 SER HA H 40 5.265 5.265 5.199 0.066 25324 211 1 1 . 1 1 40 40 SER C C 40 175.783 175.783 175.669 0.114 25324 212 1 1 . 1 1 40 40 SER CA C 40 55.880 55.880 57.598 -1.718 25324 213 1 1 . 1 1 40 40 SER CB C 40 65.911 65.911 63.541 2.370 25324 214 1 1 . 1 1 40 40 SER H H 40 8.500 8.500 8.397 0.103 25324 215 1 1 . 1 1 41 41 GLY N N 41 117.567 117.567 114.076 3.491 25324 216 1 1 . 1 1 41 41 GLY C C 41 174.119 174.119 174.316 -0.197 25324 217 1 1 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.833 -1.145 25324 218 1 1 . 1 1 41 41 GLY H H 41 9.533 9.533 9.012 0.521 25324 219 1 1 . 1 1 42 42 ASP N N 42 122.141 122.141 120.805 1.336 25324 220 1 1 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.888 -0.088 25324 221 1 1 . 1 1 42 42 ASP C C 42 176.121 176.121 176.807 -0.686 25324 222 1 1 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.388 -1.242 25324 223 1 1 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.309 -2.955 25324 224 1 1 . 1 1 42 42 ASP H H 42 8.644 8.644 7.822 0.822 25324 225 1 1 . 1 1 43 43 ASP N N 43 116.025 116.025 120.706 -4.681 25324 226 1 1 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.524 -0.295 25324 227 1 1 . 1 1 43 43 ASP C C 43 176.018 176.018 176.415 -0.397 25324 228 1 1 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.632 0.617 25324 229 1 1 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.174 -0.615 25324 230 1 1 . 1 1 43 43 ASP H H 43 9.111 9.111 8.752 0.359 25324 231 1 1 . 1 1 44 44 GLY N N 44 104.263 104.263 105.997 -1.734 25324 232 1 1 . 1 1 44 44 GLY C C 44 173.922 173.922 174.947 -1.025 25324 233 1 1 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.442 -0.141 25324 234 1 1 . 1 1 44 44 GLY H H 44 9.063 9.063 7.993 1.070 25324 235 1 1 . 1 1 45 45 GLN N N 45 121.691 121.691 117.826 3.865 25324 236 1 1 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.271 -0.185 25324 237 1 1 . 1 1 45 45 GLN C C 45 176.284 176.284 175.739 0.545 25324 238 1 1 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.548 0.570 25324 239 1 1 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.148 -1.474 25324 240 1 1 . 1 1 45 45 GLN H H 45 7.356 7.356 8.165 -0.809 25324 241 1 1 . 1 1 46 46 THR N N 46 111.843 111.843 113.765 -1.922 25324 242 1 1 . 1 1 46 46 THR HA H 46 5.355 5.355 5.368 -0.013 25324 243 1 1 . 1 1 46 46 THR C C 46 174.451 174.451 172.720 1.731 25324 244 1 1 . 1 1 46 46 THR CA C 46 59.644 59.644 60.599 -0.955 25324 245 1 1 . 1 1 46 46 THR CB C 46 72.714 72.714 69.306 3.408 25324 246 1 1 . 1 1 46 46 THR H H 46 10.123 10.123 7.782 2.341 25324 247 1 1 . 1 1 47 47 LEU N N 47 119.302 119.302 129.756 -10.454 25324 248 1 1 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.819 -0.012 25324 249 1 1 . 1 1 47 47 LEU C C 47 175.487 175.487 175.330 0.157 25324 250 1 1 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.771 -0.701 25324 251 1 1 . 1 1 47 47 LEU CB C 47 48.003 48.003 42.812 5.191 25324 252 1 1 . 1 1 47 47 LEU H H 47 8.364 8.364 8.795 -0.431 25324 253 1 1 . 1 1 48 48 ASN N N 48 116.844 116.844 119.206 -2.362 25324 254 1 1 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.059 -0.330 25324 255 1 1 . 1 1 48 48 ASN C C 48 174.460 174.460 175.012 -0.552 25324 256 1 1 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.096 1.643 25324 257 1 1 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.291 1.122 25324 258 1 1 . 1 1 48 48 ASN H H 48 8.748 8.748 8.855 -0.107 25324 259 1 1 . 1 1 49 49 GLY N N 49 109.417 109.417 106.856 2.561 25324 260 1 1 . 1 1 49 49 GLY C C 49 172.126 172.126 172.430 -0.304 25324 261 1 1 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.180 0.311 25324 262 1 1 . 1 1 49 49 GLY H H 49 8.744 8.744 8.872 -0.128 25324 263 1 1 . 1 1 50 50 THR N N 50 119.162 119.162 118.200 0.962 25324 264 1 1 . 1 1 50 50 THR HA H 50 5.556 5.556 5.351 0.205 25324 265 1 1 . 1 1 50 50 THR C C 50 171.790 171.790 172.682 -0.892 25324 266 1 1 . 1 1 50 50 THR CA C 50 59.371 59.371 61.794 -2.423 25324 267 1 1 . 1 1 50 50 THR CB C 50 72.799 72.799 71.735 1.064 25324 268 1 1 . 1 1 50 50 THR H H 50 8.799 8.799 8.836 -0.037 25324 269 1 1 . 1 1 51 51 MET N N 51 115.232 115.232 126.038 -10.806 25324 270 1 1 . 1 1 51 51 MET HA H 51 4.886 4.886 4.988 -0.102 25324 271 1 1 . 1 1 51 51 MET C C 51 172.708 172.708 173.617 -0.909 25324 272 1 1 . 1 1 51 51 MET CA C 51 54.722 54.722 53.579 1.143 25324 273 1 1 . 1 1 51 51 MET CB C 51 34.557 34.557 37.402 -2.845 25324 274 1 1 . 1 1 51 51 MET H H 51 9.062 9.062 9.348 -0.286 25324 275 1 1 . 1 1 52 52 THR N N 52 113.697 113.697 122.082 -8.385 25324 276 1 1 . 1 1 52 52 THR HA H 52 4.682 4.682 4.812 -0.130 25324 277 1 1 . 1 1 52 52 THR C C 52 173.952 173.952 173.601 0.351 25324 278 1 1 . 1 1 52 52 THR CA C 52 61.395 61.395 61.553 -0.158 25324 279 1 1 . 1 1 52 52 THR CB C 52 71.734 71.734 70.939 0.795 25324 280 1 1 . 1 1 52 52 THR H H 52 8.685 8.685 8.831 -0.146 25324 281 1 1 . 1 1 53 53 TYR N N 53 129.086 129.086 126.276 2.810 25324 282 1 1 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.854 -0.054 25324 283 1 1 . 1 1 53 53 TYR C C 53 175.214 175.214 176.321 -1.107 25324 284 1 1 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.358 0.523 25324 285 1 1 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.951 0.561 25324 286 1 1 . 1 1 53 53 TYR H H 53 10.112 10.112 8.674 1.438 25324 287 1 1 . 1 1 54 54 ALA N N 54 119.947 119.947 123.883 -3.936 25324 288 1 1 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.347 -0.345 25324 289 1 1 . 1 1 54 54 ALA C C 54 178.285 178.285 177.928 0.357 25324 290 1 1 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.670 0.301 25324 291 1 1 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.725 -0.008 25324 292 1 1 . 1 1 54 54 ALA H H 54 8.704 8.704 8.663 0.041 25324 293 1 1 . 1 1 55 55 GLY N N 55 110.940 110.940 111.274 -0.334 25324 294 1 1 . 1 1 55 55 GLY C C 55 173.903 173.903 174.447 -0.544 25324 295 1 1 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.740 -0.724 25324 296 1 1 . 1 1 55 55 GLY H H 55 8.745 8.745 8.768 -0.023 25324 297 1 1 . 1 1 56 56 GLU N N 56 120.073 120.073 120.259 -0.186 25324 298 1 1 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.749 -0.040 25324 299 1 1 . 1 1 56 56 GLU C C 56 175.906 175.906 176.254 -0.348 25324 300 1 1 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.959 -0.536 25324 301 1 1 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.288 0.536 25324 302 1 1 . 1 1 56 56 GLU H H 56 8.039 8.039 7.841 0.198 25324 303 1 1 . 1 1 57 57 GLY N N 57 105.298 105.298 107.822 -2.524 25324 304 1 1 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.396 0.406 25324 305 1 1 . 1 1 57 57 GLY H H 57 7.937 7.937 8.293 -0.356 25324 306 1 1 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.582 0.352 25324 307 1 1 . 1 1 58 58 PRO C C 58 177.785 177.785 176.320 1.465 25324 308 1 1 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.175 -0.043 25324 309 1 1 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.223 -0.383 25324 310 1 1 . 1 1 59 59 ILE N N 59 117.386 117.386 117.262 0.124 25324 311 1 1 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.656 0.332 25324 312 1 1 . 1 1 59 59 ILE C C 59 175.688 175.688 174.939 0.749 25324 313 1 1 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.191 0.352 25324 314 1 1 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.159 1.129 25324 315 1 1 . 1 1 59 59 ILE H H 59 9.600 9.600 8.925 0.675 25324 316 1 1 . 1 1 60 60 GLY N N 60 107.164 107.164 107.270 -0.106 25324 317 1 1 . 1 1 60 60 GLY C C 60 173.787 173.787 172.490 1.297 25324 318 1 1 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.428 1.807 25324 319 1 1 . 1 1 60 60 GLY H H 60 8.957 8.957 8.396 0.561 25324 320 1 1 . 1 1 61 61 PHE N N 61 124.597 124.597 126.185 -1.588 25324 321 1 1 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.436 -0.212 25324 322 1 1 . 1 1 61 61 PHE C C 61 173.126 173.126 173.280 -0.154 25324 323 1 1 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.674 0.187 25324 324 1 1 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.385 -0.168 25324 325 1 1 . 1 1 61 61 PHE H H 61 8.788 8.788 8.993 -0.205 25324 326 1 1 . 1 1 62 62 ARG N N 62 129.706 129.706 127.373 2.333 25324 327 1 1 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.412 -0.280 25324 328 1 1 . 1 1 62 62 ARG C C 62 172.456 172.456 172.911 -0.455 25324 329 1 1 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.120 0.834 25324 330 1 1 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.472 -1.602 25324 331 1 1 . 1 1 62 62 ARG H H 62 8.405 8.405 8.523 -0.118 25324 332 1 1 . 1 1 63 63 ALA N N 63 122.744 122.744 128.895 -6.151 25324 333 1 1 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.332 0.013 25324 334 1 1 . 1 1 63 63 ALA C C 63 176.120 176.120 175.564 0.556 25324 335 1 1 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.102 -0.183 25324 336 1 1 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.852 1.921 25324 337 1 1 . 1 1 63 63 ALA H H 63 8.628 8.628 8.916 -0.288 25324 338 1 1 . 1 1 64 64 THR N N 64 116.855 116.855 119.252 -2.397 25324 339 1 1 . 1 1 64 64 THR HA H 64 4.848 4.848 5.172 -0.324 25324 340 1 1 . 1 1 64 64 THR C C 64 172.957 172.957 173.849 -0.892 25324 341 1 1 . 1 1 64 64 THR CA C 64 61.211 61.211 61.545 -0.334 25324 342 1 1 . 1 1 64 64 THR CB C 64 71.064 71.064 70.705 0.359 25324 343 1 1 . 1 1 64 64 THR H H 64 8.315 8.315 8.725 -0.410 25324 344 1 1 . 1 1 65 65 LEU N N 65 129.360 129.360 129.391 -0.031 25324 345 1 1 . 1 1 65 65 LEU HA H 65 3.362 3.362 4.057 -0.695 25324 346 1 1 . 1 1 65 65 LEU C C 65 176.459 176.459 176.288 0.171 25324 347 1 1 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.766 0.921 25324 348 1 1 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.353 -0.642 25324 349 1 1 . 1 1 65 65 LEU H H 65 8.877 8.877 9.020 -0.143 25324 350 1 1 . 1 1 66 66 LEU N N 66 128.683 128.683 128.001 0.682 25324 351 1 1 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.252 0.124 25324 352 1 1 . 1 1 66 66 LEU C C 66 177.621 177.621 177.371 0.250 25324 353 1 1 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.810 -1.110 25324 354 1 1 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.171 0.131 25324 355 1 1 . 1 1 66 66 LEU H H 66 9.320 9.320 9.214 0.106 25324 356 1 1 . 1 1 67 67 GLY N N 67 105.361 105.361 105.609 -0.248 25324 357 1 1 . 1 1 67 67 GLY C C 67 173.618 173.618 174.057 -0.439 25324 358 1 1 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.830 -1.463 25324 359 1 1 . 1 1 67 67 GLY H H 67 6.639 6.639 8.211 -1.572 25324 360 1 1 . 1 1 68 68 ASN N N 68 121.848 121.848 117.881 3.967 25324 361 1 1 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.825 -0.494 25324 362 1 1 . 1 1 68 68 ASN C C 68 174.316 174.316 175.067 -0.751 25324 363 1 1 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.668 2.884 25324 364 1 1 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.879 -1.714 25324 365 1 1 . 1 1 68 68 ASN H H 68 9.236 9.236 7.771 1.465 25324 366 1 1 . 1 1 69 69 ASN N N 69 109.509 109.509 113.898 -4.389 25324 367 1 1 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.119 -0.039 25324 368 1 1 . 1 1 69 69 ASN C C 69 171.456 171.456 173.515 -2.059 25324 369 1 1 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.715 1.035 25324 370 1 1 . 1 1 69 69 ASN CB C 69 37.306 37.306 36.643 0.663 25324 371 1 1 . 1 1 69 69 ASN H H 69 8.651 8.651 8.471 0.180 25324 372 1 1 . 1 1 70 70 SER N N 70 113.479 113.479 115.257 -1.778 25324 373 1 1 . 1 1 70 70 SER HA H 70 5.437 5.437 4.943 0.494 25324 374 1 1 . 1 1 70 70 SER C C 70 173.750 173.750 172.719 1.031 25324 375 1 1 . 1 1 70 70 SER CA C 70 57.139 57.139 58.225 -1.086 25324 376 1 1 . 1 1 70 70 SER CB C 70 63.818 63.818 64.270 -0.452 25324 377 1 1 . 1 1 70 70 SER H H 70 7.693 7.693 7.240 0.453 25324 378 1 1 . 1 1 71 71 TYR N N 71 123.132 123.132 126.341 -3.209 25324 379 1 1 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.114 0.029 25324 380 1 1 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.387 0.261 25324 381 1 1 . 1 1 71 71 TYR CB C 71 42.445 42.445 41.557 0.888 25324 382 1 1 . 1 1 71 71 TYR H H 71 9.326 9.326 9.554 -0.228 25324 383 1 1 . 1 1 72 72 GLU N N 72 122.396 122.396 124.128 -1.732 25324 384 1 1 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.439 0.367 25324 385 1 1 . 1 1 72 72 GLU C C 72 175.698 175.698 175.077 0.621 25324 386 1 1 . 1 1 72 72 GLU CA C 72 55.167 55.167 56.127 -0.960 25324 387 1 1 . 1 1 72 72 GLU CB C 72 30.184 30.184 30.812 -0.628 25324 388 1 1 . 1 1 72 72 GLU H H 72 8.624 8.624 9.051 -0.427 25324 389 1 1 . 1 1 73 73 VAL N N 73 128.513 128.513 127.939 0.574 25324 390 1 1 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.243 -0.044 25324 391 1 1 . 1 1 73 73 VAL C C 73 175.369 175.369 174.907 0.462 25324 392 1 1 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.948 0.532 25324 393 1 1 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.392 0.941 25324 394 1 1 . 1 1 73 73 VAL H H 73 8.564 8.564 9.004 -0.440 25324 395 1 1 . 1 1 74 74 GLU N N 74 124.842 124.842 126.205 -1.363 25324 396 1 1 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.032 0.055 25324 397 1 1 . 1 1 74 74 GLU C C 74 174.415 174.415 174.730 -0.315 25324 398 1 1 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.765 -0.428 25324 399 1 1 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.725 1.432 25324 400 1 1 . 1 1 74 74 GLU H H 74 9.011 9.011 8.987 0.024 25324 401 1 1 . 1 1 75 75 ASN N N 75 116.136 116.136 120.249 -4.113 25324 402 1 1 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.779 0.360 25324 403 1 1 . 1 1 75 75 ASN C C 75 172.703 172.703 173.342 -0.639 25324 404 1 1 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.374 -0.549 25324 405 1 1 . 1 1 75 75 ASN CB C 75 45.896 45.896 43.154 2.742 25324 406 1 1 . 1 1 75 75 ASN H H 75 9.424 9.424 9.213 0.211 25324 407 1 1 . 1 1 76 76 GLN N N 76 120.762 120.762 122.310 -1.548 25324 408 1 1 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.397 -0.357 25324 409 1 1 . 1 1 76 76 GLN C C 76 173.113 173.113 173.828 -0.715 25324 410 1 1 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.346 -0.123 25324 411 1 1 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.323 -0.975 25324 412 1 1 . 1 1 76 76 GLN H H 76 7.106 7.106 8.706 -1.600 25324 413 1 1 . 1 1 77 77 TRP N N 77 125.598 125.598 125.062 0.536 25324 414 1 1 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.104 0.048 25324 415 1 1 . 1 1 77 77 TRP C C 77 175.502 175.502 175.342 0.160 25324 416 1 1 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.793 -1.029 25324 417 1 1 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.769 -0.770 25324 418 1 1 . 1 1 77 77 TRP H H 77 8.181 8.181 7.972 0.209 25324 419 1 1 . 1 1 78 78 GLY N N 78 107.901 107.901 108.284 -0.383 25324 420 1 1 . 1 1 78 78 GLY C C 78 174.611 174.611 174.157 0.454 25324 421 1 1 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.388 -0.486 25324 422 1 1 . 1 1 78 78 GLY H H 78 8.778 8.778 8.844 -0.066 25324 423 1 1 . 1 1 79 79 GLY N N 79 109.844 109.844 108.143 1.701 25324 424 1 1 . 1 1 79 79 GLY C C 79 173.782 173.782 174.211 -0.429 25324 425 1 1 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.443 -0.650 25324 426 1 1 . 1 1 79 79 GLY H H 79 8.198 8.198 7.588 0.610 25324 427 1 1 . 1 1 80 80 ASP N N 80 115.837 115.837 117.591 -1.754 25324 428 1 1 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.329 -0.088 25324 429 1 1 . 1 1 80 80 ASP C C 80 177.285 177.285 176.679 0.606 25324 430 1 1 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.928 0.255 25324 431 1 1 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.601 -0.078 25324 432 1 1 . 1 1 80 80 ASP H H 80 8.132 8.132 8.696 -0.564 25324 433 1 1 . 1 1 81 81 SER N N 81 112.690 112.690 114.161 -1.471 25324 434 1 1 . 1 1 81 81 SER HA H 81 4.513 4.513 4.414 0.099 25324 435 1 1 . 1 1 81 81 SER C C 81 173.684 173.684 174.396 -0.712 25324 436 1 1 . 1 1 81 81 SER CA C 81 57.232 57.232 58.010 -0.777 25324 437 1 1 . 1 1 81 81 SER CB C 81 63.170 63.170 63.261 -0.091 25324 438 1 1 . 1 1 81 81 SER H H 81 8.179 8.179 8.129 0.050 25324 439 1 1 . 1 1 82 82 ALA N N 82 126.310 126.310 126.919 -0.609 25324 440 1 1 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.566 -0.163 25324 441 1 1 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.871 0.595 25324 442 1 1 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.575 -0.377 25324 443 1 1 . 1 1 82 82 ALA H H 82 7.274 7.274 7.282 -0.008 25324 444 1 1 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.327 0.046 25324 445 1 1 . 1 1 83 83 PRO C C 83 175.378 175.378 175.270 0.108 25324 446 1 1 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.057 0.270 25324 447 1 1 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.708 -0.544 25324 448 1 1 . 1 1 84 84 TRP N N 84 120.106 120.106 116.789 3.317 25324 449 1 1 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.579 -0.308 25324 450 1 1 . 1 1 84 84 TRP C C 84 176.358 176.358 176.094 0.264 25324 451 1 1 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.769 0.177 25324 452 1 1 . 1 1 84 84 TRP CB C 84 29.716 29.716 31.164 -1.448 25324 453 1 1 . 1 1 84 84 TRP H H 84 8.329 8.329 7.989 0.340 25324 454 1 1 . 1 1 85 85 HIS N N 85 118.543 118.543 120.093 -1.550 25324 455 1 1 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.958 -0.040 25324 456 1 1 . 1 1 85 85 HIS C C 85 174.950 174.950 175.147 -0.197 25324 457 1 1 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.944 -1.475 25324 458 1 1 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.350 -1.677 25324 459 1 1 . 1 1 85 85 HIS H H 85 9.204 9.204 9.173 0.031 25324 460 1 1 . 1 1 86 86 SER N N 86 117.803 117.803 118.281 -0.478 25324 461 1 1 . 1 1 86 86 SER HA H 86 4.412 4.412 4.204 0.208 25324 462 1 1 . 1 1 86 86 SER C C 86 175.691 175.691 174.603 1.088 25324 463 1 1 . 1 1 86 86 SER CA C 86 60.257 60.257 59.480 0.777 25324 464 1 1 . 1 1 86 86 SER CB C 86 63.015 63.015 63.565 -0.549 25324 465 1 1 . 1 1 86 86 SER H H 86 9.168 9.168 8.945 0.223 25324 466 1 1 . 1 1 87 87 GLY N N 87 115.773 115.773 110.130 5.643 25324 467 1 1 . 1 1 87 87 GLY C C 87 174.288 174.288 173.423 0.865 25324 468 1 1 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.296 -0.595 25324 469 1 1 . 1 1 87 87 GLY H H 87 9.284 9.284 8.820 0.464 25324 470 1 1 . 1 1 88 88 GLY N N 88 109.162 109.162 107.311 1.851 25324 471 1 1 . 1 1 88 88 GLY C C 88 171.120 171.120 171.591 -0.471 25324 472 1 1 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.191 -0.596 25324 473 1 1 . 1 1 88 88 GLY H H 88 8.054 8.054 7.967 0.087 25324 474 1 1 . 1 1 89 89 ASN N N 89 117.048 117.048 119.439 -2.391 25324 475 1 1 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.763 0.275 25324 476 1 1 . 1 1 89 89 ASN C C 89 175.287 175.287 175.098 0.189 25324 477 1 1 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.075 -0.210 25324 478 1 1 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.730 -1.125 25324 479 1 1 . 1 1 89 89 ASN H H 89 8.516 8.516 8.765 -0.249 25324 480 1 1 . 1 1 90 90 TRP N N 90 125.844 125.844 126.652 -0.808 25324 481 1 1 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.254 -0.001 25324 482 1 1 . 1 1 90 90 TRP C C 90 175.278 175.278 175.348 -0.070 25324 483 1 1 . 1 1 90 90 TRP CA C 90 54.268 54.268 53.947 0.321 25324 484 1 1 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.119 -0.161 25324 485 1 1 . 1 1 90 90 TRP H H 90 9.282 9.282 9.385 -0.103 25324 486 1 1 . 1 1 91 91 ILE N N 91 123.134 123.134 121.206 1.928 25324 487 1 1 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.895 0.551 25324 488 1 1 . 1 1 91 91 ILE C C 91 175.489 175.489 175.285 0.204 25324 489 1 1 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.812 1.014 25324 490 1 1 . 1 1 91 91 ILE CB C 91 39.676 39.676 37.790 1.886 25324 491 1 1 . 1 1 91 91 ILE H H 91 9.318 9.318 8.756 0.562 25324 492 1 1 . 1 1 92 92 LEU N N 92 123.452 123.452 129.157 -5.705 25324 493 1 1 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.791 0.151 25324 494 1 1 . 1 1 92 92 LEU C C 92 173.620 173.620 174.328 -0.708 25324 495 1 1 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.694 -1.438 25324 496 1 1 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.617 1.891 25324 497 1 1 . 1 1 92 92 LEU H H 92 8.463 8.463 8.988 -0.525 25324 498 1 1 . 1 1 93 93 GLY N N 93 103.987 103.987 108.076 -4.089 25324 499 1 1 . 1 1 93 93 GLY C C 93 172.284 172.284 174.125 -1.841 25324 500 1 1 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.555 -2.055 25324 501 1 1 . 1 1 93 93 GLY H H 93 2.937 2.937 7.361 -4.424 25324 502 1 1 . 1 1 94 94 SER N N 94 110.274 110.274 117.789 -7.515 25324 503 1 1 . 1 1 94 94 SER HA H 94 4.711 4.711 4.693 0.018 25324 504 1 1 . 1 1 94 94 SER C C 94 174.784 174.784 175.197 -0.413 25324 505 1 1 . 1 1 94 94 SER CA C 94 56.555 56.555 59.209 -2.655 25324 506 1 1 . 1 1 94 94 SER CB C 94 65.051 65.051 64.961 0.090 25324 507 1 1 . 1 1 94 94 SER H H 94 7.919 7.919 9.363 -1.444 25324 508 1 1 . 1 1 95 95 ARG N N 95 123.020 123.020 122.002 1.018 25324 509 1 1 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.438 0.234 25324 510 1 1 . 1 1 95 95 ARG C C 95 176.120 176.120 176.181 -0.061 25324 511 1 1 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.174 0.200 25324 512 1 1 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.701 0.147 25324 513 1 1 . 1 1 95 95 ARG H H 95 9.148 9.148 7.572 1.576 25324 514 1 1 . 1 1 96 96 GLU N N 96 120.357 120.357 122.520 -2.163 25324 515 1 1 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.199 0.083 25324 516 1 1 . 1 1 96 96 GLU C C 96 176.278 176.278 176.326 -0.048 25324 517 1 1 . 1 1 96 96 GLU CA C 96 56.530 56.530 57.922 -1.392 25324 518 1 1 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.997 0.156 25324 519 1 1 . 1 1 96 96 GLU H H 96 8.610 8.610 8.756 -0.146 25324 520 1 1 . 1 1 97 97 ASN N N 97 117.678 117.678 116.001 1.677 25324 521 1 1 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.709 -0.097 25324 522 1 1 . 1 1 97 97 ASN C C 97 173.949 173.949 174.181 -0.232 25324 523 1 1 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.313 0.702 25324 524 1 1 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.308 -0.142 25324 525 1 1 . 1 1 97 97 ASN H H 97 8.533 8.533 8.002 0.531 25324 526 1 1 . 1 1 98 98 GLN N N 98 118.592 118.592 120.287 -1.695 25324 527 1 1 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.402 -0.042 25324 528 1 1 . 1 1 98 98 GLN C C 98 173.116 173.116 173.722 -0.606 25324 529 1 1 . 1 1 98 98 GLN CA C 98 55.628 55.628 56.013 -0.385 25324 530 1 1 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.049 -0.180 25324 531 1 1 . 1 1 98 98 GLN H H 98 7.663 7.663 7.439 0.224 25324 532 1 1 . 1 1 99 99 ASN N N 99 122.855 122.855 121.676 1.179 25324 533 1 1 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.298 -0.163 25324 534 1 1 . 1 1 99 99 ASN C C 99 175.287 175.287 175.311 -0.024 25324 535 1 1 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.165 0.825 25324 536 1 1 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.423 0.068 25324 537 1 1 . 1 1 99 99 ASN H H 99 8.759 8.759 8.590 0.169 25324 538 1 1 . 1 1 100 100 VAL N N 100 121.385 121.385 119.702 1.683 25324 539 1 1 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.641 0.107 25324 540 1 1 . 1 1 100 100 VAL C C 100 174.956 174.956 176.262 -1.306 25324 541 1 1 . 1 1 100 100 VAL CA C 100 63.843 63.843 64.330 -0.487 25324 542 1 1 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.510 0.933 25324 543 1 1 . 1 1 100 100 VAL H H 100 8.717 8.717 7.970 0.747 25324 544 1 1 . 1 1 101 101 VAL N N 101 112.736 112.736 122.932 -10.196 25324 545 1 1 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.440 0.205 25324 546 1 1 . 1 1 101 101 VAL C C 101 175.577 175.577 174.291 1.286 25324 547 1 1 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.778 -1.815 25324 548 1 1 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.689 -0.648 25324 549 1 1 . 1 1 101 101 VAL H H 101 8.802 8.802 8.648 0.154 25324 550 1 1 . 1 1 102 102 ALA N N 102 122.104 122.104 120.591 1.513 25324 551 1 1 . 1 1 102 102 ALA HA H 102 4.807 4.807 4.937 -0.130 25324 552 1 1 . 1 1 102 102 ALA C C 102 176.046 176.046 174.931 1.115 25324 553 1 1 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.843 2.412 25324 554 1 1 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.292 -0.667 25324 555 1 1 . 1 1 102 102 ALA H H 102 7.677 7.677 7.799 -0.122 25324 556 1 1 . 1 1 103 103 ILE N N 103 118.218 118.218 121.425 -3.207 25324 557 1 1 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.331 -0.304 25324 558 1 1 . 1 1 103 103 ILE C C 103 173.118 173.118 173.854 -0.736 25324 559 1 1 . 1 1 103 103 ILE CA C 103 62.227 62.227 59.325 2.902 25324 560 1 1 . 1 1 103 103 ILE CB C 103 42.471 42.471 40.946 1.526 25324 561 1 1 . 1 1 103 103 ILE H H 103 8.102 8.102 8.538 -0.436 25324 562 1 1 . 1 1 104 104 ASN N N 104 125.938 125.938 127.065 -1.127 25324 563 1 1 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.268 0.418 25324 564 1 1 . 1 1 104 104 ASN C C 104 174.870 174.870 173.612 1.258 25324 565 1 1 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.004 0.549 25324 566 1 1 . 1 1 104 104 ASN CB C 104 38.852 38.852 39.869 -1.017 25324 567 1 1 . 1 1 104 104 ASN H H 104 8.668 8.668 8.922 -0.254 25324 568 1 1 . 1 1 105 105 VAL N N 105 114.631 114.631 119.691 -5.060 25324 569 1 1 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.087 0.118 25324 570 1 1 . 1 1 105 105 VAL C C 105 174.788 174.788 173.473 1.315 25324 571 1 1 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.084 -2.105 25324 572 1 1 . 1 1 105 105 VAL CB C 105 36.040 36.040 34.968 1.072 25324 573 1 1 . 1 1 105 105 VAL H H 105 8.933 8.933 8.916 0.017 25324 574 1 1 . 1 1 106 106 GLU N N 106 118.347 118.347 125.385 -7.038 25324 575 1 1 . 1 1 106 106 GLU HA H 106 5.080 5.080 4.983 0.097 25324 576 1 1 . 1 1 106 106 GLU C C 106 174.777 174.777 174.602 0.175 25324 577 1 1 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.002 -0.035 25324 578 1 1 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.001 -0.358 25324 579 1 1 . 1 1 106 106 GLU H H 106 8.814 8.814 9.097 -0.283 25324 580 1 1 . 1 1 107 107 SER N N 107 115.335 115.335 121.211 -5.876 25324 581 1 1 . 1 1 107 107 SER HA H 107 5.266 5.266 4.882 0.384 25324 582 1 1 . 1 1 107 107 SER C C 107 175.787 175.787 175.146 0.641 25324 583 1 1 . 1 1 107 107 SER CA C 107 55.888 55.888 56.636 -0.748 25324 584 1 1 . 1 1 107 107 SER CB C 107 65.921 65.921 64.538 1.383 25324 585 1 1 . 1 1 107 107 SER H H 107 8.576 8.576 8.512 0.064 25324 586 1 1 . 1 1 108 108 GLY N N 108 117.567 117.567 114.482 3.085 25324 587 1 1 . 1 1 108 108 GLY C C 108 173.959 173.959 174.113 -0.154 25324 588 1 1 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.201 -0.524 25324 589 1 1 . 1 1 108 108 GLY H H 108 9.532 9.532 8.796 0.736 25324 590 1 1 . 1 1 109 109 ASP N N 109 122.108 122.108 120.184 1.924 25324 591 1 1 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.766 0.035 25324 592 1 1 . 1 1 109 109 ASP C C 109 176.203 176.203 175.917 0.286 25324 593 1 1 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.707 -0.573 25324 594 1 1 . 1 1 109 109 ASP CB C 109 39.342 39.342 43.206 -3.864 25324 595 1 1 . 1 1 109 109 ASP H H 109 8.605 8.605 7.519 1.086 25324 596 1 1 . 1 1 110 110 ASP N N 110 116.197 116.197 118.774 -2.577 25324 597 1 1 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.691 -0.469 25324 598 1 1 . 1 1 110 110 ASP C C 110 175.951 175.951 176.098 -0.147 25324 599 1 1 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.916 1.282 25324 600 1 1 . 1 1 110 110 ASP CB C 110 38.630 38.630 41.096 -2.466 25324 601 1 1 . 1 1 110 110 ASP H H 110 9.087 9.087 8.507 0.580 25324 602 1 1 . 1 1 111 111 GLY N N 111 103.841 103.841 107.130 -3.289 25324 603 1 1 . 1 1 111 111 GLY C C 111 173.924 173.924 174.636 -0.712 25324 604 1 1 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.148 0.015 25324 605 1 1 . 1 1 111 111 GLY H H 111 8.930 8.930 7.770 1.160 25324 606 1 1 . 1 1 112 112 GLN N N 112 121.626 121.626 120.701 0.925 25324 607 1 1 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.154 -0.084 25324 608 1 1 . 1 1 112 112 GLN C C 112 176.431 176.431 175.070 1.361 25324 609 1 1 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.485 -0.212 25324 610 1 1 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.499 -1.806 25324 611 1 1 . 1 1 112 112 GLN H H 112 7.351 7.351 8.048 -0.697 25324 612 1 1 . 1 1 113 113 THR N N 113 112.322 112.322 108.208 4.114 25324 613 1 1 . 1 1 113 113 THR HA H 113 5.331 5.331 5.170 0.161 25324 614 1 1 . 1 1 113 113 THR C C 113 174.452 174.452 172.625 1.827 25324 615 1 1 . 1 1 113 113 THR CA C 113 59.739 59.739 59.843 -0.104 25324 616 1 1 . 1 1 113 113 THR CB C 113 71.773 71.773 71.953 -0.180 25324 617 1 1 . 1 1 113 113 THR H H 113 10.053 10.053 7.768 2.285 25324 618 1 1 . 1 1 114 114 LEU N N 114 122.083 122.083 123.275 -1.192 25324 619 1 1 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.623 -0.042 25324 620 1 1 . 1 1 114 114 LEU C C 114 175.113 175.113 174.989 0.124 25324 621 1 1 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.016 -1.111 25324 622 1 1 . 1 1 114 114 LEU CB C 114 47.033 47.033 43.817 3.216 25324 623 1 1 . 1 1 114 114 LEU H H 114 8.978 8.978 8.907 0.071 25324 624 1 1 . 1 1 115 115 ASN N N 115 118.846 118.846 121.438 -2.592 25324 625 1 1 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.597 0.173 25324 626 1 1 . 1 1 115 115 ASN C C 115 174.788 174.788 174.958 -0.170 25324 627 1 1 . 1 1 115 115 ASN CA C 115 52.342 52.342 52.245 0.097 25324 628 1 1 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.022 1.392 25324 629 1 1 . 1 1 115 115 ASN H H 115 8.837 8.837 8.071 0.766 25324 630 1 1 . 1 1 116 116 GLY N N 116 109.661 109.661 110.420 -0.759 25324 631 1 1 . 1 1 116 116 GLY C C 116 172.452 172.452 172.350 0.102 25324 632 1 1 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.366 0.105 25324 633 1 1 . 1 1 116 116 GLY H H 116 8.625 8.625 8.753 -0.128 25324 634 1 1 . 1 1 117 117 THR N N 117 120.009 120.009 113.261 6.748 25324 635 1 1 . 1 1 117 117 THR HA H 117 5.556 5.556 5.715 -0.159 25324 636 1 1 . 1 1 117 117 THR C C 117 171.619 171.619 173.091 -1.472 25324 637 1 1 . 1 1 117 117 THR CA C 117 59.373 59.373 60.287 -0.914 25324 638 1 1 . 1 1 117 117 THR CB C 117 72.777 72.777 72.861 -0.084 25324 639 1 1 . 1 1 117 117 THR H H 117 8.911 8.911 9.055 -0.144 25324 640 1 1 . 1 1 118 118 MET N N 118 115.550 115.550 116.898 -1.348 25324 641 1 1 . 1 1 118 118 MET HA H 118 4.889 4.889 5.231 -0.342 25324 642 1 1 . 1 1 118 118 MET C C 118 172.707 172.707 174.059 -1.352 25324 643 1 1 . 1 1 118 118 MET CA C 118 54.714 54.714 54.752 -0.038 25324 644 1 1 . 1 1 118 118 MET CB C 118 33.663 33.663 37.530 -3.867 25324 645 1 1 . 1 1 118 118 MET H H 118 9.159 9.159 9.416 -0.257 25324 646 1 1 . 1 1 119 119 THR N N 119 113.716 113.716 114.983 -1.267 25324 647 1 1 . 1 1 119 119 THR HA H 119 4.682 4.682 4.842 -0.160 25324 648 1 1 . 1 1 119 119 THR C C 119 173.952 173.952 173.242 0.710 25324 649 1 1 . 1 1 119 119 THR CA C 119 61.395 61.395 62.042 -0.647 25324 650 1 1 . 1 1 119 119 THR CB C 119 71.746 71.746 71.500 0.246 25324 651 1 1 . 1 1 119 119 THR H H 119 8.685 8.685 8.763 -0.078 25324 652 1 1 . 1 1 120 120 TYR N N 120 129.153 129.153 126.339 2.814 25324 653 1 1 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.854 -0.054 25324 654 1 1 . 1 1 120 120 TYR C C 120 175.214 175.214 175.779 -0.565 25324 655 1 1 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.712 1.165 25324 656 1 1 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.837 -0.335 25324 657 1 1 . 1 1 120 120 TYR H H 120 10.107 10.107 8.253 1.854 25324 658 1 1 . 1 1 121 121 ALA N N 121 119.947 119.947 124.073 -4.126 25324 659 1 1 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.281 -0.277 25324 660 1 1 . 1 1 121 121 ALA C C 121 178.456 178.456 177.809 0.647 25324 661 1 1 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.847 0.109 25324 662 1 1 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.671 0.039 25324 663 1 1 . 1 1 121 121 ALA H H 121 8.704 8.704 8.440 0.264 25324 664 1 1 . 1 1 122 122 GLY N N 122 111.186 111.186 110.774 0.412 25324 665 1 1 . 1 1 122 122 GLY C C 122 173.949 173.949 173.952 -0.003 25324 666 1 1 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.242 -0.240 25324 667 1 1 . 1 1 122 122 GLY H H 122 8.792 8.792 8.634 0.158 25324 668 1 1 . 1 1 123 123 GLU N N 123 120.099 120.099 119.784 0.315 25324 669 1 1 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.625 0.080 25324 670 1 1 . 1 1 123 123 GLU C C 123 175.912 175.912 175.940 -0.028 25324 671 1 1 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.668 -0.254 25324 672 1 1 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.590 0.194 25324 673 1 1 . 1 1 123 123 GLU H H 123 8.072 8.072 7.975 0.097 25324 674 1 1 . 1 1 124 124 GLY N N 124 105.303 105.303 109.770 -4.467 25324 675 1 1 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.651 0.151 25324 676 1 1 . 1 1 124 124 GLY H H 124 7.939 7.939 8.442 -0.503 25324 677 1 1 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.766 0.169 25324 678 1 1 . 1 1 125 125 PRO C C 125 177.788 177.788 176.516 1.272 25324 679 1 1 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.367 -0.236 25324 680 1 1 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.081 -0.222 25324 681 1 1 . 1 1 126 126 ILE N N 126 117.387 117.387 118.806 -1.419 25324 682 1 1 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.681 0.218 25324 683 1 1 . 1 1 126 126 ILE C C 126 175.625 175.625 175.159 0.466 25324 684 1 1 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.064 0.389 25324 685 1 1 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.558 0.990 25324 686 1 1 . 1 1 126 126 ILE H H 126 9.599 9.599 8.892 0.707 25324 687 1 1 . 1 1 127 127 GLY N N 127 106.753 106.753 108.289 -1.536 25324 688 1 1 . 1 1 127 127 GLY C C 127 173.627 173.627 172.836 0.791 25324 689 1 1 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.745 1.538 25324 690 1 1 . 1 1 127 127 GLY H H 127 8.840 8.840 8.674 0.166 25324 691 1 1 . 1 1 128 128 PHE N N 128 124.826 124.826 126.663 -1.837 25324 692 1 1 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.184 -0.240 25324 693 1 1 . 1 1 128 128 PHE C C 128 173.087 173.087 173.252 -0.165 25324 694 1 1 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.817 0.192 25324 695 1 1 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.517 -0.357 25324 696 1 1 . 1 1 128 128 PHE H H 128 8.924 8.924 9.304 -0.380 25324 697 1 1 . 1 1 129 129 LYS N N 129 131.518 131.518 128.209 3.309 25324 698 1 1 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.810 0.073 25324 699 1 1 . 1 1 129 129 LYS C C 129 173.863 173.863 173.961 -0.098 25324 700 1 1 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.297 1.438 25324 701 1 1 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.382 -0.661 25324 702 1 1 . 1 1 129 129 LYS H H 129 8.201 8.201 8.249 -0.048 25324 703 1 1 . 1 1 130 130 GLY N N 130 114.030 114.030 113.245 0.785 25324 704 1 1 . 1 1 130 130 GLY C C 130 171.951 171.951 172.783 -0.832 25324 705 1 1 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.553 0.234 25324 706 1 1 . 1 1 130 130 GLY H H 130 9.325 9.325 8.782 0.543 25324 707 1 1 . 1 1 131 131 THR N N 131 120.583 120.583 119.389 1.194 25324 708 1 1 . 1 1 131 131 THR HA H 131 4.939 4.939 4.965 -0.026 25324 709 1 1 . 1 1 131 131 THR C C 131 173.118 173.118 173.360 -0.242 25324 710 1 1 . 1 1 131 131 THR CA C 131 61.266 61.266 61.630 -0.364 25324 711 1 1 . 1 1 131 131 THR CB C 131 70.392 70.392 72.264 -1.872 25324 712 1 1 . 1 1 131 131 THR H H 131 8.916 8.916 8.892 0.024 25324 713 1 1 . 1 1 132 132 LEU N N 132 130.774 130.774 129.565 1.209 25324 714 1 1 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.946 -0.446 25324 715 1 1 . 1 1 132 132 LEU C C 132 176.574 176.574 176.074 0.500 25324 716 1 1 . 1 1 132 132 LEU CA C 132 56.187 56.187 54.751 1.436 25324 717 1 1 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.850 -0.403 25324 718 1 1 . 1 1 132 132 LEU H H 132 8.527 8.527 9.149 -0.622 25324 719 1 2 . 1 1 3 3 LEU N N 3 123.202 123.202 120.157 3.045 25324 720 1 2 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.895 0.262 25324 721 1 2 . 1 1 3 3 LEU C C 3 175.786 175.786 174.240 1.546 25324 722 1 2 . 1 1 3 3 LEU CA C 3 54.284 54.284 55.094 -0.810 25324 723 1 2 . 1 1 3 3 LEU CB C 3 43.330 43.330 44.860 -1.530 25324 724 1 2 . 1 1 3 3 LEU H H 3 8.711 8.711 8.010 0.701 25324 725 1 2 . 1 1 4 4 TYR N N 4 120.906 120.906 123.514 -2.608 25324 726 1 2 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.010 0.014 25324 727 1 2 . 1 1 4 4 TYR C C 4 175.953 175.953 174.371 1.582 25324 728 1 2 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.757 -0.380 25324 729 1 2 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.863 -1.208 25324 730 1 2 . 1 1 4 4 TYR H H 4 9.142 9.142 9.554 -0.412 25324 731 1 2 . 1 1 5 5 ASN N N 5 120.496 120.496 120.405 0.091 25324 732 1 2 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.993 0.123 25324 733 1 2 . 1 1 5 5 ASN C C 5 174.953 174.953 173.594 1.359 25324 734 1 2 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.641 0.306 25324 735 1 2 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.792 -1.901 25324 736 1 2 . 1 1 5 5 ASN H H 5 8.787 8.787 9.030 -0.243 25324 737 1 2 . 1 1 6 6 VAL N N 6 127.428 127.428 125.965 1.463 25324 738 1 2 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.414 -0.052 25324 739 1 2 . 1 1 6 6 VAL C C 6 174.955 174.955 174.404 0.551 25324 740 1 2 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.767 0.666 25324 741 1 2 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.881 -0.550 25324 742 1 2 . 1 1 6 6 VAL H H 6 8.806 8.806 8.989 -0.183 25324 743 1 2 . 1 1 7 7 GLU N N 7 124.355 124.355 126.523 -2.168 25324 744 1 2 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.888 0.094 25324 745 1 2 . 1 1 7 7 GLU C C 7 174.551 174.551 174.924 -0.373 25324 746 1 2 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.736 -0.947 25324 747 1 2 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.892 1.675 25324 748 1 2 . 1 1 7 7 GLU H H 7 8.800 8.800 8.908 -0.108 25324 749 1 2 . 1 1 8 8 ASN N N 8 116.231 116.231 121.484 -5.253 25324 750 1 2 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.742 0.299 25324 751 1 2 . 1 1 8 8 ASN C C 8 172.709 172.709 173.466 -0.757 25324 752 1 2 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.325 -0.708 25324 753 1 2 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.491 3.094 25324 754 1 2 . 1 1 8 8 ASN H H 8 9.320 9.320 9.238 0.082 25324 755 1 2 . 1 1 9 9 GLN N N 9 120.762 120.762 123.230 -2.468 25324 756 1 2 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.194 -0.020 25324 757 1 2 . 1 1 9 9 GLN C C 9 173.454 173.454 173.535 -0.081 25324 758 1 2 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.098 -0.138 25324 759 1 2 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.596 -0.905 25324 760 1 2 . 1 1 9 9 GLN H H 9 6.887 6.887 8.651 -1.764 25324 761 1 2 . 1 1 10 10 TRP N N 10 127.775 127.775 125.072 2.703 25324 762 1 2 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.085 -0.097 25324 763 1 2 . 1 1 10 10 TRP C C 10 175.281 175.281 175.674 -0.393 25324 764 1 2 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.556 -0.263 25324 765 1 2 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.006 -1.264 25324 766 1 2 . 1 1 10 10 TRP H H 10 8.518 8.518 8.010 0.508 25324 767 1 2 . 1 1 11 11 GLY N N 11 107.838 107.838 109.829 -1.991 25324 768 1 2 . 1 1 11 11 GLY C C 11 174.733 174.733 174.532 0.201 25324 769 1 2 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.743 0.093 25324 770 1 2 . 1 1 11 11 GLY H H 11 8.461 8.461 8.815 -0.354 25324 771 1 2 . 1 1 12 12 GLY N N 12 109.696 109.696 107.224 2.472 25324 772 1 2 . 1 1 12 12 GLY C C 12 174.133 174.133 174.558 -0.425 25324 773 1 2 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.332 -0.543 25324 774 1 2 . 1 1 12 12 GLY H H 12 8.138 8.138 7.414 0.724 25324 775 1 2 . 1 1 13 13 SER N N 13 111.308 111.308 115.650 -4.342 25324 776 1 2 . 1 1 13 13 SER HA H 13 4.092 4.092 4.569 -0.477 25324 777 1 2 . 1 1 13 13 SER C C 13 175.622 175.622 175.315 0.307 25324 778 1 2 . 1 1 13 13 SER CA C 13 60.494 60.494 59.994 0.500 25324 779 1 2 . 1 1 13 13 SER CB C 13 63.028 63.028 63.220 -0.192 25324 780 1 2 . 1 1 13 13 SER H H 13 8.215 8.215 8.578 -0.363 25324 781 1 2 . 1 1 14 14 SER N N 14 115.290 115.290 114.724 0.566 25324 782 1 2 . 1 1 14 14 SER HA H 14 4.566 4.566 4.477 0.089 25324 783 1 2 . 1 1 14 14 SER C C 14 173.532 173.532 173.763 -0.231 25324 784 1 2 . 1 1 14 14 SER CA C 14 57.317 57.317 58.630 -1.313 25324 785 1 2 . 1 1 14 14 SER CB C 14 63.230 63.230 63.438 -0.208 25324 786 1 2 . 1 1 14 14 SER H H 14 8.213 8.213 8.111 0.102 25324 787 1 2 . 1 1 15 15 ALA N N 15 126.470 126.470 125.812 0.658 25324 788 1 2 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.517 -0.114 25324 789 1 2 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.679 0.785 25324 790 1 2 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.384 -0.155 25324 791 1 2 . 1 1 15 15 ALA H H 15 7.308 7.308 7.328 -0.020 25324 792 1 2 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.322 0.087 25324 793 1 2 . 1 1 16 16 PRO C C 16 175.627 175.627 176.090 -0.463 25324 794 1 2 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.467 -0.075 25324 795 1 2 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.530 -0.393 25324 796 1 2 . 1 1 17 17 TRP N N 17 120.228 120.228 120.679 -0.451 25324 797 1 2 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.742 -0.424 25324 798 1 2 . 1 1 17 17 TRP C C 17 175.951 175.951 176.092 -0.141 25324 799 1 2 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.778 0.137 25324 800 1 2 . 1 1 17 17 TRP CB C 17 29.409 29.409 29.885 -0.476 25324 801 1 2 . 1 1 17 17 TRP H H 17 8.380 8.380 8.226 0.154 25324 802 1 2 . 1 1 18 18 ASN N N 18 120.663 120.663 122.305 -1.642 25324 803 1 2 . 1 1 18 18 ASN HA H 18 5.086 5.086 4.946 0.140 25324 804 1 2 . 1 1 18 18 ASN C C 18 174.793 174.793 174.336 0.457 25324 805 1 2 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.281 -0.680 25324 806 1 2 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.294 1.354 25324 807 1 2 . 1 1 18 18 ASN H H 18 9.094 9.094 8.760 0.334 25324 808 1 2 . 1 1 19 19 GLU N N 19 122.202 122.202 124.466 -2.264 25324 809 1 2 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.114 0.025 25324 810 1 2 . 1 1 19 19 GLU C C 19 176.869 176.869 176.835 0.034 25324 811 1 2 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.467 1.133 25324 812 1 2 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.924 -0.542 25324 813 1 2 . 1 1 19 19 GLU H H 19 9.013 9.013 8.990 0.023 25324 814 1 2 . 1 1 20 20 GLY N N 20 112.893 112.893 113.648 -0.755 25324 815 1 2 . 1 1 20 20 GLY C C 20 174.878 174.878 173.713 1.165 25324 816 1 2 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.775 0.220 25324 817 1 2 . 1 1 20 20 GLY H H 20 8.926 8.926 9.093 -0.167 25324 818 1 2 . 1 1 21 21 GLY N N 21 110.354 110.354 108.118 2.236 25324 819 1 2 . 1 1 21 21 GLY C C 21 171.623 171.623 171.697 -0.074 25324 820 1 2 . 1 1 21 21 GLY CA C 21 44.398 44.398 44.878 -0.480 25324 821 1 2 . 1 1 21 21 GLY H H 21 8.258 8.258 7.689 0.569 25324 822 1 2 . 1 1 22 22 GLN N N 22 117.541 117.541 119.544 -2.003 25324 823 1 2 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.185 0.492 25324 824 1 2 . 1 1 22 22 GLN C C 22 175.957 175.957 174.386 1.571 25324 825 1 2 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.551 0.393 25324 826 1 2 . 1 1 22 22 GLN CB C 22 31.085 31.085 31.983 -0.898 25324 827 1 2 . 1 1 22 22 GLN H H 22 8.564 8.564 8.506 0.058 25324 828 1 2 . 1 1 23 23 TRP N N 23 127.208 127.208 122.049 5.159 25324 829 1 2 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.087 0.112 25324 830 1 2 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.191 0.340 25324 831 1 2 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.895 -1.212 25324 832 1 2 . 1 1 23 23 TRP H H 23 9.347 9.347 9.159 0.188 25324 833 1 2 . 1 1 24 24 GLU N N 24 123.504 123.504 121.210 2.294 25324 834 1 2 . 1 1 24 24 GLU HA H 24 5.508 5.508 4.881 0.627 25324 835 1 2 . 1 1 24 24 GLU C C 24 174.222 174.222 174.880 -0.658 25324 836 1 2 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.053 0.538 25324 837 1 2 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.446 -0.831 25324 838 1 2 . 1 1 24 24 GLU H H 24 9.296 9.296 8.733 0.563 25324 839 1 2 . 1 1 25 25 ILE N N 25 123.447 123.447 125.596 -2.149 25324 840 1 2 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.752 -0.316 25324 841 1 2 . 1 1 25 25 ILE C C 25 175.790 175.790 174.714 1.076 25324 842 1 2 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.065 -0.438 25324 843 1 2 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.420 0.532 25324 844 1 2 . 1 1 25 25 ILE H H 25 8.635 8.635 8.359 0.276 25324 845 1 2 . 1 1 26 26 GLY N N 26 111.544 111.544 113.903 -2.359 25324 846 1 2 . 1 1 26 26 GLY C C 26 172.122 172.122 174.045 -1.923 25324 847 1 2 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.478 -0.400 25324 848 1 2 . 1 1 26 26 GLY H H 26 3.381 3.381 6.574 -3.193 25324 849 1 2 . 1 1 27 27 SER N N 27 112.279 112.279 118.647 -6.368 25324 850 1 2 . 1 1 27 27 SER HA H 27 4.876 4.876 4.551 0.325 25324 851 1 2 . 1 1 27 27 SER C C 27 174.113 174.113 174.032 0.081 25324 852 1 2 . 1 1 27 27 SER CA C 27 56.954 56.954 58.706 -1.752 25324 853 1 2 . 1 1 27 27 SER CB C 27 64.554 64.554 63.762 0.792 25324 854 1 2 . 1 1 27 27 SER H H 27 8.212 8.212 8.701 -0.489 25324 855 1 2 . 1 1 28 28 ARG N N 28 120.872 120.872 120.822 0.050 25324 856 1 2 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.634 0.129 25324 857 1 2 . 1 1 28 28 ARG C C 28 176.119 176.119 175.879 0.240 25324 858 1 2 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.419 -0.302 25324 859 1 2 . 1 1 28 28 ARG CB C 28 31.830 31.830 32.666 -0.837 25324 860 1 2 . 1 1 28 28 ARG H H 28 7.849 7.849 7.937 -0.088 25324 861 1 2 . 1 1 29 29 SER N N 29 118.985 118.985 118.901 0.084 25324 862 1 2 . 1 1 29 29 SER HA H 29 4.192 4.192 4.461 -0.269 25324 863 1 2 . 1 1 29 29 SER C C 29 174.622 174.622 174.508 0.114 25324 864 1 2 . 1 1 29 29 SER CA C 29 60.072 60.072 59.429 0.643 25324 865 1 2 . 1 1 29 29 SER CB C 29 62.876 62.876 63.668 -0.792 25324 866 1 2 . 1 1 29 29 SER H H 29 8.892 8.892 8.850 0.042 25324 867 1 2 . 1 1 30 30 ASP N N 30 117.632 117.632 120.091 -2.459 25324 868 1 2 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.527 0.091 25324 869 1 2 . 1 1 30 30 ASP C C 30 175.101 175.101 176.062 -0.961 25324 870 1 2 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.126 -2.074 25324 871 1 2 . 1 1 30 30 ASP CB C 30 40.523 40.523 40.948 -0.425 25324 872 1 2 . 1 1 30 30 ASP H H 30 8.441 8.441 8.122 0.319 25324 873 1 2 . 1 1 31 31 GLN N N 31 118.273 118.273 119.069 -0.796 25324 874 1 2 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.466 0.019 25324 875 1 2 . 1 1 31 31 GLN C C 31 173.453 173.453 174.358 -0.905 25324 876 1 2 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.760 0.108 25324 877 1 2 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.305 2.944 25324 878 1 2 . 1 1 31 31 GLN H H 31 7.029 7.029 7.825 -0.796 25324 879 1 2 . 1 1 32 32 ASN N N 32 120.865 120.865 120.616 0.249 25324 880 1 2 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.966 0.154 25324 881 1 2 . 1 1 32 32 ASN C C 32 175.198 175.198 174.692 0.506 25324 882 1 2 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.126 -0.257 25324 883 1 2 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.313 -0.683 25324 884 1 2 . 1 1 32 32 ASN H H 32 8.713 8.713 8.619 0.094 25324 885 1 2 . 1 1 33 33 VAL N N 33 122.111 122.111 119.386 2.725 25324 886 1 2 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.226 -0.521 25324 887 1 2 . 1 1 33 33 VAL C C 33 174.950 174.950 176.030 -1.080 25324 888 1 2 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.854 0.993 25324 889 1 2 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.207 0.143 25324 890 1 2 . 1 1 33 33 VAL H H 33 8.542 8.542 8.667 -0.125 25324 891 1 2 . 1 1 34 34 VAL N N 34 113.282 113.282 119.505 -6.223 25324 892 1 2 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.432 0.213 25324 893 1 2 . 1 1 34 34 VAL C C 34 175.574 175.574 174.799 0.775 25324 894 1 2 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.476 -1.502 25324 895 1 2 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.953 0.076 25324 896 1 2 . 1 1 34 34 VAL H H 34 8.744 8.744 8.903 -0.159 25324 897 1 2 . 1 1 35 35 ALA N N 35 122.102 122.102 121.478 0.624 25324 898 1 2 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.309 -0.506 25324 899 1 2 . 1 1 35 35 ALA C C 35 175.947 175.947 175.007 0.940 25324 900 1 2 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.912 2.338 25324 901 1 2 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.534 -0.906 25324 902 1 2 . 1 1 35 35 ALA H H 35 7.677 7.677 7.786 -0.109 25324 903 1 2 . 1 1 36 36 ILE N N 36 118.005 118.005 121.270 -3.265 25324 904 1 2 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.553 -0.525 25324 905 1 2 . 1 1 36 36 ILE C C 36 173.116 173.116 173.985 -0.869 25324 906 1 2 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.170 1.012 25324 907 1 2 . 1 1 36 36 ILE CB C 36 42.485 42.485 42.070 0.415 25324 908 1 2 . 1 1 36 36 ILE H H 36 8.126 8.126 8.757 -0.631 25324 909 1 2 . 1 1 37 37 ASN N N 37 125.632 125.632 125.952 -0.320 25324 910 1 2 . 1 1 37 37 ASN HA H 37 5.681 5.681 6.039 -0.358 25324 911 1 2 . 1 1 37 37 ASN C C 37 174.854 174.854 173.777 1.077 25324 912 1 2 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.188 0.341 25324 913 1 2 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.814 -2.961 25324 914 1 2 . 1 1 37 37 ASN H H 37 8.577 8.577 9.191 -0.614 25324 915 1 2 . 1 1 38 38 VAL N N 38 114.223 114.223 119.144 -4.921 25324 916 1 2 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.928 0.275 25324 917 1 2 . 1 1 38 38 VAL C C 38 174.854 174.854 173.413 1.441 25324 918 1 2 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.192 -2.212 25324 919 1 2 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.763 0.281 25324 920 1 2 . 1 1 38 38 VAL H H 38 8.874 8.874 8.718 0.156 25324 921 1 2 . 1 1 39 39 GLU N N 39 118.277 118.277 122.258 -3.981 25324 922 1 2 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.126 -0.044 25324 923 1 2 . 1 1 39 39 GLU C C 39 174.548 174.548 175.353 -0.805 25324 924 1 2 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.715 1.278 25324 925 1 2 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.302 -0.724 25324 926 1 2 . 1 1 39 39 GLU H H 39 8.761 8.761 9.320 -0.559 25324 927 1 2 . 1 1 40 40 SER N N 40 114.960 114.960 120.527 -5.567 25324 928 1 2 . 1 1 40 40 SER HA H 40 5.265 5.265 4.744 0.521 25324 929 1 2 . 1 1 40 40 SER C C 40 175.783 175.783 175.053 0.730 25324 930 1 2 . 1 1 40 40 SER CA C 40 55.880 55.880 57.914 -2.034 25324 931 1 2 . 1 1 40 40 SER CB C 40 65.911 65.911 63.607 2.304 25324 932 1 2 . 1 1 40 40 SER H H 40 8.500 8.500 8.437 0.063 25324 933 1 2 . 1 1 41 41 GLY N N 41 117.567 117.567 111.069 6.498 25324 934 1 2 . 1 1 41 41 GLY C C 41 174.119 174.119 174.662 -0.543 25324 935 1 2 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.442 -0.754 25324 936 1 2 . 1 1 41 41 GLY H H 41 9.533 9.533 8.529 1.004 25324 937 1 2 . 1 1 42 42 ASP N N 42 122.141 122.141 121.163 0.978 25324 938 1 2 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.794 0.006 25324 939 1 2 . 1 1 42 42 ASP C C 42 176.121 176.121 175.908 0.213 25324 940 1 2 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.316 -1.170 25324 941 1 2 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.384 -3.030 25324 942 1 2 . 1 1 42 42 ASP H H 42 8.644 8.644 7.768 0.876 25324 943 1 2 . 1 1 43 43 ASP N N 43 116.025 116.025 118.872 -2.847 25324 944 1 2 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.506 -0.277 25324 945 1 2 . 1 1 43 43 ASP C C 43 176.018 176.018 176.473 -0.455 25324 946 1 2 . 1 1 43 43 ASP CA C 43 55.249 55.249 53.397 1.852 25324 947 1 2 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.233 0.326 25324 948 1 2 . 1 1 43 43 ASP H H 43 9.111 9.111 8.571 0.540 25324 949 1 2 . 1 1 44 44 GLY N N 44 104.263 104.263 108.594 -4.331 25324 950 1 2 . 1 1 44 44 GLY C C 44 173.922 173.922 174.757 -0.835 25324 951 1 2 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.540 -0.239 25324 952 1 2 . 1 1 44 44 GLY H H 44 9.063 9.063 7.907 1.156 25324 953 1 2 . 1 1 45 45 GLN N N 45 121.691 121.691 120.380 1.311 25324 954 1 2 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.143 -0.057 25324 955 1 2 . 1 1 45 45 GLN C C 45 176.284 176.284 175.098 1.186 25324 956 1 2 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.297 -0.179 25324 957 1 2 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.399 -1.725 25324 958 1 2 . 1 1 45 45 GLN H H 45 7.356 7.356 8.128 -0.772 25324 959 1 2 . 1 1 46 46 THR N N 46 111.843 111.843 107.914 3.929 25324 960 1 2 . 1 1 46 46 THR HA H 46 5.355 5.355 5.152 0.203 25324 961 1 2 . 1 1 46 46 THR C C 46 174.451 174.451 173.021 1.430 25324 962 1 2 . 1 1 46 46 THR CA C 46 59.644 59.644 59.684 -0.040 25324 963 1 2 . 1 1 46 46 THR CB C 46 72.714 72.714 71.483 1.231 25324 964 1 2 . 1 1 46 46 THR H H 46 10.123 10.123 7.454 2.669 25324 965 1 2 . 1 1 47 47 LEU N N 47 119.302 119.302 123.769 -4.467 25324 966 1 2 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.581 0.226 25324 967 1 2 . 1 1 47 47 LEU C C 47 175.487 175.487 174.509 0.978 25324 968 1 2 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.718 -0.648 25324 969 1 2 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.560 3.443 25324 970 1 2 . 1 1 47 47 LEU H H 47 8.364 8.364 9.069 -0.705 25324 971 1 2 . 1 1 48 48 ASN N N 48 116.844 116.844 118.289 -1.445 25324 972 1 2 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.627 0.102 25324 973 1 2 . 1 1 48 48 ASN C C 48 174.460 174.460 174.415 0.045 25324 974 1 2 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.399 1.340 25324 975 1 2 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.340 1.073 25324 976 1 2 . 1 1 48 48 ASN H H 48 8.748 8.748 8.893 -0.145 25324 977 1 2 . 1 1 49 49 GLY N N 49 109.417 109.417 107.363 2.054 25324 978 1 2 . 1 1 49 49 GLY C C 49 172.126 172.126 171.907 0.219 25324 979 1 2 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.260 0.231 25324 980 1 2 . 1 1 49 49 GLY H H 49 8.744 8.744 8.632 0.112 25324 981 1 2 . 1 1 50 50 THR N N 50 119.162 119.162 116.973 2.189 25324 982 1 2 . 1 1 50 50 THR HA H 50 5.556 5.556 5.628 -0.072 25324 983 1 2 . 1 1 50 50 THR C C 50 171.790 171.790 172.554 -0.764 25324 984 1 2 . 1 1 50 50 THR CA C 50 59.371 59.371 60.262 -0.891 25324 985 1 2 . 1 1 50 50 THR CB C 50 72.799 72.799 71.686 1.113 25324 986 1 2 . 1 1 50 50 THR H H 50 8.799 8.799 8.922 -0.123 25324 987 1 2 . 1 1 51 51 MET N N 51 115.232 115.232 126.425 -11.193 25324 988 1 2 . 1 1 51 51 MET HA H 51 4.886 4.886 5.173 -0.287 25324 989 1 2 . 1 1 51 51 MET C C 51 172.708 172.708 173.645 -0.937 25324 990 1 2 . 1 1 51 51 MET CA C 51 54.722 54.722 53.782 0.940 25324 991 1 2 . 1 1 51 51 MET CB C 51 34.557 34.557 37.300 -2.743 25324 992 1 2 . 1 1 51 51 MET H H 51 9.062 9.062 9.086 -0.024 25324 993 1 2 . 1 1 52 52 THR N N 52 113.697 113.697 122.127 -8.430 25324 994 1 2 . 1 1 52 52 THR HA H 52 4.682 4.682 4.761 -0.079 25324 995 1 2 . 1 1 52 52 THR C C 52 173.952 173.952 173.585 0.367 25324 996 1 2 . 1 1 52 52 THR CA C 52 61.395 61.395 61.405 -0.010 25324 997 1 2 . 1 1 52 52 THR CB C 52 71.734 71.734 70.903 0.832 25324 998 1 2 . 1 1 52 52 THR H H 52 8.685 8.685 8.913 -0.228 25324 999 1 2 . 1 1 53 53 TYR N N 53 129.086 129.086 126.088 2.998 25324 1000 1 2 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.983 -0.183 25324 1001 1 2 . 1 1 53 53 TYR C C 53 175.214 175.214 176.493 -1.279 25324 1002 1 2 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.041 0.840 25324 1003 1 2 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.655 0.857 25324 1004 1 2 . 1 1 53 53 TYR H H 53 10.112 10.112 8.772 1.340 25324 1005 1 2 . 1 1 54 54 ALA N N 54 119.947 119.947 123.611 -3.664 25324 1006 1 2 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.307 -0.305 25324 1007 1 2 . 1 1 54 54 ALA C C 54 178.285 178.285 177.778 0.507 25324 1008 1 2 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.609 0.362 25324 1009 1 2 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.590 0.127 25324 1010 1 2 . 1 1 54 54 ALA H H 54 8.704 8.704 8.568 0.136 25324 1011 1 2 . 1 1 55 55 GLY N N 55 110.940 110.940 110.851 0.089 25324 1012 1 2 . 1 1 55 55 GLY C C 55 173.903 173.903 174.441 -0.538 25324 1013 1 2 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.547 -0.531 25324 1014 1 2 . 1 1 55 55 GLY H H 55 8.745 8.745 8.714 0.031 25324 1015 1 2 . 1 1 56 56 GLU N N 56 120.073 120.073 120.293 -0.220 25324 1016 1 2 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.660 0.049 25324 1017 1 2 . 1 1 56 56 GLU C C 56 175.906 175.906 176.180 -0.274 25324 1018 1 2 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.621 -0.198 25324 1019 1 2 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.539 0.285 25324 1020 1 2 . 1 1 56 56 GLU H H 56 8.039 8.039 7.853 0.186 25324 1021 1 2 . 1 1 57 57 GLY N N 57 105.298 105.298 107.915 -2.617 25324 1022 1 2 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.250 0.552 25324 1023 1 2 . 1 1 57 57 GLY H H 57 7.937 7.937 8.231 -0.294 25324 1024 1 2 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.552 0.382 25324 1025 1 2 . 1 1 58 58 PRO C C 58 177.785 177.785 176.340 1.445 25324 1026 1 2 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.375 -0.243 25324 1027 1 2 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.178 -0.338 25324 1028 1 2 . 1 1 59 59 ILE N N 59 117.386 117.386 118.117 -0.731 25324 1029 1 2 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.911 0.077 25324 1030 1 2 . 1 1 59 59 ILE C C 59 175.688 175.688 175.896 -0.208 25324 1031 1 2 . 1 1 59 59 ILE CA C 59 59.543 59.543 58.856 0.687 25324 1032 1 2 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.610 0.678 25324 1033 1 2 . 1 1 59 59 ILE H H 59 9.600 9.600 8.836 0.764 25324 1034 1 2 . 1 1 60 60 GLY N N 60 107.164 107.164 107.909 -0.745 25324 1035 1 2 . 1 1 60 60 GLY C C 60 173.787 173.787 172.494 1.293 25324 1036 1 2 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.658 1.577 25324 1037 1 2 . 1 1 60 60 GLY H H 60 8.957 8.957 8.687 0.270 25324 1038 1 2 . 1 1 61 61 PHE N N 61 124.597 124.597 126.557 -1.960 25324 1039 1 2 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.283 -0.060 25324 1040 1 2 . 1 1 61 61 PHE C C 61 173.126 173.126 173.073 0.053 25324 1041 1 2 . 1 1 61 61 PHE CA C 61 56.861 56.861 55.527 1.334 25324 1042 1 2 . 1 1 61 61 PHE CB C 61 43.217 43.217 42.991 0.226 25324 1043 1 2 . 1 1 61 61 PHE H H 61 8.788 8.788 9.171 -0.383 25324 1044 1 2 . 1 1 62 62 ARG N N 62 129.706 129.706 127.960 1.746 25324 1045 1 2 . 1 1 62 62 ARG HA H 62 5.132 5.132 4.940 0.192 25324 1046 1 2 . 1 1 62 62 ARG C C 62 172.456 172.456 173.153 -0.697 25324 1047 1 2 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.849 1.105 25324 1048 1 2 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.204 -1.334 25324 1049 1 2 . 1 1 62 62 ARG H H 62 8.405 8.405 8.933 -0.528 25324 1050 1 2 . 1 1 63 63 ALA N N 63 122.744 122.744 129.258 -6.514 25324 1051 1 2 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.446 -0.101 25324 1052 1 2 . 1 1 63 63 ALA C C 63 176.120 176.120 175.452 0.668 25324 1053 1 2 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.066 -0.147 25324 1054 1 2 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.721 2.053 25324 1055 1 2 . 1 1 63 63 ALA H H 63 8.628 8.628 8.772 -0.144 25324 1056 1 2 . 1 1 64 64 THR N N 64 116.855 116.855 119.455 -2.600 25324 1057 1 2 . 1 1 64 64 THR HA H 64 4.848 4.848 4.986 -0.138 25324 1058 1 2 . 1 1 64 64 THR C C 64 172.957 172.957 173.448 -0.491 25324 1059 1 2 . 1 1 64 64 THR CA C 64 61.211 61.211 61.301 -0.090 25324 1060 1 2 . 1 1 64 64 THR CB C 64 71.064 71.064 71.352 -0.288 25324 1061 1 2 . 1 1 64 64 THR H H 64 8.315 8.315 8.738 -0.423 25324 1062 1 2 . 1 1 65 65 LEU N N 65 129.360 129.360 128.595 0.765 25324 1063 1 2 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.660 -0.298 25324 1064 1 2 . 1 1 65 65 LEU C C 65 176.459 176.459 175.994 0.465 25324 1065 1 2 . 1 1 65 65 LEU CA C 65 55.687 55.687 55.308 0.379 25324 1066 1 2 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.857 -0.146 25324 1067 1 2 . 1 1 65 65 LEU H H 65 8.877 8.877 8.704 0.173 25324 1068 1 2 . 1 1 66 66 LEU N N 66 128.683 128.683 127.466 1.217 25324 1069 1 2 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.124 0.252 25324 1070 1 2 . 1 1 66 66 LEU C C 66 177.621 177.621 177.961 -0.340 25324 1071 1 2 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.174 -1.474 25324 1072 1 2 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.260 0.042 25324 1073 1 2 . 1 1 66 66 LEU H H 66 9.320 9.320 8.892 0.428 25324 1074 1 2 . 1 1 67 67 GLY N N 67 105.361 105.361 104.166 1.195 25324 1075 1 2 . 1 1 67 67 GLY C C 67 173.618 173.618 174.073 -0.455 25324 1076 1 2 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.733 -1.366 25324 1077 1 2 . 1 1 67 67 GLY H H 67 6.639 6.639 7.974 -1.335 25324 1078 1 2 . 1 1 68 68 ASN N N 68 121.848 121.848 119.376 2.472 25324 1079 1 2 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.938 -0.607 25324 1080 1 2 . 1 1 68 68 ASN C C 68 174.316 174.316 174.933 -0.617 25324 1081 1 2 . 1 1 68 68 ASN CA C 68 54.552 54.552 52.101 2.451 25324 1082 1 2 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.076 -1.911 25324 1083 1 2 . 1 1 68 68 ASN H H 68 9.236 9.236 7.954 1.282 25324 1084 1 2 . 1 1 69 69 ASN N N 69 109.509 109.509 114.250 -4.741 25324 1085 1 2 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.532 -0.453 25324 1086 1 2 . 1 1 69 69 ASN C C 69 171.456 171.456 174.412 -2.956 25324 1087 1 2 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.269 1.482 25324 1088 1 2 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.356 -0.050 25324 1089 1 2 . 1 1 69 69 ASN H H 69 8.651 8.651 8.553 0.098 25324 1090 1 2 . 1 1 70 70 SER N N 70 113.479 113.479 112.946 0.533 25324 1091 1 2 . 1 1 70 70 SER HA H 70 5.437 5.437 5.039 0.398 25324 1092 1 2 . 1 1 70 70 SER C C 70 173.750 173.750 172.885 0.865 25324 1093 1 2 . 1 1 70 70 SER CA C 70 57.139 57.139 57.773 -0.634 25324 1094 1 2 . 1 1 70 70 SER CB C 70 63.818 63.818 64.575 -0.757 25324 1095 1 2 . 1 1 70 70 SER H H 70 7.693 7.693 7.440 0.253 25324 1096 1 2 . 1 1 71 71 TYR N N 71 123.132 123.132 125.338 -2.206 25324 1097 1 2 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.207 -0.064 25324 1098 1 2 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.425 0.223 25324 1099 1 2 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.302 0.143 25324 1100 1 2 . 1 1 71 71 TYR H H 71 9.326 9.326 9.613 -0.287 25324 1101 1 2 . 1 1 72 72 GLU N N 72 122.396 122.396 122.923 -0.527 25324 1102 1 2 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.727 0.079 25324 1103 1 2 . 1 1 72 72 GLU C C 72 175.698 175.698 175.165 0.533 25324 1104 1 2 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.562 -0.395 25324 1105 1 2 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.691 -1.507 25324 1106 1 2 . 1 1 72 72 GLU H H 72 8.624 8.624 9.122 -0.498 25324 1107 1 2 . 1 1 73 73 VAL N N 73 128.513 128.513 127.696 0.817 25324 1108 1 2 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.691 -0.492 25324 1109 1 2 . 1 1 73 73 VAL C C 73 175.369 175.369 174.816 0.553 25324 1110 1 2 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.101 0.379 25324 1111 1 2 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.157 0.176 25324 1112 1 2 . 1 1 73 73 VAL H H 73 8.564 8.564 9.210 -0.646 25324 1113 1 2 . 1 1 74 74 GLU N N 74 124.842 124.842 126.647 -1.805 25324 1114 1 2 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.098 -0.011 25324 1115 1 2 . 1 1 74 74 GLU C C 74 174.415 174.415 175.068 -0.653 25324 1116 1 2 . 1 1 74 74 GLU CA C 74 54.337 54.337 55.068 -0.731 25324 1117 1 2 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.303 1.854 25324 1118 1 2 . 1 1 74 74 GLU H H 74 9.011 9.011 9.285 -0.274 25324 1119 1 2 . 1 1 75 75 ASN N N 75 116.136 116.136 122.631 -6.495 25324 1120 1 2 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.659 0.480 25324 1121 1 2 . 1 1 75 75 ASN C C 75 172.703 172.703 173.899 -1.196 25324 1122 1 2 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.983 -0.158 25324 1123 1 2 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.251 3.645 25324 1124 1 2 . 1 1 75 75 ASN H H 75 9.424 9.424 9.173 0.251 25324 1125 1 2 . 1 1 76 76 GLN N N 76 120.762 120.762 122.599 -1.837 25324 1126 1 2 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.505 -0.465 25324 1127 1 2 . 1 1 76 76 GLN C C 76 173.113 173.113 174.007 -0.894 25324 1128 1 2 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.365 -0.142 25324 1129 1 2 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.984 -0.636 25324 1130 1 2 . 1 1 76 76 GLN H H 76 7.106 7.106 9.101 -1.995 25324 1131 1 2 . 1 1 77 77 TRP N N 77 125.598 125.598 124.206 1.392 25324 1132 1 2 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.089 0.063 25324 1133 1 2 . 1 1 77 77 TRP C C 77 175.502 175.502 175.767 -0.265 25324 1134 1 2 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.699 -0.935 25324 1135 1 2 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.852 -0.854 25324 1136 1 2 . 1 1 77 77 TRP H H 77 8.181 8.181 8.083 0.098 25324 1137 1 2 . 1 1 78 78 GLY N N 78 107.901 107.901 107.311 0.590 25324 1138 1 2 . 1 1 78 78 GLY C C 78 174.611 174.611 174.787 -0.176 25324 1139 1 2 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.791 0.111 25324 1140 1 2 . 1 1 78 78 GLY H H 78 8.778 8.778 8.563 0.215 25324 1141 1 2 . 1 1 79 79 GLY N N 79 109.844 109.844 107.652 2.192 25324 1142 1 2 . 1 1 79 79 GLY C C 79 173.782 173.782 173.644 0.138 25324 1143 1 2 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.595 -0.802 25324 1144 1 2 . 1 1 79 79 GLY H H 79 8.198 8.198 7.729 0.469 25324 1145 1 2 . 1 1 80 80 ASP N N 80 115.837 115.837 121.398 -5.561 25324 1146 1 2 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.428 -0.187 25324 1147 1 2 . 1 1 80 80 ASP C C 80 177.285 177.285 176.474 0.811 25324 1148 1 2 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.322 0.861 25324 1149 1 2 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.194 -0.671 25324 1150 1 2 . 1 1 80 80 ASP H H 80 8.132 8.132 8.548 -0.416 25324 1151 1 2 . 1 1 81 81 SER N N 81 112.690 112.690 113.681 -0.991 25324 1152 1 2 . 1 1 81 81 SER HA H 81 4.513 4.513 4.345 0.168 25324 1153 1 2 . 1 1 81 81 SER C C 81 173.684 173.684 174.145 -0.461 25324 1154 1 2 . 1 1 81 81 SER CA C 81 57.232 57.232 58.337 -1.105 25324 1155 1 2 . 1 1 81 81 SER CB C 81 63.170 63.170 63.506 -0.336 25324 1156 1 2 . 1 1 81 81 SER H H 81 8.179 8.179 7.972 0.207 25324 1157 1 2 . 1 1 82 82 ALA N N 82 126.310 126.310 125.860 0.450 25324 1158 1 2 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.430 -0.027 25324 1159 1 2 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.391 0.075 25324 1160 1 2 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.624 -0.426 25324 1161 1 2 . 1 1 82 82 ALA H H 82 7.274 7.274 7.113 0.161 25324 1162 1 2 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.234 0.139 25324 1163 1 2 . 1 1 83 83 PRO C C 83 175.378 175.378 175.336 0.042 25324 1164 1 2 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.364 -0.037 25324 1165 1 2 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.438 -0.274 25324 1166 1 2 . 1 1 84 84 TRP N N 84 120.106 120.106 118.153 1.953 25324 1167 1 2 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.425 -0.154 25324 1168 1 2 . 1 1 84 84 TRP C C 84 176.358 176.358 175.984 0.374 25324 1169 1 2 . 1 1 84 84 TRP CA C 84 56.946 56.946 57.047 -0.101 25324 1170 1 2 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.719 -1.003 25324 1171 1 2 . 1 1 84 84 TRP H H 84 8.329 8.329 8.244 0.085 25324 1172 1 2 . 1 1 85 85 HIS N N 85 118.543 118.543 120.189 -1.646 25324 1173 1 2 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.800 0.118 25324 1174 1 2 . 1 1 85 85 HIS C C 85 174.950 174.950 174.747 0.203 25324 1175 1 2 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.463 -0.994 25324 1176 1 2 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.628 -0.955 25324 1177 1 2 . 1 1 85 85 HIS H H 85 9.204 9.204 8.983 0.221 25324 1178 1 2 . 1 1 86 86 SER N N 86 117.803 117.803 115.416 2.387 25324 1179 1 2 . 1 1 86 86 SER HA H 86 4.412 4.412 4.265 0.147 25324 1180 1 2 . 1 1 86 86 SER C C 86 175.691 175.691 174.676 1.015 25324 1181 1 2 . 1 1 86 86 SER CA C 86 60.257 60.257 59.982 0.275 25324 1182 1 2 . 1 1 86 86 SER CB C 86 63.015 63.015 63.822 -0.807 25324 1183 1 2 . 1 1 86 86 SER H H 86 9.168 9.168 8.671 0.497 25324 1184 1 2 . 1 1 87 87 GLY N N 87 115.773 115.773 110.796 4.977 25324 1185 1 2 . 1 1 87 87 GLY C C 87 174.288 174.288 173.357 0.931 25324 1186 1 2 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.145 -0.444 25324 1187 1 2 . 1 1 87 87 GLY H H 87 9.284 9.284 8.811 0.473 25324 1188 1 2 . 1 1 88 88 GLY N N 88 109.162 109.162 108.098 1.064 25324 1189 1 2 . 1 1 88 88 GLY C C 88 171.120 171.120 172.128 -1.008 25324 1190 1 2 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.013 -0.419 25324 1191 1 2 . 1 1 88 88 GLY H H 88 8.054 8.054 7.939 0.115 25324 1192 1 2 . 1 1 89 89 ASN N N 89 117.048 117.048 120.161 -3.113 25324 1193 1 2 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.684 0.354 25324 1194 1 2 . 1 1 89 89 ASN C C 89 175.287 175.287 174.506 0.781 25324 1195 1 2 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.434 -1.569 25324 1196 1 2 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.308 -1.703 25324 1197 1 2 . 1 1 89 89 ASN H H 89 8.516 8.516 8.407 0.109 25324 1198 1 2 . 1 1 90 90 TRP N N 90 125.844 125.844 122.285 3.559 25324 1199 1 2 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.143 0.110 25324 1200 1 2 . 1 1 90 90 TRP C C 90 175.278 175.278 174.715 0.563 25324 1201 1 2 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.917 -0.649 25324 1202 1 2 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.591 -0.633 25324 1203 1 2 . 1 1 90 90 TRP H H 90 9.282 9.282 9.177 0.105 25324 1204 1 2 . 1 1 91 91 ILE N N 91 123.134 123.134 120.890 2.244 25324 1205 1 2 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.786 0.660 25324 1206 1 2 . 1 1 91 91 ILE C C 91 175.489 175.489 175.068 0.421 25324 1207 1 2 . 1 1 91 91 ILE CA C 91 60.826 60.826 61.052 -0.226 25324 1208 1 2 . 1 1 91 91 ILE CB C 91 39.676 39.676 39.533 0.143 25324 1209 1 2 . 1 1 91 91 ILE H H 91 9.318 9.318 8.877 0.441 25324 1210 1 2 . 1 1 92 92 LEU N N 92 123.452 123.452 128.845 -5.393 25324 1211 1 2 . 1 1 92 92 LEU HA H 92 3.942 3.942 4.002 -0.060 25324 1212 1 2 . 1 1 92 92 LEU C C 92 173.620 173.620 174.580 -0.960 25324 1213 1 2 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.839 -1.583 25324 1214 1 2 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.844 1.664 25324 1215 1 2 . 1 1 92 92 LEU H H 92 8.463 8.463 8.717 -0.254 25324 1216 1 2 . 1 1 93 93 GLY N N 93 103.987 103.987 107.892 -3.905 25324 1217 1 2 . 1 1 93 93 GLY C C 93 172.284 172.284 174.098 -1.814 25324 1218 1 2 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.478 -1.978 25324 1219 1 2 . 1 1 93 93 GLY H H 93 2.937 2.937 7.547 -4.610 25324 1220 1 2 . 1 1 94 94 SER N N 94 110.274 110.274 117.136 -6.862 25324 1221 1 2 . 1 1 94 94 SER HA H 94 4.711 4.711 4.554 0.157 25324 1222 1 2 . 1 1 94 94 SER C C 94 174.784 174.784 175.242 -0.458 25324 1223 1 2 . 1 1 94 94 SER CA C 94 56.555 56.555 59.188 -2.633 25324 1224 1 2 . 1 1 94 94 SER CB C 94 65.051 65.051 65.048 0.003 25324 1225 1 2 . 1 1 94 94 SER H H 94 7.919 7.919 8.717 -0.798 25324 1226 1 2 . 1 1 95 95 ARG N N 95 123.020 123.020 122.552 0.468 25324 1227 1 2 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.477 0.195 25324 1228 1 2 . 1 1 95 95 ARG C C 95 176.120 176.120 177.276 -1.156 25324 1229 1 2 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.366 0.008 25324 1230 1 2 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.198 0.650 25324 1231 1 2 . 1 1 95 95 ARG H H 95 9.148 9.148 7.629 1.519 25324 1232 1 2 . 1 1 96 96 GLU N N 96 120.357 120.357 123.525 -3.168 25324 1233 1 2 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.087 0.195 25324 1234 1 2 . 1 1 96 96 GLU C C 96 176.278 176.278 176.416 -0.138 25324 1235 1 2 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.898 -2.368 25324 1236 1 2 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.934 0.219 25324 1237 1 2 . 1 1 96 96 GLU H H 96 8.610 8.610 8.869 -0.259 25324 1238 1 2 . 1 1 97 97 ASN N N 97 117.678 117.678 116.108 1.570 25324 1239 1 2 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.920 -0.308 25324 1240 1 2 . 1 1 97 97 ASN C C 97 173.949 173.949 174.410 -0.461 25324 1241 1 2 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.682 0.333 25324 1242 1 2 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.532 -0.366 25324 1243 1 2 . 1 1 97 97 ASN H H 97 8.533 8.533 8.185 0.348 25324 1244 1 2 . 1 1 98 98 GLN N N 98 118.592 118.592 119.315 -0.723 25324 1245 1 2 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.495 -0.135 25324 1246 1 2 . 1 1 98 98 GLN C C 98 173.116 173.116 173.800 -0.684 25324 1247 1 2 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.258 0.370 25324 1248 1 2 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.351 -0.482 25324 1249 1 2 . 1 1 98 98 GLN H H 98 7.663 7.663 7.418 0.245 25324 1250 1 2 . 1 1 99 99 ASN N N 99 122.855 122.855 121.101 1.754 25324 1251 1 2 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.021 0.114 25324 1252 1 2 . 1 1 99 99 ASN C C 99 175.287 175.287 174.650 0.637 25324 1253 1 2 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.781 0.209 25324 1254 1 2 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.729 -0.238 25324 1255 1 2 . 1 1 99 99 ASN H H 99 8.759 8.759 8.705 0.054 25324 1256 1 2 . 1 1 100 100 VAL N N 100 121.385 121.385 119.284 2.101 25324 1257 1 2 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.961 -0.213 25324 1258 1 2 . 1 1 100 100 VAL C C 100 174.956 174.956 176.808 -1.852 25324 1259 1 2 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.016 0.827 25324 1260 1 2 . 1 1 100 100 VAL CB C 100 32.443 32.443 30.989 1.454 25324 1261 1 2 . 1 1 100 100 VAL H H 100 8.717 8.717 8.201 0.516 25324 1262 1 2 . 1 1 101 101 VAL N N 101 112.736 112.736 120.319 -7.583 25324 1263 1 2 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.416 0.229 25324 1264 1 2 . 1 1 101 101 VAL C C 101 175.577 175.577 174.697 0.880 25324 1265 1 2 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.733 -1.770 25324 1266 1 2 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.326 -0.285 25324 1267 1 2 . 1 1 101 101 VAL H H 101 8.802 8.802 8.915 -0.113 25324 1268 1 2 . 1 1 102 102 ALA N N 102 122.104 122.104 121.408 0.696 25324 1269 1 2 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.168 -0.361 25324 1270 1 2 . 1 1 102 102 ALA C C 102 176.046 176.046 174.927 1.119 25324 1271 1 2 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.778 2.476 25324 1272 1 2 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.304 -0.679 25324 1273 1 2 . 1 1 102 102 ALA H H 102 7.677 7.677 7.769 -0.092 25324 1274 1 2 . 1 1 103 103 ILE N N 103 118.218 118.218 121.589 -3.371 25324 1275 1 2 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.367 -0.340 25324 1276 1 2 . 1 1 103 103 ILE C C 103 173.118 173.118 173.860 -0.742 25324 1277 1 2 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.546 1.681 25324 1278 1 2 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.808 0.663 25324 1279 1 2 . 1 1 103 103 ILE H H 103 8.102 8.102 8.361 -0.259 25324 1280 1 2 . 1 1 104 104 ASN N N 104 125.938 125.938 126.545 -0.607 25324 1281 1 2 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.482 0.204 25324 1282 1 2 . 1 1 104 104 ASN C C 104 174.870 174.870 173.535 1.335 25324 1283 1 2 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.024 0.529 25324 1284 1 2 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.120 -1.268 25324 1285 1 2 . 1 1 104 104 ASN H H 104 8.668 8.668 8.928 -0.260 25324 1286 1 2 . 1 1 105 105 VAL N N 105 114.631 114.631 119.643 -5.012 25324 1287 1 2 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.091 0.114 25324 1288 1 2 . 1 1 105 105 VAL C C 105 174.788 174.788 173.536 1.252 25324 1289 1 2 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.012 -2.033 25324 1290 1 2 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.035 1.006 25324 1291 1 2 . 1 1 105 105 VAL H H 105 8.933 8.933 8.822 0.111 25324 1292 1 2 . 1 1 106 106 GLU N N 106 118.347 118.347 125.277 -6.930 25324 1293 1 2 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.167 -0.087 25324 1294 1 2 . 1 1 106 106 GLU C C 106 174.777 174.777 174.603 0.174 25324 1295 1 2 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.233 -0.267 25324 1296 1 2 . 1 1 106 106 GLU CB C 106 33.643 33.643 33.800 -0.157 25324 1297 1 2 . 1 1 106 106 GLU H H 106 8.814 8.814 8.755 0.059 25324 1298 1 2 . 1 1 107 107 SER N N 107 115.335 115.335 120.546 -5.211 25324 1299 1 2 . 1 1 107 107 SER HA H 107 5.266 5.266 4.855 0.411 25324 1300 1 2 . 1 1 107 107 SER C C 107 175.787 175.787 174.039 1.748 25324 1301 1 2 . 1 1 107 107 SER CA C 107 55.888 55.888 57.203 -1.315 25324 1302 1 2 . 1 1 107 107 SER CB C 107 65.921 65.921 65.114 0.807 25324 1303 1 2 . 1 1 107 107 SER H H 107 8.576 8.576 8.621 -0.045 25324 1304 1 2 . 1 1 108 108 GLY N N 108 117.567 117.567 110.950 6.617 25324 1305 1 2 . 1 1 108 108 GLY C C 108 173.959 173.959 175.024 -1.065 25324 1306 1 2 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.255 -0.579 25324 1307 1 2 . 1 1 108 108 GLY H H 108 9.532 9.532 8.723 0.809 25324 1308 1 2 . 1 1 109 109 ASP N N 109 122.108 122.108 121.825 0.283 25324 1309 1 2 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.752 0.049 25324 1310 1 2 . 1 1 109 109 ASP C C 109 176.203 176.203 175.845 0.358 25324 1311 1 2 . 1 1 109 109 ASP CA C 109 52.134 52.134 54.323 -2.189 25324 1312 1 2 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.237 -1.895 25324 1313 1 2 . 1 1 109 109 ASP H H 109 8.605 8.605 7.719 0.886 25324 1314 1 2 . 1 1 110 110 ASP N N 110 116.197 116.197 117.063 -0.866 25324 1315 1 2 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.364 -0.142 25324 1316 1 2 . 1 1 110 110 ASP C C 110 175.951 175.951 176.177 -0.226 25324 1317 1 2 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.130 0.068 25324 1318 1 2 . 1 1 110 110 ASP CB C 110 38.630 38.630 39.436 -0.806 25324 1319 1 2 . 1 1 110 110 ASP H H 110 9.087 9.087 8.532 0.555 25324 1320 1 2 . 1 1 111 111 GLY N N 111 103.841 103.841 103.472 0.369 25324 1321 1 2 . 1 1 111 111 GLY C C 111 173.924 173.924 175.290 -1.366 25324 1322 1 2 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.100 0.063 25324 1323 1 2 . 1 1 111 111 GLY H H 111 8.930 8.930 8.030 0.900 25324 1324 1 2 . 1 1 112 112 GLN N N 112 121.626 121.626 121.345 0.281 25324 1325 1 2 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.148 -0.078 25324 1326 1 2 . 1 1 112 112 GLN C C 112 176.431 176.431 174.846 1.585 25324 1327 1 2 . 1 1 112 112 GLN CA C 112 58.273 58.273 59.027 -0.754 25324 1328 1 2 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.497 -1.804 25324 1329 1 2 . 1 1 112 112 GLN H H 112 7.351 7.351 7.804 -0.453 25324 1330 1 2 . 1 1 113 113 THR N N 113 112.322 112.322 108.940 3.382 25324 1331 1 2 . 1 1 113 113 THR HA H 113 5.331 5.331 5.186 0.145 25324 1332 1 2 . 1 1 113 113 THR C C 113 174.452 174.452 172.797 1.655 25324 1333 1 2 . 1 1 113 113 THR CA C 113 59.739 59.739 59.951 -0.212 25324 1334 1 2 . 1 1 113 113 THR CB C 113 71.773 71.773 71.495 0.278 25324 1335 1 2 . 1 1 113 113 THR H H 113 10.053 10.053 7.700 2.353 25324 1336 1 2 . 1 1 114 114 LEU N N 114 122.083 122.083 124.945 -2.862 25324 1337 1 2 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.668 -0.087 25324 1338 1 2 . 1 1 114 114 LEU C C 114 175.113 175.113 174.950 0.163 25324 1339 1 2 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.675 -0.770 25324 1340 1 2 . 1 1 114 114 LEU CB C 114 47.033 47.033 43.126 3.907 25324 1341 1 2 . 1 1 114 114 LEU H H 114 8.978 8.978 9.027 -0.049 25324 1342 1 2 . 1 1 115 115 ASN N N 115 118.846 118.846 122.203 -3.357 25324 1343 1 2 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.840 -0.070 25324 1344 1 2 . 1 1 115 115 ASN C C 115 174.788 174.788 175.263 -0.475 25324 1345 1 2 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.823 0.519 25324 1346 1 2 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.680 0.734 25324 1347 1 2 . 1 1 115 115 ASN H H 115 8.837 8.837 8.028 0.809 25324 1348 1 2 . 1 1 116 116 GLY N N 116 109.661 109.661 109.291 0.370 25324 1349 1 2 . 1 1 116 116 GLY C C 116 172.452 172.452 172.464 -0.012 25324 1350 1 2 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.171 0.300 25324 1351 1 2 . 1 1 116 116 GLY H H 116 8.625 8.625 8.785 -0.160 25324 1352 1 2 . 1 1 117 117 THR N N 117 120.009 120.009 114.518 5.491 25324 1353 1 2 . 1 1 117 117 THR HA H 117 5.556 5.556 5.503 0.053 25324 1354 1 2 . 1 1 117 117 THR C C 117 171.619 171.619 173.394 -1.775 25324 1355 1 2 . 1 1 117 117 THR CA C 117 59.373 59.373 60.260 -0.887 25324 1356 1 2 . 1 1 117 117 THR CB C 117 72.777 72.777 72.472 0.304 25324 1357 1 2 . 1 1 117 117 THR H H 117 8.911 8.911 9.024 -0.113 25324 1358 1 2 . 1 1 118 118 MET N N 118 115.550 115.550 118.606 -3.056 25324 1359 1 2 . 1 1 118 118 MET HA H 118 4.889 4.889 5.336 -0.447 25324 1360 1 2 . 1 1 118 118 MET C C 118 172.707 172.707 174.027 -1.320 25324 1361 1 2 . 1 1 118 118 MET CA C 118 54.714 54.714 54.353 0.361 25324 1362 1 2 . 1 1 118 118 MET CB C 118 33.663 33.663 37.368 -3.705 25324 1363 1 2 . 1 1 118 118 MET H H 118 9.159 9.159 9.446 -0.287 25324 1364 1 2 . 1 1 119 119 THR N N 119 113.716 113.716 117.479 -3.763 25324 1365 1 2 . 1 1 119 119 THR HA H 119 4.682 4.682 5.287 -0.605 25324 1366 1 2 . 1 1 119 119 THR C C 119 173.952 173.952 173.719 0.233 25324 1367 1 2 . 1 1 119 119 THR CA C 119 61.395 61.395 61.609 -0.214 25324 1368 1 2 . 1 1 119 119 THR CB C 119 71.746 71.746 71.365 0.381 25324 1369 1 2 . 1 1 119 119 THR H H 119 8.685 8.685 8.848 -0.163 25324 1370 1 2 . 1 1 120 120 TYR N N 120 129.153 129.153 125.670 3.483 25324 1371 1 2 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.948 -0.148 25324 1372 1 2 . 1 1 120 120 TYR C C 120 175.214 175.214 177.582 -2.368 25324 1373 1 2 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.129 0.748 25324 1374 1 2 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.870 0.632 25324 1375 1 2 . 1 1 120 120 TYR H H 120 10.107 10.107 8.220 1.887 25324 1376 1 2 . 1 1 121 121 ALA N N 121 119.947 119.947 125.443 -5.496 25324 1377 1 2 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.132 -0.128 25324 1378 1 2 . 1 1 121 121 ALA C C 121 178.456 178.456 177.299 1.157 25324 1379 1 2 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.476 -0.520 25324 1380 1 2 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.841 -0.131 25324 1381 1 2 . 1 1 121 121 ALA H H 121 8.704 8.704 8.649 0.055 25324 1382 1 2 . 1 1 122 122 GLY N N 122 111.186 111.186 104.038 7.148 25324 1383 1 2 . 1 1 122 122 GLY C C 122 173.949 173.949 173.936 0.013 25324 1384 1 2 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.056 -0.054 25324 1385 1 2 . 1 1 122 122 GLY H H 122 8.792 8.792 8.384 0.408 25324 1386 1 2 . 1 1 123 123 GLU N N 123 120.099 120.099 121.385 -1.286 25324 1387 1 2 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.551 0.154 25324 1388 1 2 . 1 1 123 123 GLU C C 123 175.912 175.912 176.706 -0.794 25324 1389 1 2 . 1 1 123 123 GLU CA C 123 54.414 54.414 55.975 -1.561 25324 1390 1 2 . 1 1 123 123 GLU CB C 123 32.784 32.784 31.342 1.442 25324 1391 1 2 . 1 1 123 123 GLU H H 123 8.072 8.072 7.784 0.288 25324 1392 1 2 . 1 1 124 124 GLY N N 124 105.303 105.303 108.244 -2.941 25324 1393 1 2 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.297 -0.496 25324 1394 1 2 . 1 1 124 124 GLY H H 124 7.939 7.939 7.612 0.327 25324 1395 1 2 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.935 -0.000 25324 1396 1 2 . 1 1 125 125 PRO C C 125 177.788 177.788 176.439 1.349 25324 1397 1 2 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.222 -0.091 25324 1398 1 2 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.387 0.472 25324 1399 1 2 . 1 1 126 126 ILE N N 126 117.387 117.387 119.911 -2.524 25324 1400 1 2 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.709 0.190 25324 1401 1 2 . 1 1 126 126 ILE C C 126 175.625 175.625 175.001 0.624 25324 1402 1 2 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.076 0.377 25324 1403 1 2 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.568 0.980 25324 1404 1 2 . 1 1 126 126 ILE H H 126 9.599 9.599 8.943 0.656 25324 1405 1 2 . 1 1 127 127 GLY N N 127 106.753 106.753 108.003 -1.250 25324 1406 1 2 . 1 1 127 127 GLY C C 127 173.627 173.627 172.602 1.025 25324 1407 1 2 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.632 1.651 25324 1408 1 2 . 1 1 127 127 GLY H H 127 8.840 8.840 8.762 0.078 25324 1409 1 2 . 1 1 128 128 PHE N N 128 124.826 124.826 126.431 -1.605 25324 1410 1 2 . 1 1 128 128 PHE HA H 128 4.944 4.944 4.908 0.036 25324 1411 1 2 . 1 1 128 128 PHE C C 128 173.087 173.087 173.425 -0.338 25324 1412 1 2 . 1 1 128 128 PHE CA C 128 57.009 57.009 57.021 -0.012 25324 1413 1 2 . 1 1 128 128 PHE CB C 128 43.160 43.160 42.873 0.287 25324 1414 1 2 . 1 1 128 128 PHE H H 128 8.924 8.924 9.180 -0.256 25324 1415 1 2 . 1 1 129 129 LYS N N 129 131.518 131.518 128.781 2.737 25324 1416 1 2 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.794 0.089 25324 1417 1 2 . 1 1 129 129 LYS C C 129 173.863 173.863 174.022 -0.159 25324 1418 1 2 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.677 1.058 25324 1419 1 2 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.302 -0.581 25324 1420 1 2 . 1 1 129 129 LYS H H 129 8.201 8.201 8.122 0.079 25324 1421 1 2 . 1 1 130 130 GLY N N 130 114.030 114.030 113.718 0.312 25324 1422 1 2 . 1 1 130 130 GLY C C 130 171.951 171.951 172.660 -0.709 25324 1423 1 2 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.730 0.057 25324 1424 1 2 . 1 1 130 130 GLY H H 130 9.325 9.325 8.875 0.450 25324 1425 1 2 . 1 1 131 131 THR N N 131 120.583 120.583 121.257 -0.674 25324 1426 1 2 . 1 1 131 131 THR HA H 131 4.939 4.939 4.975 -0.036 25324 1427 1 2 . 1 1 131 131 THR C C 131 173.118 173.118 174.148 -1.030 25324 1428 1 2 . 1 1 131 131 THR CA C 131 61.266 61.266 61.254 0.012 25324 1429 1 2 . 1 1 131 131 THR CB C 131 70.392 70.392 72.515 -2.123 25324 1430 1 2 . 1 1 131 131 THR H H 131 8.916 8.916 9.012 -0.096 25324 1431 1 2 . 1 1 132 132 LEU N N 132 130.774 130.774 127.568 3.206 25324 1432 1 2 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.818 -0.318 25324 1433 1 2 . 1 1 132 132 LEU C C 132 176.574 176.574 177.756 -1.182 25324 1434 1 2 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.787 0.400 25324 1435 1 2 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.738 0.709 25324 1436 1 2 . 1 1 132 132 LEU H H 132 8.527 8.527 8.360 0.168 25324 1437 1 3 . 1 1 3 3 LEU N N 3 123.202 123.202 123.186 0.016 25324 1438 1 3 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.145 0.012 25324 1439 1 3 . 1 1 3 3 LEU C C 3 175.786 175.786 175.084 0.702 25324 1440 1 3 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.679 0.605 25324 1441 1 3 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.588 -0.258 25324 1442 1 3 . 1 1 3 3 LEU H H 3 8.711 8.711 8.746 -0.035 25324 1443 1 3 . 1 1 4 4 TYR N N 4 120.906 120.906 126.173 -5.267 25324 1444 1 3 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.153 -0.129 25324 1445 1 3 . 1 1 4 4 TYR C C 4 175.953 175.953 175.124 0.829 25324 1446 1 3 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.383 -0.007 25324 1447 1 3 . 1 1 4 4 TYR CB C 4 41.655 41.655 41.856 -0.201 25324 1448 1 3 . 1 1 4 4 TYR H H 4 9.142 9.142 9.540 -0.398 25324 1449 1 3 . 1 1 5 5 ASN N N 5 120.496 120.496 121.375 -0.879 25324 1450 1 3 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.858 0.258 25324 1451 1 3 . 1 1 5 5 ASN C C 5 174.953 174.953 173.867 1.086 25324 1452 1 3 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.572 -0.625 25324 1453 1 3 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.034 -1.143 25324 1454 1 3 . 1 1 5 5 ASN H H 5 8.787 8.787 8.974 -0.187 25324 1455 1 3 . 1 1 6 6 VAL N N 6 127.428 127.428 124.575 2.853 25324 1456 1 3 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.382 -0.020 25324 1457 1 3 . 1 1 6 6 VAL C C 6 174.955 174.955 174.350 0.605 25324 1458 1 3 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.966 0.467 25324 1459 1 3 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.529 -0.198 25324 1460 1 3 . 1 1 6 6 VAL H H 6 8.806 8.806 8.409 0.397 25324 1461 1 3 . 1 1 7 7 GLU N N 7 124.355 124.355 126.447 -2.092 25324 1462 1 3 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.942 0.040 25324 1463 1 3 . 1 1 7 7 GLU C C 7 174.551 174.551 174.742 -0.191 25324 1464 1 3 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.620 -0.831 25324 1465 1 3 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.324 1.243 25324 1466 1 3 . 1 1 7 7 GLU H H 7 8.800 8.800 8.803 -0.003 25324 1467 1 3 . 1 1 8 8 ASN N N 8 116.231 116.231 121.454 -5.223 25324 1468 1 3 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.810 0.231 25324 1469 1 3 . 1 1 8 8 ASN C C 8 172.709 172.709 173.713 -1.004 25324 1470 1 3 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.469 -0.853 25324 1471 1 3 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.073 2.512 25324 1472 1 3 . 1 1 8 8 ASN H H 8 9.320 9.320 9.223 0.097 25324 1473 1 3 . 1 1 9 9 GLN N N 9 120.762 120.762 123.060 -2.298 25324 1474 1 3 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.444 -0.270 25324 1475 1 3 . 1 1 9 9 GLN C C 9 173.454 173.454 173.777 -0.323 25324 1476 1 3 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.114 -0.154 25324 1477 1 3 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.703 -1.012 25324 1478 1 3 . 1 1 9 9 GLN H H 9 6.887 6.887 8.561 -1.674 25324 1479 1 3 . 1 1 10 10 TRP N N 10 127.775 127.775 124.039 3.736 25324 1480 1 3 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.104 -0.116 25324 1481 1 3 . 1 1 10 10 TRP C C 10 175.281 175.281 175.782 -0.501 25324 1482 1 3 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.460 -0.167 25324 1483 1 3 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.398 -1.657 25324 1484 1 3 . 1 1 10 10 TRP H H 10 8.518 8.518 7.823 0.695 25324 1485 1 3 . 1 1 11 11 GLY N N 11 107.838 107.838 110.469 -2.631 25324 1486 1 3 . 1 1 11 11 GLY C C 11 174.733 174.733 174.139 0.594 25324 1487 1 3 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.808 0.028 25324 1488 1 3 . 1 1 11 11 GLY H H 11 8.461 8.461 8.877 -0.416 25324 1489 1 3 . 1 1 12 12 GLY N N 12 109.696 109.696 107.512 2.184 25324 1490 1 3 . 1 1 12 12 GLY C C 12 174.133 174.133 175.153 -1.020 25324 1491 1 3 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.340 -0.550 25324 1492 1 3 . 1 1 12 12 GLY H H 12 8.138 8.138 7.505 0.633 25324 1493 1 3 . 1 1 13 13 SER N N 13 111.308 111.308 115.346 -4.038 25324 1494 1 3 . 1 1 13 13 SER HA H 13 4.092 4.092 4.057 0.035 25324 1495 1 3 . 1 1 13 13 SER C C 13 175.622 175.622 175.658 -0.036 25324 1496 1 3 . 1 1 13 13 SER CA C 13 60.494 60.494 60.794 -0.300 25324 1497 1 3 . 1 1 13 13 SER CB C 13 63.028 63.028 63.164 -0.136 25324 1498 1 3 . 1 1 13 13 SER H H 13 8.215 8.215 8.659 -0.444 25324 1499 1 3 . 1 1 14 14 SER N N 14 115.290 115.290 115.605 -0.315 25324 1500 1 3 . 1 1 14 14 SER HA H 14 4.566 4.566 4.307 0.259 25324 1501 1 3 . 1 1 14 14 SER C C 14 173.532 173.532 174.099 -0.567 25324 1502 1 3 . 1 1 14 14 SER CA C 14 57.317 57.317 59.332 -2.015 25324 1503 1 3 . 1 1 14 14 SER CB C 14 63.230 63.230 63.492 -0.262 25324 1504 1 3 . 1 1 14 14 SER H H 14 8.213 8.213 8.283 -0.070 25324 1505 1 3 . 1 1 15 15 ALA N N 15 126.470 126.470 124.896 1.574 25324 1506 1 3 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.568 -0.165 25324 1507 1 3 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.205 1.259 25324 1508 1 3 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.665 -0.436 25324 1509 1 3 . 1 1 15 15 ALA H H 15 7.308 7.308 7.399 -0.091 25324 1510 1 3 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.296 0.113 25324 1511 1 3 . 1 1 16 16 PRO C C 16 175.627 175.627 175.320 0.307 25324 1512 1 3 . 1 1 16 16 PRO CA C 16 62.392 62.392 61.937 0.455 25324 1513 1 3 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.861 -0.724 25324 1514 1 3 . 1 1 17 17 TRP N N 17 120.228 120.228 117.309 2.919 25324 1515 1 3 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.424 -0.106 25324 1516 1 3 . 1 1 17 17 TRP C C 17 175.951 175.951 176.035 -0.084 25324 1517 1 3 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.983 -0.067 25324 1518 1 3 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.486 -1.077 25324 1519 1 3 . 1 1 17 17 TRP H H 17 8.380 8.380 8.076 0.304 25324 1520 1 3 . 1 1 18 18 ASN N N 18 120.663 120.663 123.004 -2.341 25324 1521 1 3 . 1 1 18 18 ASN HA H 18 5.086 5.086 4.975 0.111 25324 1522 1 3 . 1 1 18 18 ASN C C 18 174.793 174.793 174.122 0.671 25324 1523 1 3 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.577 -0.976 25324 1524 1 3 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.822 1.826 25324 1525 1 3 . 1 1 18 18 ASN H H 18 9.094 9.094 8.894 0.200 25324 1526 1 3 . 1 1 19 19 GLU N N 19 122.202 122.202 125.955 -3.753 25324 1527 1 3 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.429 -0.290 25324 1528 1 3 . 1 1 19 19 GLU C C 19 176.869 176.869 176.856 0.013 25324 1529 1 3 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.080 1.520 25324 1530 1 3 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.910 -0.528 25324 1531 1 3 . 1 1 19 19 GLU H H 19 9.013 9.013 9.051 -0.038 25324 1532 1 3 . 1 1 20 20 GLY N N 20 112.893 112.893 115.310 -2.417 25324 1533 1 3 . 1 1 20 20 GLY C C 20 174.878 174.878 172.949 1.929 25324 1534 1 3 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.748 0.246 25324 1535 1 3 . 1 1 20 20 GLY H H 20 8.926 8.926 8.382 0.544 25324 1536 1 3 . 1 1 21 21 GLY N N 21 110.354 110.354 107.139 3.215 25324 1537 1 3 . 1 1 21 21 GLY C C 21 171.623 171.623 171.869 -0.246 25324 1538 1 3 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.226 -0.828 25324 1539 1 3 . 1 1 21 21 GLY H H 21 8.258 8.258 7.604 0.654 25324 1540 1 3 . 1 1 22 22 GLN N N 22 117.541 117.541 117.372 0.169 25324 1541 1 3 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.856 0.821 25324 1542 1 3 . 1 1 22 22 GLN C C 22 175.957 175.957 173.850 2.107 25324 1543 1 3 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.861 0.083 25324 1544 1 3 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.663 -1.578 25324 1545 1 3 . 1 1 22 22 GLN H H 22 8.564 8.564 8.443 0.121 25324 1546 1 3 . 1 1 23 23 TRP N N 23 127.208 127.208 119.815 7.393 25324 1547 1 3 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.104 0.095 25324 1548 1 3 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.791 -0.260 25324 1549 1 3 . 1 1 23 23 TRP CB C 23 31.683 31.683 33.152 -1.469 25324 1550 1 3 . 1 1 23 23 TRP H H 23 9.347 9.347 9.187 0.160 25324 1551 1 3 . 1 1 24 24 GLU N N 24 123.504 123.504 121.087 2.417 25324 1552 1 3 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.418 0.090 25324 1553 1 3 . 1 1 24 24 GLU C C 24 174.222 174.222 175.374 -1.152 25324 1554 1 3 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.183 0.408 25324 1555 1 3 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.634 -2.019 25324 1556 1 3 . 1 1 24 24 GLU H H 24 9.296 9.296 8.628 0.668 25324 1557 1 3 . 1 1 25 25 ILE N N 25 123.447 123.447 126.686 -3.239 25324 1558 1 3 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.531 -0.095 25324 1559 1 3 . 1 1 25 25 ILE C C 25 175.790 175.790 174.661 1.129 25324 1560 1 3 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.852 -0.225 25324 1561 1 3 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.061 0.891 25324 1562 1 3 . 1 1 25 25 ILE H H 25 8.635 8.635 8.312 0.323 25324 1563 1 3 . 1 1 26 26 GLY N N 26 111.544 111.544 114.384 -2.840 25324 1564 1 3 . 1 1 26 26 GLY C C 26 172.122 172.122 175.042 -2.920 25324 1565 1 3 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.686 -0.608 25324 1566 1 3 . 1 1 26 26 GLY H H 26 3.381 3.381 6.978 -3.597 25324 1567 1 3 . 1 1 27 27 SER N N 27 112.279 112.279 115.501 -3.222 25324 1568 1 3 . 1 1 27 27 SER HA H 27 4.876 4.876 4.104 0.772 25324 1569 1 3 . 1 1 27 27 SER C C 27 174.113 174.113 176.548 -2.435 25324 1570 1 3 . 1 1 27 27 SER CA C 27 56.954 56.954 60.689 -3.735 25324 1571 1 3 . 1 1 27 27 SER CB C 27 64.554 64.554 63.284 1.270 25324 1572 1 3 . 1 1 27 27 SER H H 27 8.212 8.212 8.158 0.054 25324 1573 1 3 . 1 1 28 28 ARG N N 28 120.872 120.872 122.276 -1.404 25324 1574 1 3 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.151 0.612 25324 1575 1 3 . 1 1 28 28 ARG C C 28 176.119 176.119 177.826 -1.707 25324 1576 1 3 . 1 1 28 28 ARG CA C 28 55.117 55.117 59.197 -4.080 25324 1577 1 3 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.165 1.665 25324 1578 1 3 . 1 1 28 28 ARG H H 28 7.849 7.849 8.972 -1.123 25324 1579 1 3 . 1 1 29 29 SER N N 29 118.985 118.985 109.305 9.680 25324 1580 1 3 . 1 1 29 29 SER HA H 29 4.192 4.192 4.148 0.044 25324 1581 1 3 . 1 1 29 29 SER C C 29 174.622 174.622 174.055 0.567 25324 1582 1 3 . 1 1 29 29 SER CA C 29 60.072 60.072 61.168 -1.096 25324 1583 1 3 . 1 1 29 29 SER CB C 29 62.876 62.876 61.610 1.266 25324 1584 1 3 . 1 1 29 29 SER H H 29 8.892 8.892 8.792 0.100 25324 1585 1 3 . 1 1 30 30 ASP N N 30 117.632 117.632 120.734 -3.102 25324 1586 1 3 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.418 0.200 25324 1587 1 3 . 1 1 30 30 ASP C C 30 175.101 175.101 175.949 -0.848 25324 1588 1 3 . 1 1 30 30 ASP CA C 30 53.052 53.052 54.977 -1.925 25324 1589 1 3 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.242 -0.719 25324 1590 1 3 . 1 1 30 30 ASP H H 30 8.441 8.441 8.239 0.202 25324 1591 1 3 . 1 1 31 31 GLN N N 31 118.273 118.273 118.929 -0.656 25324 1592 1 3 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.272 0.213 25324 1593 1 3 . 1 1 31 31 GLN C C 31 173.453 173.453 174.175 -0.722 25324 1594 1 3 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.048 -0.180 25324 1595 1 3 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.533 2.716 25324 1596 1 3 . 1 1 31 31 GLN H H 31 7.029 7.029 7.561 -0.532 25324 1597 1 3 . 1 1 32 32 ASN N N 32 120.865 120.865 122.557 -1.692 25324 1598 1 3 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.830 0.290 25324 1599 1 3 . 1 1 32 32 ASN C C 32 175.198 175.198 174.256 0.942 25324 1600 1 3 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.803 -0.934 25324 1601 1 3 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.067 -0.437 25324 1602 1 3 . 1 1 32 32 ASN H H 32 8.713 8.713 8.527 0.186 25324 1603 1 3 . 1 1 33 33 VAL N N 33 122.111 122.111 122.594 -0.483 25324 1604 1 3 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.427 -0.722 25324 1605 1 3 . 1 1 33 33 VAL C C 33 174.950 174.950 176.210 -1.260 25324 1606 1 3 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.184 1.663 25324 1607 1 3 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.784 -0.434 25324 1608 1 3 . 1 1 33 33 VAL H H 33 8.542 8.542 8.656 -0.114 25324 1609 1 3 . 1 1 34 34 VAL N N 34 113.282 113.282 119.712 -6.430 25324 1610 1 3 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.457 0.188 25324 1611 1 3 . 1 1 34 34 VAL C C 34 175.574 175.574 174.828 0.746 25324 1612 1 3 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.398 -1.424 25324 1613 1 3 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.748 0.281 25324 1614 1 3 . 1 1 34 34 VAL H H 34 8.744 8.744 8.778 -0.034 25324 1615 1 3 . 1 1 35 35 ALA N N 35 122.102 122.102 121.926 0.176 25324 1616 1 3 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.315 -0.512 25324 1617 1 3 . 1 1 35 35 ALA C C 35 175.947 175.947 175.009 0.938 25324 1618 1 3 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.755 2.495 25324 1619 1 3 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.621 -0.993 25324 1620 1 3 . 1 1 35 35 ALA H H 35 7.677 7.677 7.801 -0.124 25324 1621 1 3 . 1 1 36 36 ILE N N 36 118.005 118.005 121.119 -3.114 25324 1622 1 3 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.346 -0.318 25324 1623 1 3 . 1 1 36 36 ILE C C 36 173.116 173.116 173.929 -0.813 25324 1624 1 3 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.069 1.113 25324 1625 1 3 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.766 0.719 25324 1626 1 3 . 1 1 36 36 ILE H H 36 8.126 8.126 8.942 -0.816 25324 1627 1 3 . 1 1 37 37 ASN N N 37 125.632 125.632 126.121 -0.489 25324 1628 1 3 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.837 -0.156 25324 1629 1 3 . 1 1 37 37 ASN C C 37 174.854 174.854 173.599 1.255 25324 1630 1 3 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.128 0.402 25324 1631 1 3 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.741 -2.888 25324 1632 1 3 . 1 1 37 37 ASN H H 37 8.577 8.577 8.793 -0.216 25324 1633 1 3 . 1 1 38 38 VAL N N 38 114.223 114.223 118.886 -4.663 25324 1634 1 3 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.756 0.447 25324 1635 1 3 . 1 1 38 38 VAL C C 38 174.854 174.854 173.406 1.448 25324 1636 1 3 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.091 -2.111 25324 1637 1 3 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.445 0.599 25324 1638 1 3 . 1 1 38 38 VAL H H 38 8.874 8.874 8.602 0.272 25324 1639 1 3 . 1 1 39 39 GLU N N 39 118.277 118.277 123.165 -4.888 25324 1640 1 3 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.251 -0.169 25324 1641 1 3 . 1 1 39 39 GLU C C 39 174.548 174.548 175.087 -0.539 25324 1642 1 3 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.991 1.002 25324 1643 1 3 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.406 -0.828 25324 1644 1 3 . 1 1 39 39 GLU H H 39 8.761 8.761 9.204 -0.443 25324 1645 1 3 . 1 1 40 40 SER N N 40 114.960 114.960 119.960 -5.000 25324 1646 1 3 . 1 1 40 40 SER HA H 40 5.265 5.265 4.910 0.355 25324 1647 1 3 . 1 1 40 40 SER C C 40 175.783 175.783 175.392 0.391 25324 1648 1 3 . 1 1 40 40 SER CA C 40 55.880 55.880 57.511 -1.631 25324 1649 1 3 . 1 1 40 40 SER CB C 40 65.911 65.911 63.795 2.115 25324 1650 1 3 . 1 1 40 40 SER H H 40 8.500 8.500 8.448 0.052 25324 1651 1 3 . 1 1 41 41 GLY N N 41 117.567 117.567 110.293 7.274 25324 1652 1 3 . 1 1 41 41 GLY C C 41 174.119 174.119 174.346 -0.227 25324 1653 1 3 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.338 -0.650 25324 1654 1 3 . 1 1 41 41 GLY H H 41 9.533 9.533 8.913 0.620 25324 1655 1 3 . 1 1 42 42 ASP N N 42 122.141 122.141 121.075 1.066 25324 1656 1 3 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.812 -0.012 25324 1657 1 3 . 1 1 42 42 ASP C C 42 176.121 176.121 175.637 0.484 25324 1658 1 3 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.364 -1.218 25324 1659 1 3 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.552 -3.198 25324 1660 1 3 . 1 1 42 42 ASP H H 42 8.644 8.644 7.740 0.904 25324 1661 1 3 . 1 1 43 43 ASP N N 43 116.025 116.025 121.072 -5.047 25324 1662 1 3 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.517 -0.288 25324 1663 1 3 . 1 1 43 43 ASP C C 43 176.018 176.018 176.098 -0.080 25324 1664 1 3 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.611 0.638 25324 1665 1 3 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.002 -0.443 25324 1666 1 3 . 1 1 43 43 ASP H H 43 9.111 9.111 8.610 0.501 25324 1667 1 3 . 1 1 44 44 GLY N N 44 104.263 104.263 106.835 -2.572 25324 1668 1 3 . 1 1 44 44 GLY C C 44 173.922 173.922 174.899 -0.977 25324 1669 1 3 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.453 -0.152 25324 1670 1 3 . 1 1 44 44 GLY H H 44 9.063 9.063 7.856 1.207 25324 1671 1 3 . 1 1 45 45 GLN N N 45 121.691 121.691 118.516 3.175 25324 1672 1 3 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.226 -0.140 25324 1673 1 3 . 1 1 45 45 GLN C C 45 176.284 176.284 175.590 0.694 25324 1674 1 3 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.136 -0.018 25324 1675 1 3 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.041 -1.367 25324 1676 1 3 . 1 1 45 45 GLN H H 45 7.356 7.356 8.187 -0.831 25324 1677 1 3 . 1 1 46 46 THR N N 46 111.843 111.843 113.007 -1.164 25324 1678 1 3 . 1 1 46 46 THR HA H 46 5.355 5.355 5.364 -0.009 25324 1679 1 3 . 1 1 46 46 THR C C 46 174.451 174.451 172.915 1.536 25324 1680 1 3 . 1 1 46 46 THR CA C 46 59.644 59.644 60.337 -0.693 25324 1681 1 3 . 1 1 46 46 THR CB C 46 72.714 72.714 69.862 2.852 25324 1682 1 3 . 1 1 46 46 THR H H 46 10.123 10.123 7.597 2.526 25324 1683 1 3 . 1 1 47 47 LEU N N 47 119.302 119.302 129.239 -9.937 25324 1684 1 3 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.822 -0.015 25324 1685 1 3 . 1 1 47 47 LEU C C 47 175.487 175.487 175.368 0.119 25324 1686 1 3 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.756 -0.686 25324 1687 1 3 . 1 1 47 47 LEU CB C 47 48.003 48.003 43.592 4.411 25324 1688 1 3 . 1 1 47 47 LEU H H 47 8.364 8.364 8.952 -0.588 25324 1689 1 3 . 1 1 48 48 ASN N N 48 116.844 116.844 120.636 -3.792 25324 1690 1 3 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.829 -0.100 25324 1691 1 3 . 1 1 48 48 ASN C C 48 174.460 174.460 174.879 -0.419 25324 1692 1 3 . 1 1 48 48 ASN CA C 48 52.739 52.739 52.082 0.657 25324 1693 1 3 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.312 1.101 25324 1694 1 3 . 1 1 48 48 ASN H H 48 8.748 8.748 9.071 -0.323 25324 1695 1 3 . 1 1 49 49 GLY N N 49 109.417 109.417 110.358 -0.941 25324 1696 1 3 . 1 1 49 49 GLY C C 49 172.126 172.126 172.025 0.101 25324 1697 1 3 . 1 1 49 49 GLY CA C 49 46.491 46.491 45.871 0.620 25324 1698 1 3 . 1 1 49 49 GLY H H 49 8.744 8.744 9.104 -0.360 25324 1699 1 3 . 1 1 50 50 THR N N 50 119.162 119.162 117.108 2.054 25324 1700 1 3 . 1 1 50 50 THR HA H 50 5.556 5.556 5.314 0.242 25324 1701 1 3 . 1 1 50 50 THR C C 50 171.790 171.790 173.325 -1.535 25324 1702 1 3 . 1 1 50 50 THR CA C 50 59.371 59.371 61.676 -2.305 25324 1703 1 3 . 1 1 50 50 THR CB C 50 72.799 72.799 71.762 1.037 25324 1704 1 3 . 1 1 50 50 THR H H 50 8.799 8.799 8.841 -0.042 25324 1705 1 3 . 1 1 51 51 MET N N 51 115.232 115.232 125.523 -10.291 25324 1706 1 3 . 1 1 51 51 MET HA H 51 4.886 4.886 4.770 0.116 25324 1707 1 3 . 1 1 51 51 MET C C 51 172.708 172.708 174.733 -2.025 25324 1708 1 3 . 1 1 51 51 MET CA C 51 54.722 54.722 54.787 -0.065 25324 1709 1 3 . 1 1 51 51 MET CB C 51 34.557 34.557 36.258 -1.701 25324 1710 1 3 . 1 1 51 51 MET H H 51 9.062 9.062 9.039 0.023 25324 1711 1 3 . 1 1 52 52 THR N N 52 113.697 113.697 119.116 -5.419 25324 1712 1 3 . 1 1 52 52 THR HA H 52 4.682 4.682 4.687 -0.005 25324 1713 1 3 . 1 1 52 52 THR C C 52 173.952 173.952 173.667 0.285 25324 1714 1 3 . 1 1 52 52 THR CA C 52 61.395 61.395 61.509 -0.114 25324 1715 1 3 . 1 1 52 52 THR CB C 52 71.734 71.734 70.052 1.682 25324 1716 1 3 . 1 1 52 52 THR H H 52 8.685 8.685 8.836 -0.151 25324 1717 1 3 . 1 1 53 53 TYR N N 53 129.086 129.086 126.700 2.386 25324 1718 1 3 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.773 0.027 25324 1719 1 3 . 1 1 53 53 TYR C C 53 175.214 175.214 176.501 -1.287 25324 1720 1 3 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.725 1.156 25324 1721 1 3 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.387 1.125 25324 1722 1 3 . 1 1 53 53 TYR H H 53 10.112 10.112 8.371 1.741 25324 1723 1 3 . 1 1 54 54 ALA N N 54 119.947 119.947 123.897 -3.950 25324 1724 1 3 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.248 -0.246 25324 1725 1 3 . 1 1 54 54 ALA C C 54 178.285 178.285 178.077 0.208 25324 1726 1 3 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.261 0.710 25324 1727 1 3 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.188 0.529 25324 1728 1 3 . 1 1 54 54 ALA H H 54 8.704 8.704 8.743 -0.039 25324 1729 1 3 . 1 1 55 55 GLY N N 55 110.940 110.940 112.212 -1.272 25324 1730 1 3 . 1 1 55 55 GLY C C 55 173.903 173.903 174.065 -0.162 25324 1731 1 3 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.102 -0.086 25324 1732 1 3 . 1 1 55 55 GLY H H 55 8.745 8.745 8.714 0.031 25324 1733 1 3 . 1 1 56 56 GLU N N 56 120.073 120.073 119.445 0.628 25324 1734 1 3 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.622 0.087 25324 1735 1 3 . 1 1 56 56 GLU C C 56 175.906 175.906 175.789 0.117 25324 1736 1 3 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.102 -0.679 25324 1737 1 3 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.706 0.118 25324 1738 1 3 . 1 1 56 56 GLU H H 56 8.039 8.039 7.858 0.181 25324 1739 1 3 . 1 1 57 57 GLY N N 57 105.298 105.298 108.919 -3.621 25324 1740 1 3 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.954 -0.152 25324 1741 1 3 . 1 1 57 57 GLY H H 57 7.937 7.937 8.416 -0.479 25324 1742 1 3 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.708 0.226 25324 1743 1 3 . 1 1 58 58 PRO C C 58 177.785 177.785 176.466 1.319 25324 1744 1 3 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.022 0.110 25324 1745 1 3 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.484 -0.644 25324 1746 1 3 . 1 1 59 59 ILE N N 59 117.386 117.386 117.680 -0.294 25324 1747 1 3 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.608 0.380 25324 1748 1 3 . 1 1 59 59 ILE C C 59 175.688 175.688 175.061 0.627 25324 1749 1 3 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.019 0.524 25324 1750 1 3 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.376 0.912 25324 1751 1 3 . 1 1 59 59 ILE H H 59 9.600 9.600 8.904 0.696 25324 1752 1 3 . 1 1 60 60 GLY N N 60 107.164 107.164 107.636 -0.472 25324 1753 1 3 . 1 1 60 60 GLY C C 60 173.787 173.787 172.594 1.193 25324 1754 1 3 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.440 1.795 25324 1755 1 3 . 1 1 60 60 GLY H H 60 8.957 8.957 8.383 0.574 25324 1756 1 3 . 1 1 61 61 PHE N N 61 124.597 124.597 125.597 -1.000 25324 1757 1 3 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.817 -0.594 25324 1758 1 3 . 1 1 61 61 PHE C C 61 173.126 173.126 173.346 -0.220 25324 1759 1 3 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.077 0.784 25324 1760 1 3 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.345 -0.128 25324 1761 1 3 . 1 1 61 61 PHE H H 61 8.788 8.788 9.219 -0.431 25324 1762 1 3 . 1 1 62 62 ARG N N 62 129.706 129.706 128.029 1.677 25324 1763 1 3 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.153 -0.021 25324 1764 1 3 . 1 1 62 62 ARG C C 62 172.456 172.456 172.904 -0.448 25324 1765 1 3 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.947 1.007 25324 1766 1 3 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.134 -1.264 25324 1767 1 3 . 1 1 62 62 ARG H H 62 8.405 8.405 8.567 -0.162 25324 1768 1 3 . 1 1 63 63 ALA N N 63 122.744 122.744 129.050 -6.306 25324 1769 1 3 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.411 -0.066 25324 1770 1 3 . 1 1 63 63 ALA C C 63 176.120 176.120 175.601 0.519 25324 1771 1 3 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.051 -0.132 25324 1772 1 3 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.935 1.838 25324 1773 1 3 . 1 1 63 63 ALA H H 63 8.628 8.628 8.725 -0.097 25324 1774 1 3 . 1 1 64 64 THR N N 64 116.855 116.855 118.382 -1.527 25324 1775 1 3 . 1 1 64 64 THR HA H 64 4.848 4.848 5.305 -0.457 25324 1776 1 3 . 1 1 64 64 THR C C 64 172.957 172.957 173.525 -0.568 25324 1777 1 3 . 1 1 64 64 THR CA C 64 61.211 61.211 61.138 0.073 25324 1778 1 3 . 1 1 64 64 THR CB C 64 71.064 71.064 71.484 -0.420 25324 1779 1 3 . 1 1 64 64 THR H H 64 8.315 8.315 8.699 -0.384 25324 1780 1 3 . 1 1 65 65 LEU N N 65 129.360 129.360 129.171 0.189 25324 1781 1 3 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.930 -0.568 25324 1782 1 3 . 1 1 65 65 LEU C C 65 176.459 176.459 176.033 0.426 25324 1783 1 3 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.762 0.925 25324 1784 1 3 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.471 -0.760 25324 1785 1 3 . 1 1 65 65 LEU H H 65 8.877 8.877 8.919 -0.042 25324 1786 1 3 . 1 1 66 66 LEU N N 66 128.683 128.683 127.489 1.194 25324 1787 1 3 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.344 0.032 25324 1788 1 3 . 1 1 66 66 LEU C C 66 177.621 177.621 177.327 0.294 25324 1789 1 3 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.411 -0.711 25324 1790 1 3 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.176 0.126 25324 1791 1 3 . 1 1 66 66 LEU H H 66 9.320 9.320 9.092 0.228 25324 1792 1 3 . 1 1 67 67 GLY N N 67 105.361 105.361 106.467 -1.106 25324 1793 1 3 . 1 1 67 67 GLY C C 67 173.618 173.618 174.445 -0.827 25324 1794 1 3 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.234 -1.867 25324 1795 1 3 . 1 1 67 67 GLY H H 67 6.639 6.639 8.191 -1.552 25324 1796 1 3 . 1 1 68 68 ASN N N 68 121.848 121.848 118.910 2.938 25324 1797 1 3 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.712 -0.381 25324 1798 1 3 . 1 1 68 68 ASN C C 68 174.316 174.316 175.385 -1.069 25324 1799 1 3 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.060 3.492 25324 1800 1 3 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.484 -1.319 25324 1801 1 3 . 1 1 68 68 ASN H H 68 9.236 9.236 8.176 1.060 25324 1802 1 3 . 1 1 69 69 ASN N N 69 109.509 109.509 113.690 -4.181 25324 1803 1 3 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.227 -0.147 25324 1804 1 3 . 1 1 69 69 ASN C C 69 171.456 171.456 173.649 -2.193 25324 1805 1 3 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.878 0.872 25324 1806 1 3 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.468 -0.162 25324 1807 1 3 . 1 1 69 69 ASN H H 69 8.651 8.651 8.771 -0.120 25324 1808 1 3 . 1 1 70 70 SER N N 70 113.479 113.479 114.425 -0.946 25324 1809 1 3 . 1 1 70 70 SER HA H 70 5.437 5.437 5.233 0.204 25324 1810 1 3 . 1 1 70 70 SER C C 70 173.750 173.750 173.182 0.568 25324 1811 1 3 . 1 1 70 70 SER CA C 70 57.139 57.139 58.058 -0.919 25324 1812 1 3 . 1 1 70 70 SER CB C 70 63.818 63.818 65.197 -1.379 25324 1813 1 3 . 1 1 70 70 SER H H 70 7.693 7.693 7.326 0.367 25324 1814 1 3 . 1 1 71 71 TYR N N 71 123.132 123.132 123.719 -0.587 25324 1815 1 3 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.132 0.011 25324 1816 1 3 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.690 -0.042 25324 1817 1 3 . 1 1 71 71 TYR CB C 71 42.445 42.445 41.652 0.793 25324 1818 1 3 . 1 1 71 71 TYR H H 71 9.326 9.326 9.569 -0.243 25324 1819 1 3 . 1 1 72 72 GLU N N 72 122.396 122.396 123.542 -1.146 25324 1820 1 3 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.675 0.131 25324 1821 1 3 . 1 1 72 72 GLU C C 72 175.698 175.698 175.152 0.546 25324 1822 1 3 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.702 -0.535 25324 1823 1 3 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.232 -1.048 25324 1824 1 3 . 1 1 72 72 GLU H H 72 8.624 8.624 9.090 -0.466 25324 1825 1 3 . 1 1 73 73 VAL N N 73 128.513 128.513 127.978 0.535 25324 1826 1 3 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.337 -0.138 25324 1827 1 3 . 1 1 73 73 VAL C C 73 175.369 175.369 174.579 0.790 25324 1828 1 3 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.126 0.354 25324 1829 1 3 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.602 -0.269 25324 1830 1 3 . 1 1 73 73 VAL H H 73 8.564 8.564 9.197 -0.633 25324 1831 1 3 . 1 1 74 74 GLU N N 74 124.842 124.842 126.590 -1.748 25324 1832 1 3 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.083 0.004 25324 1833 1 3 . 1 1 74 74 GLU C C 74 174.415 174.415 174.754 -0.339 25324 1834 1 3 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.960 -0.623 25324 1835 1 3 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.373 1.784 25324 1836 1 3 . 1 1 74 74 GLU H H 74 9.011 9.011 9.017 -0.006 25324 1837 1 3 . 1 1 75 75 ASN N N 75 116.136 116.136 121.404 -5.268 25324 1838 1 3 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.584 0.555 25324 1839 1 3 . 1 1 75 75 ASN C C 75 172.703 172.703 173.457 -0.754 25324 1840 1 3 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.677 0.148 25324 1841 1 3 . 1 1 75 75 ASN CB C 75 45.896 45.896 43.143 2.753 25324 1842 1 3 . 1 1 75 75 ASN H H 75 9.424 9.424 9.282 0.142 25324 1843 1 3 . 1 1 76 76 GLN N N 76 120.762 120.762 120.691 0.071 25324 1844 1 3 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.419 -0.379 25324 1845 1 3 . 1 1 76 76 GLN C C 76 173.113 173.113 174.308 -1.195 25324 1846 1 3 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.563 -0.340 25324 1847 1 3 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.326 0.022 25324 1848 1 3 . 1 1 76 76 GLN H H 76 7.106 7.106 8.764 -1.658 25324 1849 1 3 . 1 1 77 77 TRP N N 77 125.598 125.598 124.660 0.938 25324 1850 1 3 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.122 0.030 25324 1851 1 3 . 1 1 77 77 TRP C C 77 175.502 175.502 175.108 0.394 25324 1852 1 3 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.516 -0.752 25324 1853 1 3 . 1 1 77 77 TRP CB C 77 29.999 29.999 29.194 0.805 25324 1854 1 3 . 1 1 77 77 TRP H H 77 8.181 8.181 8.249 -0.068 25324 1855 1 3 . 1 1 78 78 GLY N N 78 107.901 107.901 107.616 0.285 25324 1856 1 3 . 1 1 78 78 GLY C C 78 174.611 174.611 174.116 0.495 25324 1857 1 3 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.553 0.349 25324 1858 1 3 . 1 1 78 78 GLY H H 78 8.778 8.778 8.220 0.558 25324 1859 1 3 . 1 1 79 79 GLY N N 79 109.844 109.844 108.147 1.697 25324 1860 1 3 . 1 1 79 79 GLY C C 79 173.782 173.782 174.312 -0.530 25324 1861 1 3 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.301 -0.508 25324 1862 1 3 . 1 1 79 79 GLY H H 79 8.198 8.198 7.231 0.967 25324 1863 1 3 . 1 1 80 80 ASP N N 80 115.837 115.837 120.072 -4.235 25324 1864 1 3 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.350 -0.109 25324 1865 1 3 . 1 1 80 80 ASP C C 80 177.285 177.285 176.601 0.684 25324 1866 1 3 . 1 1 80 80 ASP CA C 80 56.183 56.183 56.251 -0.068 25324 1867 1 3 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.804 -0.281 25324 1868 1 3 . 1 1 80 80 ASP H H 80 8.132 8.132 8.620 -0.488 25324 1869 1 3 . 1 1 81 81 SER N N 81 112.690 112.690 112.764 -0.074 25324 1870 1 3 . 1 1 81 81 SER HA H 81 4.513 4.513 4.444 0.069 25324 1871 1 3 . 1 1 81 81 SER C C 81 173.684 173.684 173.980 -0.296 25324 1872 1 3 . 1 1 81 81 SER CA C 81 57.232 57.232 57.862 -0.630 25324 1873 1 3 . 1 1 81 81 SER CB C 81 63.170 63.170 63.288 -0.118 25324 1874 1 3 . 1 1 81 81 SER H H 81 8.179 8.179 8.005 0.174 25324 1875 1 3 . 1 1 82 82 ALA N N 82 126.310 126.310 126.611 -0.301 25324 1876 1 3 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.504 -0.101 25324 1877 1 3 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.180 0.286 25324 1878 1 3 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.379 -0.181 25324 1879 1 3 . 1 1 82 82 ALA H H 82 7.274 7.274 7.256 0.018 25324 1880 1 3 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.316 0.057 25324 1881 1 3 . 1 1 83 83 PRO C C 83 175.378 175.378 175.549 -0.171 25324 1882 1 3 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.299 0.028 25324 1883 1 3 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.365 -0.201 25324 1884 1 3 . 1 1 84 84 TRP N N 84 120.106 120.106 119.691 0.415 25324 1885 1 3 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.448 -0.177 25324 1886 1 3 . 1 1 84 84 TRP C C 84 176.358 176.358 176.173 0.185 25324 1887 1 3 . 1 1 84 84 TRP CA C 84 56.946 56.946 57.318 -0.372 25324 1888 1 3 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.339 -0.623 25324 1889 1 3 . 1 1 84 84 TRP H H 84 8.329 8.329 8.128 0.201 25324 1890 1 3 . 1 1 85 85 HIS N N 85 118.543 118.543 119.792 -1.249 25324 1891 1 3 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.859 0.060 25324 1892 1 3 . 1 1 85 85 HIS C C 85 174.950 174.950 174.889 0.061 25324 1893 1 3 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.015 -1.546 25324 1894 1 3 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.189 -1.516 25324 1895 1 3 . 1 1 85 85 HIS H H 85 9.204 9.204 9.103 0.101 25324 1896 1 3 . 1 1 86 86 SER N N 86 117.803 117.803 117.810 -0.007 25324 1897 1 3 . 1 1 86 86 SER HA H 86 4.412 4.412 4.252 0.160 25324 1898 1 3 . 1 1 86 86 SER C C 86 175.691 175.691 174.836 0.855 25324 1899 1 3 . 1 1 86 86 SER CA C 86 60.257 60.257 59.783 0.474 25324 1900 1 3 . 1 1 86 86 SER CB C 86 63.015 63.015 63.110 -0.095 25324 1901 1 3 . 1 1 86 86 SER H H 86 9.168 9.168 8.888 0.280 25324 1902 1 3 . 1 1 87 87 GLY N N 87 115.773 115.773 111.956 3.817 25324 1903 1 3 . 1 1 87 87 GLY C C 87 174.288 174.288 173.576 0.712 25324 1904 1 3 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.053 -0.353 25324 1905 1 3 . 1 1 87 87 GLY H H 87 9.284 9.284 9.046 0.238 25324 1906 1 3 . 1 1 88 88 GLY N N 88 109.162 109.162 107.356 1.806 25324 1907 1 3 . 1 1 88 88 GLY C C 88 171.120 171.120 172.066 -0.946 25324 1908 1 3 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.985 -0.391 25324 1909 1 3 . 1 1 88 88 GLY H H 88 8.054 8.054 8.047 0.007 25324 1910 1 3 . 1 1 89 89 ASN N N 89 117.048 117.048 120.533 -3.485 25324 1911 1 3 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.744 0.294 25324 1912 1 3 . 1 1 89 89 ASN C C 89 175.287 175.287 175.064 0.223 25324 1913 1 3 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.719 -1.854 25324 1914 1 3 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.827 -1.222 25324 1915 1 3 . 1 1 89 89 ASN H H 89 8.516 8.516 8.332 0.184 25324 1916 1 3 . 1 1 90 90 TRP N N 90 125.844 125.844 124.851 0.993 25324 1917 1 3 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.110 0.143 25324 1918 1 3 . 1 1 90 90 TRP C C 90 175.278 175.278 174.971 0.307 25324 1919 1 3 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.906 -0.638 25324 1920 1 3 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.323 -0.365 25324 1921 1 3 . 1 1 90 90 TRP H H 90 9.282 9.282 9.385 -0.103 25324 1922 1 3 . 1 1 91 91 ILE N N 91 123.134 123.134 121.891 1.243 25324 1923 1 3 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.907 0.539 25324 1924 1 3 . 1 1 91 91 ILE C C 91 175.489 175.489 175.254 0.235 25324 1925 1 3 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.879 0.947 25324 1926 1 3 . 1 1 91 91 ILE CB C 91 39.676 39.676 37.867 1.809 25324 1927 1 3 . 1 1 91 91 ILE H H 91 9.318 9.318 8.681 0.637 25324 1928 1 3 . 1 1 92 92 LEU N N 92 123.452 123.452 129.784 -6.332 25324 1929 1 3 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.816 0.126 25324 1930 1 3 . 1 1 92 92 LEU C C 92 173.620 173.620 174.734 -1.114 25324 1931 1 3 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.812 -1.556 25324 1932 1 3 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.900 1.608 25324 1933 1 3 . 1 1 92 92 LEU H H 92 8.463 8.463 8.784 -0.321 25324 1934 1 3 . 1 1 93 93 GLY N N 93 103.987 103.987 108.145 -4.158 25324 1935 1 3 . 1 1 93 93 GLY C C 93 172.284 172.284 174.275 -1.991 25324 1936 1 3 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.510 -2.010 25324 1937 1 3 . 1 1 93 93 GLY H H 93 2.937 2.937 7.336 -4.399 25324 1938 1 3 . 1 1 94 94 SER N N 94 110.274 110.274 118.724 -8.450 25324 1939 1 3 . 1 1 94 94 SER HA H 94 4.711 4.711 4.794 -0.083 25324 1940 1 3 . 1 1 94 94 SER C C 94 174.784 174.784 175.798 -1.014 25324 1941 1 3 . 1 1 94 94 SER CA C 94 56.555 56.555 58.983 -2.428 25324 1942 1 3 . 1 1 94 94 SER CB C 94 65.051 65.051 65.018 0.033 25324 1943 1 3 . 1 1 94 94 SER H H 94 7.919 7.919 9.038 -1.119 25324 1944 1 3 . 1 1 95 95 ARG N N 95 123.020 123.020 120.858 2.162 25324 1945 1 3 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.404 0.268 25324 1946 1 3 . 1 1 95 95 ARG C C 95 176.120 176.120 176.748 -0.628 25324 1947 1 3 . 1 1 95 95 ARG CA C 95 55.374 55.374 56.847 -1.474 25324 1948 1 3 . 1 1 95 95 ARG CB C 95 31.848 31.848 30.377 1.471 25324 1949 1 3 . 1 1 95 95 ARG H H 95 9.148 9.148 8.506 0.642 25324 1950 1 3 . 1 1 96 96 GLU N N 96 120.357 120.357 117.589 2.768 25324 1951 1 3 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.036 0.246 25324 1952 1 3 . 1 1 96 96 GLU C C 96 176.278 176.278 175.856 0.422 25324 1953 1 3 . 1 1 96 96 GLU CA C 96 56.530 56.530 59.022 -2.492 25324 1954 1 3 . 1 1 96 96 GLU CB C 96 30.153 30.153 28.024 2.129 25324 1955 1 3 . 1 1 96 96 GLU H H 96 8.610 8.610 8.978 -0.368 25324 1956 1 3 . 1 1 97 97 ASN N N 97 117.678 117.678 118.632 -0.954 25324 1957 1 3 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.774 -0.162 25324 1958 1 3 . 1 1 97 97 ASN C C 97 173.949 173.949 174.234 -0.285 25324 1959 1 3 . 1 1 97 97 ASN CA C 97 53.015 53.015 53.874 -0.859 25324 1960 1 3 . 1 1 97 97 ASN CB C 97 38.166 38.166 39.354 -1.188 25324 1961 1 3 . 1 1 97 97 ASN H H 97 8.533 8.533 8.314 0.219 25324 1962 1 3 . 1 1 98 98 GLN N N 98 118.592 118.592 119.596 -1.004 25324 1963 1 3 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.445 -0.085 25324 1964 1 3 . 1 1 98 98 GLN C C 98 173.116 173.116 173.995 -0.879 25324 1965 1 3 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.220 0.408 25324 1966 1 3 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.656 0.213 25324 1967 1 3 . 1 1 98 98 GLN H H 98 7.663 7.663 7.631 0.032 25324 1968 1 3 . 1 1 99 99 ASN N N 99 122.855 122.855 122.524 0.331 25324 1969 1 3 . 1 1 99 99 ASN HA H 99 5.135 5.135 4.836 0.299 25324 1970 1 3 . 1 1 99 99 ASN C C 99 175.287 175.287 175.328 -0.041 25324 1971 1 3 . 1 1 99 99 ASN CA C 99 52.990 52.990 53.162 -0.172 25324 1972 1 3 . 1 1 99 99 ASN CB C 99 40.491 40.491 39.811 0.680 25324 1973 1 3 . 1 1 99 99 ASN H H 99 8.759 8.759 8.619 0.140 25324 1974 1 3 . 1 1 100 100 VAL N N 100 121.385 121.385 119.347 2.038 25324 1975 1 3 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.865 -0.117 25324 1976 1 3 . 1 1 100 100 VAL C C 100 174.956 174.956 176.436 -1.480 25324 1977 1 3 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.661 0.181 25324 1978 1 3 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.496 0.947 25324 1979 1 3 . 1 1 100 100 VAL H H 100 8.717 8.717 8.013 0.704 25324 1980 1 3 . 1 1 101 101 VAL N N 101 112.736 112.736 122.932 -10.196 25324 1981 1 3 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.458 0.187 25324 1982 1 3 . 1 1 101 101 VAL C C 101 175.577 175.577 174.544 1.033 25324 1983 1 3 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.493 -1.530 25324 1984 1 3 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.670 -0.629 25324 1985 1 3 . 1 1 101 101 VAL H H 101 8.802 8.802 8.634 0.168 25324 1986 1 3 . 1 1 102 102 ALA N N 102 122.104 122.104 120.865 1.239 25324 1987 1 3 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.174 -0.367 25324 1988 1 3 . 1 1 102 102 ALA C C 102 176.046 176.046 174.975 1.071 25324 1989 1 3 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.905 2.349 25324 1990 1 3 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.051 -0.426 25324 1991 1 3 . 1 1 102 102 ALA H H 102 7.677 7.677 7.754 -0.077 25324 1992 1 3 . 1 1 103 103 ILE N N 103 118.218 118.218 122.521 -4.303 25324 1993 1 3 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.270 -0.243 25324 1994 1 3 . 1 1 103 103 ILE C C 103 173.118 173.118 173.867 -0.749 25324 1995 1 3 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.738 1.489 25324 1996 1 3 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.736 0.735 25324 1997 1 3 . 1 1 103 103 ILE H H 103 8.102 8.102 8.473 -0.371 25324 1998 1 3 . 1 1 104 104 ASN N N 104 125.938 125.938 126.031 -0.093 25324 1999 1 3 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.456 0.230 25324 2000 1 3 . 1 1 104 104 ASN C C 104 174.870 174.870 173.766 1.104 25324 2001 1 3 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.232 0.321 25324 2002 1 3 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.663 -1.811 25324 2003 1 3 . 1 1 104 104 ASN H H 104 8.668 8.668 9.087 -0.419 25324 2004 1 3 . 1 1 105 105 VAL N N 105 114.631 114.631 119.147 -4.516 25324 2005 1 3 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.108 0.097 25324 2006 1 3 . 1 1 105 105 VAL C C 105 174.788 174.788 173.254 1.534 25324 2007 1 3 . 1 1 105 105 VAL CA C 105 57.979 57.979 59.715 -1.736 25324 2008 1 3 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.604 0.436 25324 2009 1 3 . 1 1 105 105 VAL H H 105 8.933 8.933 8.910 0.023 25324 2010 1 3 . 1 1 106 106 GLU N N 106 118.347 118.347 125.038 -6.691 25324 2011 1 3 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.291 -0.211 25324 2012 1 3 . 1 1 106 106 GLU C C 106 174.777 174.777 174.665 0.112 25324 2013 1 3 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.110 -0.143 25324 2014 1 3 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.120 -0.477 25324 2015 1 3 . 1 1 106 106 GLU H H 106 8.814 8.814 8.763 0.051 25324 2016 1 3 . 1 1 107 107 SER N N 107 115.335 115.335 121.169 -5.834 25324 2017 1 3 . 1 1 107 107 SER HA H 107 5.266 5.266 4.818 0.448 25324 2018 1 3 . 1 1 107 107 SER C C 107 175.787 175.787 173.942 1.845 25324 2019 1 3 . 1 1 107 107 SER CA C 107 55.888 55.888 57.238 -1.350 25324 2020 1 3 . 1 1 107 107 SER CB C 107 65.921 65.921 65.231 0.690 25324 2021 1 3 . 1 1 107 107 SER H H 107 8.576 8.576 8.797 -0.221 25324 2022 1 3 . 1 1 108 108 GLY N N 108 117.567 117.567 110.999 6.568 25324 2023 1 3 . 1 1 108 108 GLY C C 108 173.959 173.959 175.049 -1.090 25324 2024 1 3 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.229 -0.552 25324 2025 1 3 . 1 1 108 108 GLY H H 108 9.532 9.532 8.688 0.844 25324 2026 1 3 . 1 1 109 109 ASP N N 109 122.108 122.108 122.033 0.075 25324 2027 1 3 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.706 0.095 25324 2028 1 3 . 1 1 109 109 ASP C C 109 176.203 176.203 175.976 0.227 25324 2029 1 3 . 1 1 109 109 ASP CA C 109 52.134 52.134 54.404 -2.269 25324 2030 1 3 . 1 1 109 109 ASP CB C 109 39.342 39.342 40.997 -1.655 25324 2031 1 3 . 1 1 109 109 ASP H H 109 8.605 8.605 7.835 0.770 25324 2032 1 3 . 1 1 110 110 ASP N N 110 116.197 116.197 117.430 -1.233 25324 2033 1 3 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.344 -0.122 25324 2034 1 3 . 1 1 110 110 ASP C C 110 175.951 175.951 176.551 -0.600 25324 2035 1 3 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.120 0.078 25324 2036 1 3 . 1 1 110 110 ASP CB C 110 38.630 38.630 39.590 -0.960 25324 2037 1 3 . 1 1 110 110 ASP H H 110 9.087 9.087 8.505 0.582 25324 2038 1 3 . 1 1 111 111 GLY N N 111 103.841 103.841 103.961 -0.120 25324 2039 1 3 . 1 1 111 111 GLY C C 111 173.924 173.924 175.322 -1.398 25324 2040 1 3 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.281 -0.118 25324 2041 1 3 . 1 1 111 111 GLY H H 111 8.930 8.930 8.334 0.596 25324 2042 1 3 . 1 1 112 112 GLN N N 112 121.626 121.626 121.040 0.586 25324 2043 1 3 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.156 -0.086 25324 2044 1 3 . 1 1 112 112 GLN C C 112 176.431 176.431 174.887 1.544 25324 2045 1 3 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.843 -0.570 25324 2046 1 3 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.505 -1.812 25324 2047 1 3 . 1 1 112 112 GLN H H 112 7.351 7.351 7.740 -0.389 25324 2048 1 3 . 1 1 113 113 THR N N 113 112.322 112.322 110.483 1.839 25324 2049 1 3 . 1 1 113 113 THR HA H 113 5.331 5.331 5.318 0.013 25324 2050 1 3 . 1 1 113 113 THR C C 113 174.452 174.452 173.097 1.355 25324 2051 1 3 . 1 1 113 113 THR CA C 113 59.739 59.739 59.935 -0.196 25324 2052 1 3 . 1 1 113 113 THR CB C 113 71.773 71.773 70.799 0.974 25324 2053 1 3 . 1 1 113 113 THR H H 113 10.053 10.053 7.690 2.363 25324 2054 1 3 . 1 1 114 114 LEU N N 114 122.083 122.083 126.818 -4.735 25324 2055 1 3 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.585 -0.004 25324 2056 1 3 . 1 1 114 114 LEU C C 114 175.113 175.113 175.085 0.028 25324 2057 1 3 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.752 -0.847 25324 2058 1 3 . 1 1 114 114 LEU CB C 114 47.033 47.033 42.181 4.852 25324 2059 1 3 . 1 1 114 114 LEU H H 114 8.978 8.978 8.818 0.160 25324 2060 1 3 . 1 1 115 115 ASN N N 115 118.846 118.846 122.050 -3.204 25324 2061 1 3 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.915 -0.145 25324 2062 1 3 . 1 1 115 115 ASN C C 115 174.788 174.788 175.230 -0.442 25324 2063 1 3 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.741 0.601 25324 2064 1 3 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.943 0.471 25324 2065 1 3 . 1 1 115 115 ASN H H 115 8.837 8.837 8.006 0.831 25324 2066 1 3 . 1 1 116 116 GLY N N 116 109.661 109.661 108.571 1.090 25324 2067 1 3 . 1 1 116 116 GLY C C 116 172.452 172.452 172.638 -0.186 25324 2068 1 3 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.242 0.230 25324 2069 1 3 . 1 1 116 116 GLY H H 116 8.625 8.625 8.932 -0.307 25324 2070 1 3 . 1 1 117 117 THR N N 117 120.009 120.009 114.252 5.757 25324 2071 1 3 . 1 1 117 117 THR HA H 117 5.556 5.556 5.659 -0.103 25324 2072 1 3 . 1 1 117 117 THR C C 117 171.619 171.619 173.108 -1.489 25324 2073 1 3 . 1 1 117 117 THR CA C 117 59.373 59.373 60.328 -0.955 25324 2074 1 3 . 1 1 117 117 THR CB C 117 72.777 72.777 72.832 -0.055 25324 2075 1 3 . 1 1 117 117 THR H H 117 8.911 8.911 8.976 -0.065 25324 2076 1 3 . 1 1 118 118 MET N N 118 115.550 115.550 117.347 -1.797 25324 2077 1 3 . 1 1 118 118 MET HA H 118 4.889 4.889 5.125 -0.236 25324 2078 1 3 . 1 1 118 118 MET C C 118 172.707 172.707 173.838 -1.131 25324 2079 1 3 . 1 1 118 118 MET CA C 118 54.714 54.714 54.978 -0.264 25324 2080 1 3 . 1 1 118 118 MET CB C 118 33.663 33.663 37.244 -3.581 25324 2081 1 3 . 1 1 118 118 MET H H 118 9.159 9.159 9.395 -0.236 25324 2082 1 3 . 1 1 119 119 THR N N 119 113.716 113.716 115.905 -2.189 25324 2083 1 3 . 1 1 119 119 THR HA H 119 4.682 4.682 4.925 -0.243 25324 2084 1 3 . 1 1 119 119 THR C C 119 173.952 173.952 173.425 0.527 25324 2085 1 3 . 1 1 119 119 THR CA C 119 61.395 61.395 61.402 -0.007 25324 2086 1 3 . 1 1 119 119 THR CB C 119 71.746 71.746 71.882 -0.136 25324 2087 1 3 . 1 1 119 119 THR H H 119 8.685 8.685 8.730 -0.045 25324 2088 1 3 . 1 1 120 120 TYR N N 120 129.153 129.153 125.065 4.088 25324 2089 1 3 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.838 -0.038 25324 2090 1 3 . 1 1 120 120 TYR C C 120 175.214 175.214 175.828 -0.614 25324 2091 1 3 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.917 0.960 25324 2092 1 3 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.428 0.074 25324 2093 1 3 . 1 1 120 120 TYR H H 120 10.107 10.107 9.039 1.068 25324 2094 1 3 . 1 1 121 121 ALA N N 121 119.947 119.947 123.012 -3.065 25324 2095 1 3 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.275 -0.271 25324 2096 1 3 . 1 1 121 121 ALA C C 121 178.456 178.456 177.894 0.562 25324 2097 1 3 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.431 0.525 25324 2098 1 3 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.721 -0.012 25324 2099 1 3 . 1 1 121 121 ALA H H 121 8.704 8.704 8.375 0.329 25324 2100 1 3 . 1 1 122 122 GLY N N 122 111.186 111.186 111.221 -0.035 25324 2101 1 3 . 1 1 122 122 GLY C C 122 173.949 173.949 174.054 -0.105 25324 2102 1 3 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.381 -0.379 25324 2103 1 3 . 1 1 122 122 GLY H H 122 8.792 8.792 8.699 0.093 25324 2104 1 3 . 1 1 123 123 GLU N N 123 120.099 120.099 119.363 0.736 25324 2105 1 3 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.673 0.032 25324 2106 1 3 . 1 1 123 123 GLU C C 123 175.912 175.912 176.063 -0.151 25324 2107 1 3 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.735 -0.321 25324 2108 1 3 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.788 -0.004 25324 2109 1 3 . 1 1 123 123 GLU H H 123 8.072 8.072 7.763 0.309 25324 2110 1 3 . 1 1 124 124 GLY N N 124 105.303 105.303 109.309 -4.006 25324 2111 1 3 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.521 0.281 25324 2112 1 3 . 1 1 124 124 GLY H H 124 7.939 7.939 8.420 -0.481 25324 2113 1 3 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.736 0.199 25324 2114 1 3 . 1 1 125 125 PRO C C 125 177.788 177.788 176.453 1.335 25324 2115 1 3 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.090 0.042 25324 2116 1 3 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.072 -0.213 25324 2117 1 3 . 1 1 126 126 ILE N N 126 117.387 117.387 117.620 -0.233 25324 2118 1 3 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.753 0.146 25324 2119 1 3 . 1 1 126 126 ILE C C 126 175.625 175.625 175.063 0.562 25324 2120 1 3 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.151 0.302 25324 2121 1 3 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.376 1.172 25324 2122 1 3 . 1 1 126 126 ILE H H 126 9.599 9.599 8.991 0.608 25324 2123 1 3 . 1 1 127 127 GLY N N 127 106.753 106.753 107.799 -1.046 25324 2124 1 3 . 1 1 127 127 GLY C C 127 173.627 173.627 172.721 0.906 25324 2125 1 3 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.652 1.631 25324 2126 1 3 . 1 1 127 127 GLY H H 127 8.840 8.840 8.766 0.074 25324 2127 1 3 . 1 1 128 128 PHE N N 128 124.826 124.826 125.622 -0.796 25324 2128 1 3 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.396 -0.452 25324 2129 1 3 . 1 1 128 128 PHE C C 128 173.087 173.087 173.305 -0.218 25324 2130 1 3 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.712 0.297 25324 2131 1 3 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.703 -0.543 25324 2132 1 3 . 1 1 128 128 PHE H H 128 8.924 8.924 9.155 -0.231 25324 2133 1 3 . 1 1 129 129 LYS N N 129 131.518 131.518 127.740 3.778 25324 2134 1 3 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.982 -0.099 25324 2135 1 3 . 1 1 129 129 LYS C C 129 173.863 173.863 173.789 0.074 25324 2136 1 3 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.565 1.170 25324 2137 1 3 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.874 -1.153 25324 2138 1 3 . 1 1 129 129 LYS H H 129 8.201 8.201 8.264 -0.063 25324 2139 1 3 . 1 1 130 130 GLY N N 130 114.030 114.030 113.250 0.780 25324 2140 1 3 . 1 1 130 130 GLY C C 130 171.951 171.951 172.600 -0.649 25324 2141 1 3 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.977 -0.190 25324 2142 1 3 . 1 1 130 130 GLY H H 130 9.325 9.325 8.845 0.480 25324 2143 1 3 . 1 1 131 131 THR N N 131 120.583 120.583 120.568 0.015 25324 2144 1 3 . 1 1 131 131 THR HA H 131 4.939 4.939 4.996 -0.057 25324 2145 1 3 . 1 1 131 131 THR C C 131 173.118 173.118 173.480 -0.362 25324 2146 1 3 . 1 1 131 131 THR CA C 131 61.266 61.266 61.329 -0.063 25324 2147 1 3 . 1 1 131 131 THR CB C 131 70.392 70.392 71.643 -1.251 25324 2148 1 3 . 1 1 131 131 THR H H 131 8.916 8.916 8.793 0.123 25324 2149 1 3 . 1 1 132 132 LEU N N 132 130.774 130.774 129.921 0.853 25324 2150 1 3 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.528 -0.028 25324 2151 1 3 . 1 1 132 132 LEU C C 132 176.574 176.574 175.966 0.608 25324 2152 1 3 . 1 1 132 132 LEU CA C 132 56.187 56.187 54.691 1.496 25324 2153 1 3 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.345 1.102 25324 2154 1 3 . 1 1 132 132 LEU H H 132 8.527 8.527 8.847 -0.320 25324 2155 1 4 . 1 1 3 3 LEU N N 3 123.202 123.202 123.975 -0.773 25324 2156 1 4 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.894 0.263 25324 2157 1 4 . 1 1 3 3 LEU C C 3 175.786 175.786 175.293 0.493 25324 2158 1 4 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.251 0.033 25324 2159 1 4 . 1 1 3 3 LEU CB C 3 43.330 43.330 42.953 0.377 25324 2160 1 4 . 1 1 3 3 LEU H H 3 8.711 8.711 8.546 0.165 25324 2161 1 4 . 1 1 4 4 TYR N N 4 120.906 120.906 125.953 -5.047 25324 2162 1 4 . 1 1 4 4 TYR HA H 4 5.024 5.024 4.974 0.050 25324 2163 1 4 . 1 1 4 4 TYR C C 4 175.953 175.953 174.842 1.111 25324 2164 1 4 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.894 -0.517 25324 2165 1 4 . 1 1 4 4 TYR CB C 4 41.655 41.655 41.941 -0.286 25324 2166 1 4 . 1 1 4 4 TYR H H 4 9.142 9.142 9.670 -0.528 25324 2167 1 4 . 1 1 5 5 ASN N N 5 120.496 120.496 120.184 0.312 25324 2168 1 4 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.916 0.200 25324 2169 1 4 . 1 1 5 5 ASN C C 5 174.953 174.953 173.637 1.316 25324 2170 1 4 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.780 0.167 25324 2171 1 4 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.795 -1.904 25324 2172 1 4 . 1 1 5 5 ASN H H 5 8.787 8.787 9.149 -0.362 25324 2173 1 4 . 1 1 6 6 VAL N N 6 127.428 127.428 125.112 2.316 25324 2174 1 4 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.277 0.085 25324 2175 1 4 . 1 1 6 6 VAL C C 6 174.955 174.955 174.255 0.700 25324 2176 1 4 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.005 0.428 25324 2177 1 4 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.760 -0.429 25324 2178 1 4 . 1 1 6 6 VAL H H 6 8.806 8.806 8.534 0.272 25324 2179 1 4 . 1 1 7 7 GLU N N 7 124.355 124.355 126.522 -2.167 25324 2180 1 4 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.808 0.174 25324 2181 1 4 . 1 1 7 7 GLU C C 7 174.551 174.551 174.814 -0.263 25324 2182 1 4 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.564 -0.775 25324 2183 1 4 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.871 1.696 25324 2184 1 4 . 1 1 7 7 GLU H H 7 8.800 8.800 8.688 0.112 25324 2185 1 4 . 1 1 8 8 ASN N N 8 116.231 116.231 122.407 -6.176 25324 2186 1 4 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.515 0.526 25324 2187 1 4 . 1 1 8 8 ASN C C 8 172.709 172.709 173.609 -0.900 25324 2188 1 4 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.358 -0.741 25324 2189 1 4 . 1 1 8 8 ASN CB C 8 45.585 45.585 41.804 3.781 25324 2190 1 4 . 1 1 8 8 ASN H H 8 9.320 9.320 9.103 0.217 25324 2191 1 4 . 1 1 9 9 GLN N N 9 120.762 120.762 124.451 -3.689 25324 2192 1 4 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.264 -0.090 25324 2193 1 4 . 1 1 9 9 GLN C C 9 173.454 173.454 173.924 -0.470 25324 2194 1 4 . 1 1 9 9 GLN CA C 9 53.960 53.960 53.753 0.207 25324 2195 1 4 . 1 1 9 9 GLN CB C 9 30.691 30.691 30.745 -0.054 25324 2196 1 4 . 1 1 9 9 GLN H H 9 6.887 6.887 8.542 -1.655 25324 2197 1 4 . 1 1 10 10 TRP N N 10 127.775 127.775 126.286 1.489 25324 2198 1 4 . 1 1 10 10 TRP HA H 10 4.988 4.988 4.985 0.003 25324 2199 1 4 . 1 1 10 10 TRP C C 10 175.281 175.281 177.113 -1.832 25324 2200 1 4 . 1 1 10 10 TRP CA C 10 56.293 56.293 55.889 0.404 25324 2201 1 4 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.224 -0.481 25324 2202 1 4 . 1 1 10 10 TRP H H 10 8.518 8.518 7.626 0.892 25324 2203 1 4 . 1 1 11 11 GLY N N 11 107.838 107.838 108.703 -0.865 25324 2204 1 4 . 1 1 11 11 GLY C C 11 174.733 174.733 174.236 0.497 25324 2205 1 4 . 1 1 11 11 GLY CA C 11 44.836 44.836 45.450 -0.614 25324 2206 1 4 . 1 1 11 11 GLY H H 11 8.461 8.461 8.752 -0.291 25324 2207 1 4 . 1 1 12 12 GLY N N 12 109.696 109.696 107.170 2.526 25324 2208 1 4 . 1 1 12 12 GLY C C 12 174.133 174.133 173.721 0.412 25324 2209 1 4 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.675 -0.886 25324 2210 1 4 . 1 1 12 12 GLY H H 12 8.138 8.138 7.688 0.450 25324 2211 1 4 . 1 1 13 13 SER N N 13 111.308 111.308 115.254 -3.946 25324 2212 1 4 . 1 1 13 13 SER HA H 13 4.092 4.092 4.532 -0.440 25324 2213 1 4 . 1 1 13 13 SER C C 13 175.622 175.622 175.562 0.060 25324 2214 1 4 . 1 1 13 13 SER CA C 13 60.494 60.494 59.203 1.291 25324 2215 1 4 . 1 1 13 13 SER CB C 13 63.028 63.028 63.594 -0.566 25324 2216 1 4 . 1 1 13 13 SER H H 13 8.215 8.215 8.529 -0.314 25324 2217 1 4 . 1 1 14 14 SER N N 14 115.290 115.290 113.730 1.560 25324 2218 1 4 . 1 1 14 14 SER HA H 14 4.566 4.566 4.354 0.212 25324 2219 1 4 . 1 1 14 14 SER C C 14 173.532 173.532 174.074 -0.542 25324 2220 1 4 . 1 1 14 14 SER CA C 14 57.317 57.317 58.351 -1.034 25324 2221 1 4 . 1 1 14 14 SER CB C 14 63.230 63.230 63.085 0.145 25324 2222 1 4 . 1 1 14 14 SER H H 14 8.213 8.213 7.732 0.481 25324 2223 1 4 . 1 1 15 15 ALA N N 15 126.470 126.470 125.866 0.604 25324 2224 1 4 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.524 -0.121 25324 2225 1 4 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.726 0.738 25324 2226 1 4 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.444 -0.215 25324 2227 1 4 . 1 1 15 15 ALA H H 15 7.308 7.308 7.350 -0.042 25324 2228 1 4 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.245 0.164 25324 2229 1 4 . 1 1 16 16 PRO C C 16 175.627 175.627 175.613 0.014 25324 2230 1 4 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.279 0.113 25324 2231 1 4 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.574 -0.437 25324 2232 1 4 . 1 1 17 17 TRP N N 17 120.228 120.228 119.602 0.626 25324 2233 1 4 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.401 -0.083 25324 2234 1 4 . 1 1 17 17 TRP C C 17 175.951 175.951 175.862 0.089 25324 2235 1 4 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.692 0.223 25324 2236 1 4 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.169 -0.760 25324 2237 1 4 . 1 1 17 17 TRP H H 17 8.380 8.380 8.139 0.241 25324 2238 1 4 . 1 1 18 18 ASN N N 18 120.663 120.663 122.959 -2.296 25324 2239 1 4 . 1 1 18 18 ASN HA H 18 5.086 5.086 4.962 0.124 25324 2240 1 4 . 1 1 18 18 ASN C C 18 174.793 174.793 174.180 0.613 25324 2241 1 4 . 1 1 18 18 ASN CA C 18 51.601 51.601 51.977 -0.376 25324 2242 1 4 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.416 2.232 25324 2243 1 4 . 1 1 18 18 ASN H H 18 9.094 9.094 8.603 0.491 25324 2244 1 4 . 1 1 19 19 GLU N N 19 122.202 122.202 125.839 -3.637 25324 2245 1 4 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.453 -0.314 25324 2246 1 4 . 1 1 19 19 GLU C C 19 176.869 176.869 176.961 -0.092 25324 2247 1 4 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.025 1.575 25324 2248 1 4 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.988 -0.605 25324 2249 1 4 . 1 1 19 19 GLU H H 19 9.013 9.013 9.006 0.007 25324 2250 1 4 . 1 1 20 20 GLY N N 20 112.893 112.893 115.301 -2.408 25324 2251 1 4 . 1 1 20 20 GLY C C 20 174.878 174.878 173.074 1.804 25324 2252 1 4 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.851 0.144 25324 2253 1 4 . 1 1 20 20 GLY H H 20 8.926 8.926 8.410 0.516 25324 2254 1 4 . 1 1 21 21 GLY N N 21 110.354 110.354 107.611 2.743 25324 2255 1 4 . 1 1 21 21 GLY C C 21 171.623 171.623 171.865 -0.242 25324 2256 1 4 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.721 -1.323 25324 2257 1 4 . 1 1 21 21 GLY H H 21 8.258 8.258 7.496 0.762 25324 2258 1 4 . 1 1 22 22 GLN N N 22 117.541 117.541 117.024 0.517 25324 2259 1 4 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.928 0.749 25324 2260 1 4 . 1 1 22 22 GLN C C 22 175.957 175.957 174.300 1.657 25324 2261 1 4 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.977 -0.033 25324 2262 1 4 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.408 -1.323 25324 2263 1 4 . 1 1 22 22 GLN H H 22 8.564 8.564 8.255 0.308 25324 2264 1 4 . 1 1 23 23 TRP N N 23 127.208 127.208 121.359 5.849 25324 2265 1 4 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.194 0.005 25324 2266 1 4 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.201 0.330 25324 2267 1 4 . 1 1 23 23 TRP CB C 23 31.683 31.683 33.398 -1.715 25324 2268 1 4 . 1 1 23 23 TRP H H 23 9.347 9.347 9.216 0.131 25324 2269 1 4 . 1 1 24 24 GLU N N 24 123.504 123.504 121.483 2.021 25324 2270 1 4 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.282 0.226 25324 2271 1 4 . 1 1 24 24 GLU C C 24 174.222 174.222 175.276 -1.054 25324 2272 1 4 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.192 0.399 25324 2273 1 4 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.653 -2.038 25324 2274 1 4 . 1 1 24 24 GLU H H 24 9.296 9.296 8.670 0.626 25324 2275 1 4 . 1 1 25 25 ILE N N 25 123.447 123.447 126.858 -3.411 25324 2276 1 4 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.633 -0.197 25324 2277 1 4 . 1 1 25 25 ILE C C 25 175.790 175.790 174.503 1.287 25324 2278 1 4 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.031 -0.404 25324 2279 1 4 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.484 0.468 25324 2280 1 4 . 1 1 25 25 ILE H H 25 8.635 8.635 8.932 -0.297 25324 2281 1 4 . 1 1 26 26 GLY N N 26 111.544 111.544 113.835 -2.291 25324 2282 1 4 . 1 1 26 26 GLY C C 26 172.122 172.122 175.033 -2.911 25324 2283 1 4 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.546 -0.468 25324 2284 1 4 . 1 1 26 26 GLY H H 26 3.381 3.381 7.162 -3.781 25324 2285 1 4 . 1 1 27 27 SER N N 27 112.279 112.279 115.816 -3.537 25324 2286 1 4 . 1 1 27 27 SER HA H 27 4.876 4.876 4.125 0.751 25324 2287 1 4 . 1 1 27 27 SER C C 27 174.113 174.113 175.283 -1.170 25324 2288 1 4 . 1 1 27 27 SER CA C 27 56.954 56.954 60.565 -3.611 25324 2289 1 4 . 1 1 27 27 SER CB C 27 64.554 64.554 63.795 0.759 25324 2290 1 4 . 1 1 27 27 SER H H 27 8.212 8.212 8.340 -0.128 25324 2291 1 4 . 1 1 28 28 ARG N N 28 120.872 120.872 122.071 -1.199 25324 2292 1 4 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.466 0.297 25324 2293 1 4 . 1 1 28 28 ARG C C 28 176.119 176.119 176.891 -0.772 25324 2294 1 4 . 1 1 28 28 ARG CA C 28 55.117 55.117 56.384 -1.267 25324 2295 1 4 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.458 1.372 25324 2296 1 4 . 1 1 28 28 ARG H H 28 7.849 7.849 8.479 -0.630 25324 2297 1 4 . 1 1 29 29 SER N N 29 118.985 118.985 122.193 -3.208 25324 2298 1 4 . 1 1 29 29 SER HA H 29 4.192 4.192 4.351 -0.159 25324 2299 1 4 . 1 1 29 29 SER C C 29 174.622 174.622 174.422 0.200 25324 2300 1 4 . 1 1 29 29 SER CA C 29 60.072 60.072 59.892 0.180 25324 2301 1 4 . 1 1 29 29 SER CB C 29 62.876 62.876 63.153 -0.277 25324 2302 1 4 . 1 1 29 29 SER H H 29 8.892 8.892 8.993 -0.101 25324 2303 1 4 . 1 1 30 30 ASP N N 30 117.632 117.632 119.318 -1.686 25324 2304 1 4 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.516 0.102 25324 2305 1 4 . 1 1 30 30 ASP C C 30 175.101 175.101 175.845 -0.744 25324 2306 1 4 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.566 -2.514 25324 2307 1 4 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.213 -0.690 25324 2308 1 4 . 1 1 30 30 ASP H H 30 8.441 8.441 8.091 0.350 25324 2309 1 4 . 1 1 31 31 GLN N N 31 118.273 118.273 118.784 -0.511 25324 2310 1 4 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.526 -0.041 25324 2311 1 4 . 1 1 31 31 GLN C C 31 173.453 173.453 174.210 -0.757 25324 2312 1 4 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.795 0.073 25324 2313 1 4 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.270 2.979 25324 2314 1 4 . 1 1 31 31 GLN H H 31 7.029 7.029 7.522 -0.493 25324 2315 1 4 . 1 1 32 32 ASN N N 32 120.865 120.865 120.818 0.047 25324 2316 1 4 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.997 0.123 25324 2317 1 4 . 1 1 32 32 ASN C C 32 175.198 175.198 174.701 0.497 25324 2318 1 4 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.183 -0.314 25324 2319 1 4 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.133 -0.503 25324 2320 1 4 . 1 1 32 32 ASN H H 32 8.713 8.713 8.712 0.001 25324 2321 1 4 . 1 1 33 33 VAL N N 33 122.111 122.111 121.729 0.382 25324 2322 1 4 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.131 -0.426 25324 2323 1 4 . 1 1 33 33 VAL C C 33 174.950 174.950 175.799 -0.849 25324 2324 1 4 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.387 1.460 25324 2325 1 4 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.081 0.269 25324 2326 1 4 . 1 1 33 33 VAL H H 33 8.542 8.542 8.821 -0.279 25324 2327 1 4 . 1 1 34 34 VAL N N 34 113.282 113.282 118.516 -5.234 25324 2328 1 4 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.437 0.208 25324 2329 1 4 . 1 1 34 34 VAL C C 34 175.574 175.574 174.636 0.938 25324 2330 1 4 . 1 1 34 34 VAL CA C 34 59.974 59.974 60.994 -1.020 25324 2331 1 4 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.753 0.276 25324 2332 1 4 . 1 1 34 34 VAL H H 34 8.744 8.744 8.564 0.180 25324 2333 1 4 . 1 1 35 35 ALA N N 35 122.102 122.102 122.191 -0.089 25324 2334 1 4 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.243 -0.440 25324 2335 1 4 . 1 1 35 35 ALA C C 35 175.947 175.947 174.958 0.989 25324 2336 1 4 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.122 2.128 25324 2337 1 4 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.434 -0.806 25324 2338 1 4 . 1 1 35 35 ALA H H 35 7.677 7.677 7.845 -0.168 25324 2339 1 4 . 1 1 36 36 ILE N N 36 118.005 118.005 122.319 -4.314 25324 2340 1 4 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.256 -0.228 25324 2341 1 4 . 1 1 36 36 ILE C C 36 173.116 173.116 173.819 -0.703 25324 2342 1 4 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.084 1.098 25324 2343 1 4 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.586 0.899 25324 2344 1 4 . 1 1 36 36 ILE H H 36 8.126 8.126 8.996 -0.870 25324 2345 1 4 . 1 1 37 37 ASN N N 37 125.632 125.632 126.547 -0.915 25324 2346 1 4 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.721 -0.040 25324 2347 1 4 . 1 1 37 37 ASN C C 37 174.854 174.854 173.518 1.336 25324 2348 1 4 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.153 0.377 25324 2349 1 4 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.401 -2.548 25324 2350 1 4 . 1 1 37 37 ASN H H 37 8.577 8.577 8.861 -0.284 25324 2351 1 4 . 1 1 38 38 VAL N N 38 114.223 114.223 118.755 -4.532 25324 2352 1 4 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.995 0.208 25324 2353 1 4 . 1 1 38 38 VAL C C 38 174.854 174.854 173.391 1.463 25324 2354 1 4 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.837 -1.857 25324 2355 1 4 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.241 0.803 25324 2356 1 4 . 1 1 38 38 VAL H H 38 8.874 8.874 8.739 0.135 25324 2357 1 4 . 1 1 39 39 GLU N N 39 118.277 118.277 123.052 -4.775 25324 2358 1 4 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.183 -0.101 25324 2359 1 4 . 1 1 39 39 GLU C C 39 174.548 174.548 175.598 -1.050 25324 2360 1 4 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.304 0.688 25324 2361 1 4 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.162 -0.584 25324 2362 1 4 . 1 1 39 39 GLU H H 39 8.761 8.761 9.275 -0.514 25324 2363 1 4 . 1 1 40 40 SER N N 40 114.960 114.960 121.884 -6.924 25324 2364 1 4 . 1 1 40 40 SER HA H 40 5.265 5.265 5.341 -0.076 25324 2365 1 4 . 1 1 40 40 SER C C 40 175.783 175.783 175.028 0.755 25324 2366 1 4 . 1 1 40 40 SER CA C 40 55.880 55.880 57.510 -1.630 25324 2367 1 4 . 1 1 40 40 SER CB C 40 65.911 65.911 64.063 1.848 25324 2368 1 4 . 1 1 40 40 SER H H 40 8.500 8.500 8.667 -0.167 25324 2369 1 4 . 1 1 41 41 GLY N N 41 117.567 117.567 110.096 7.471 25324 2370 1 4 . 1 1 41 41 GLY C C 41 174.119 174.119 174.323 -0.204 25324 2371 1 4 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.377 -0.689 25324 2372 1 4 . 1 1 41 41 GLY H H 41 9.533 9.533 9.030 0.503 25324 2373 1 4 . 1 1 42 42 ASP N N 42 122.141 122.141 121.880 0.261 25324 2374 1 4 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.907 -0.107 25324 2375 1 4 . 1 1 42 42 ASP C C 42 176.121 176.121 175.429 0.692 25324 2376 1 4 . 1 1 42 42 ASP CA C 42 52.146 52.146 52.758 -0.612 25324 2377 1 4 . 1 1 42 42 ASP CB C 42 39.354 39.354 41.458 -2.104 25324 2378 1 4 . 1 1 42 42 ASP H H 42 8.644 8.644 8.002 0.642 25324 2379 1 4 . 1 1 43 43 ASP N N 43 116.025 116.025 125.366 -9.341 25324 2380 1 4 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.339 -0.110 25324 2381 1 4 . 1 1 43 43 ASP C C 43 176.018 176.018 176.129 -0.111 25324 2382 1 4 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.324 -0.075 25324 2383 1 4 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.575 -1.016 25324 2384 1 4 . 1 1 43 43 ASP H H 43 9.111 9.111 8.947 0.164 25324 2385 1 4 . 1 1 44 44 GLY N N 44 104.263 104.263 102.485 1.778 25324 2386 1 4 . 1 1 44 44 GLY C C 44 173.922 173.922 175.495 -1.573 25324 2387 1 4 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.747 -0.446 25324 2388 1 4 . 1 1 44 44 GLY H H 44 9.063 9.063 8.142 0.921 25324 2389 1 4 . 1 1 45 45 GLN N N 45 121.691 121.691 119.212 2.479 25324 2390 1 4 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.190 -0.104 25324 2391 1 4 . 1 1 45 45 GLN C C 45 176.284 176.284 175.126 1.158 25324 2392 1 4 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.313 -0.195 25324 2393 1 4 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.718 -2.044 25324 2394 1 4 . 1 1 45 45 GLN H H 45 7.356 7.356 8.376 -1.020 25324 2395 1 4 . 1 1 46 46 THR N N 46 111.843 111.843 111.639 0.204 25324 2396 1 4 . 1 1 46 46 THR HA H 46 5.355 5.355 5.352 0.003 25324 2397 1 4 . 1 1 46 46 THR C C 46 174.451 174.451 173.429 1.022 25324 2398 1 4 . 1 1 46 46 THR CA C 46 59.644 59.644 60.202 -0.558 25324 2399 1 4 . 1 1 46 46 THR CB C 46 72.714 72.714 69.737 2.976 25324 2400 1 4 . 1 1 46 46 THR H H 46 10.123 10.123 7.496 2.627 25324 2401 1 4 . 1 1 47 47 LEU N N 47 119.302 119.302 127.983 -8.681 25324 2402 1 4 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.452 0.355 25324 2403 1 4 . 1 1 47 47 LEU C C 47 175.487 175.487 175.491 -0.004 25324 2404 1 4 . 1 1 47 47 LEU CA C 47 53.070 53.070 54.488 -1.418 25324 2405 1 4 . 1 1 47 47 LEU CB C 47 48.003 48.003 42.585 5.418 25324 2406 1 4 . 1 1 47 47 LEU H H 47 8.364 8.364 8.573 -0.209 25324 2407 1 4 . 1 1 48 48 ASN N N 48 116.844 116.844 121.081 -4.237 25324 2408 1 4 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.919 -0.190 25324 2409 1 4 . 1 1 48 48 ASN C C 48 174.460 174.460 174.891 -0.431 25324 2410 1 4 . 1 1 48 48 ASN CA C 48 52.739 52.739 52.124 0.615 25324 2411 1 4 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.490 0.923 25324 2412 1 4 . 1 1 48 48 ASN H H 48 8.748 8.748 8.961 -0.213 25324 2413 1 4 . 1 1 49 49 GLY N N 49 109.417 109.417 110.191 -0.774 25324 2414 1 4 . 1 1 49 49 GLY C C 49 172.126 172.126 172.191 -0.065 25324 2415 1 4 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.316 0.175 25324 2416 1 4 . 1 1 49 49 GLY H H 49 8.744 8.744 8.913 -0.169 25324 2417 1 4 . 1 1 50 50 THR N N 50 119.162 119.162 117.465 1.697 25324 2418 1 4 . 1 1 50 50 THR HA H 50 5.556 5.556 5.371 0.185 25324 2419 1 4 . 1 1 50 50 THR C C 50 171.790 171.790 172.712 -0.922 25324 2420 1 4 . 1 1 50 50 THR CA C 50 59.371 59.371 62.188 -2.817 25324 2421 1 4 . 1 1 50 50 THR CB C 50 72.799 72.799 71.907 0.892 25324 2422 1 4 . 1 1 50 50 THR H H 50 8.799 8.799 8.883 -0.084 25324 2423 1 4 . 1 1 51 51 MET N N 51 115.232 115.232 126.685 -11.453 25324 2424 1 4 . 1 1 51 51 MET HA H 51 4.886 4.886 5.028 -0.142 25324 2425 1 4 . 1 1 51 51 MET C C 51 172.708 172.708 173.609 -0.901 25324 2426 1 4 . 1 1 51 51 MET CA C 51 54.722 54.722 53.802 0.920 25324 2427 1 4 . 1 1 51 51 MET CB C 51 34.557 34.557 37.295 -2.738 25324 2428 1 4 . 1 1 51 51 MET H H 51 9.062 9.062 9.396 -0.334 25324 2429 1 4 . 1 1 52 52 THR N N 52 113.697 113.697 123.259 -9.562 25324 2430 1 4 . 1 1 52 52 THR HA H 52 4.682 4.682 4.803 -0.121 25324 2431 1 4 . 1 1 52 52 THR C C 52 173.952 173.952 173.496 0.456 25324 2432 1 4 . 1 1 52 52 THR CA C 52 61.395 61.395 61.260 0.135 25324 2433 1 4 . 1 1 52 52 THR CB C 52 71.734 71.734 71.078 0.656 25324 2434 1 4 . 1 1 52 52 THR H H 52 8.685 8.685 8.757 -0.072 25324 2435 1 4 . 1 1 53 53 TYR N N 53 129.086 129.086 125.110 3.976 25324 2436 1 4 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.708 0.092 25324 2437 1 4 . 1 1 53 53 TYR C C 53 175.214 175.214 176.361 -1.147 25324 2438 1 4 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.406 0.475 25324 2439 1 4 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.602 0.910 25324 2440 1 4 . 1 1 53 53 TYR H H 53 10.112 10.112 8.785 1.327 25324 2441 1 4 . 1 1 54 54 ALA N N 54 119.947 119.947 123.720 -3.773 25324 2442 1 4 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.236 -0.234 25324 2443 1 4 . 1 1 54 54 ALA C C 54 178.285 178.285 178.044 0.241 25324 2444 1 4 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.494 0.477 25324 2445 1 4 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.035 0.682 25324 2446 1 4 . 1 1 54 54 ALA H H 54 8.704 8.704 8.607 0.097 25324 2447 1 4 . 1 1 55 55 GLY N N 55 110.940 110.940 111.623 -0.683 25324 2448 1 4 . 1 1 55 55 GLY C C 55 173.903 173.903 174.348 -0.445 25324 2449 1 4 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.487 -0.471 25324 2450 1 4 . 1 1 55 55 GLY H H 55 8.745 8.745 8.606 0.139 25324 2451 1 4 . 1 1 56 56 GLU N N 56 120.073 120.073 120.336 -0.263 25324 2452 1 4 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.656 0.053 25324 2453 1 4 . 1 1 56 56 GLU C C 56 175.906 175.906 176.452 -0.546 25324 2454 1 4 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.518 -0.095 25324 2455 1 4 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.249 0.575 25324 2456 1 4 . 1 1 56 56 GLU H H 56 8.039 8.039 7.964 0.075 25324 2457 1 4 . 1 1 57 57 GLY N N 57 105.298 105.298 108.637 -3.339 25324 2458 1 4 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.709 0.093 25324 2459 1 4 . 1 1 57 57 GLY H H 57 7.937 7.937 8.398 -0.461 25324 2460 1 4 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.620 0.314 25324 2461 1 4 . 1 1 58 58 PRO C C 58 177.785 177.785 176.399 1.386 25324 2462 1 4 . 1 1 58 58 PRO CA C 58 63.132 63.132 62.955 0.177 25324 2463 1 4 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.480 -0.640 25324 2464 1 4 . 1 1 59 59 ILE N N 59 117.386 117.386 116.648 0.738 25324 2465 1 4 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.731 0.257 25324 2466 1 4 . 1 1 59 59 ILE C C 59 175.688 175.688 175.101 0.587 25324 2467 1 4 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.143 0.400 25324 2468 1 4 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.411 0.877 25324 2469 1 4 . 1 1 59 59 ILE H H 59 9.600 9.600 8.852 0.748 25324 2470 1 4 . 1 1 60 60 GLY N N 60 107.164 107.164 107.993 -0.829 25324 2471 1 4 . 1 1 60 60 GLY C C 60 173.787 173.787 172.582 1.205 25324 2472 1 4 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.526 1.709 25324 2473 1 4 . 1 1 60 60 GLY H H 60 8.957 8.957 8.573 0.384 25324 2474 1 4 . 1 1 61 61 PHE N N 61 124.597 124.597 126.519 -1.922 25324 2475 1 4 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.059 0.164 25324 2476 1 4 . 1 1 61 61 PHE C C 61 173.126 173.126 173.281 -0.155 25324 2477 1 4 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.871 -0.010 25324 2478 1 4 . 1 1 61 61 PHE CB C 61 43.217 43.217 42.959 0.258 25324 2479 1 4 . 1 1 61 61 PHE H H 61 8.788 8.788 9.164 -0.376 25324 2480 1 4 . 1 1 62 62 ARG N N 62 129.706 129.706 127.905 1.801 25324 2481 1 4 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.484 -0.352 25324 2482 1 4 . 1 1 62 62 ARG C C 62 172.456 172.456 173.099 -0.643 25324 2483 1 4 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.790 1.164 25324 2484 1 4 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.307 -1.437 25324 2485 1 4 . 1 1 62 62 ARG H H 62 8.405 8.405 8.407 -0.002 25324 2486 1 4 . 1 1 63 63 ALA N N 63 122.744 122.744 129.438 -6.694 25324 2487 1 4 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.222 0.123 25324 2488 1 4 . 1 1 63 63 ALA C C 63 176.120 176.120 175.741 0.379 25324 2489 1 4 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.072 -0.153 25324 2490 1 4 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.570 2.203 25324 2491 1 4 . 1 1 63 63 ALA H H 63 8.628 8.628 8.774 -0.146 25324 2492 1 4 . 1 1 64 64 THR N N 64 116.855 116.855 120.538 -3.683 25324 2493 1 4 . 1 1 64 64 THR HA H 64 4.848 4.848 5.101 -0.253 25324 2494 1 4 . 1 1 64 64 THR C C 64 172.957 172.957 174.090 -1.133 25324 2495 1 4 . 1 1 64 64 THR CA C 64 61.211 61.211 61.058 0.153 25324 2496 1 4 . 1 1 64 64 THR CB C 64 71.064 71.064 70.854 0.210 25324 2497 1 4 . 1 1 64 64 THR H H 64 8.315 8.315 8.990 -0.675 25324 2498 1 4 . 1 1 65 65 LEU N N 65 129.360 129.360 129.511 -0.151 25324 2499 1 4 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.559 -0.197 25324 2500 1 4 . 1 1 65 65 LEU C C 65 176.459 176.459 175.588 0.871 25324 2501 1 4 . 1 1 65 65 LEU CA C 65 55.687 55.687 55.813 -0.126 25324 2502 1 4 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.686 0.025 25324 2503 1 4 . 1 1 65 65 LEU H H 65 8.877 8.877 8.970 -0.093 25324 2504 1 4 . 1 1 66 66 LEU N N 66 128.683 128.683 127.375 1.308 25324 2505 1 4 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.269 0.107 25324 2506 1 4 . 1 1 66 66 LEU C C 66 177.621 177.621 177.591 0.030 25324 2507 1 4 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.070 -1.370 25324 2508 1 4 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.592 -0.290 25324 2509 1 4 . 1 1 66 66 LEU H H 66 9.320 9.320 8.801 0.519 25324 2510 1 4 . 1 1 67 67 GLY N N 67 105.361 105.361 105.602 -0.241 25324 2511 1 4 . 1 1 67 67 GLY C C 67 173.618 173.618 173.817 -0.199 25324 2512 1 4 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.564 -2.197 25324 2513 1 4 . 1 1 67 67 GLY H H 67 6.639 6.639 7.590 -0.951 25324 2514 1 4 . 1 1 68 68 ASN N N 68 121.848 121.848 116.253 5.595 25324 2515 1 4 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.721 -0.390 25324 2516 1 4 . 1 1 68 68 ASN C C 68 174.316 174.316 174.799 -0.483 25324 2517 1 4 . 1 1 68 68 ASN CA C 68 54.552 54.552 53.456 1.097 25324 2518 1 4 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.050 -1.885 25324 2519 1 4 . 1 1 68 68 ASN H H 68 9.236 9.236 7.975 1.261 25324 2520 1 4 . 1 1 69 69 ASN N N 69 109.509 109.509 118.322 -8.813 25324 2521 1 4 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.671 -0.591 25324 2522 1 4 . 1 1 69 69 ASN C C 69 171.456 171.456 175.604 -4.148 25324 2523 1 4 . 1 1 69 69 ASN CA C 69 55.750 55.750 55.216 0.534 25324 2524 1 4 . 1 1 69 69 ASN CB C 69 37.306 37.306 38.825 -1.519 25324 2525 1 4 . 1 1 69 69 ASN H H 69 8.651 8.651 8.407 0.244 25324 2526 1 4 . 1 1 70 70 SER N N 70 113.479 113.479 113.833 -0.354 25324 2527 1 4 . 1 1 70 70 SER HA H 70 5.437 5.437 4.806 0.631 25324 2528 1 4 . 1 1 70 70 SER C C 70 173.750 173.750 173.069 0.681 25324 2529 1 4 . 1 1 70 70 SER CA C 70 57.139 57.139 58.812 -1.673 25324 2530 1 4 . 1 1 70 70 SER CB C 70 63.818 63.818 63.780 0.038 25324 2531 1 4 . 1 1 70 70 SER H H 70 7.693 7.693 7.773 -0.080 25324 2532 1 4 . 1 1 71 71 TYR N N 71 123.132 123.132 126.178 -3.046 25324 2533 1 4 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.001 0.142 25324 2534 1 4 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.752 -0.104 25324 2535 1 4 . 1 1 71 71 TYR CB C 71 42.445 42.445 43.041 -0.597 25324 2536 1 4 . 1 1 71 71 TYR H H 71 9.326 9.326 9.605 -0.279 25324 2537 1 4 . 1 1 72 72 GLU N N 72 122.396 122.396 122.726 -0.330 25324 2538 1 4 . 1 1 72 72 GLU HA H 72 4.806 4.806 5.046 -0.240 25324 2539 1 4 . 1 1 72 72 GLU C C 72 175.698 175.698 174.781 0.917 25324 2540 1 4 . 1 1 72 72 GLU CA C 72 55.167 55.167 54.823 0.344 25324 2541 1 4 . 1 1 72 72 GLU CB C 72 30.184 30.184 32.568 -2.384 25324 2542 1 4 . 1 1 72 72 GLU H H 72 8.624 8.624 9.228 -0.604 25324 2543 1 4 . 1 1 73 73 VAL N N 73 128.513 128.513 126.871 1.642 25324 2544 1 4 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.478 -0.279 25324 2545 1 4 . 1 1 73 73 VAL C C 73 175.369 175.369 174.656 0.713 25324 2546 1 4 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.426 1.054 25324 2547 1 4 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.340 -0.007 25324 2548 1 4 . 1 1 73 73 VAL H H 73 8.564 8.564 9.192 -0.628 25324 2549 1 4 . 1 1 74 74 GLU N N 74 124.842 124.842 125.392 -0.550 25324 2550 1 4 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.059 0.028 25324 2551 1 4 . 1 1 74 74 GLU C C 74 174.415 174.415 174.756 -0.341 25324 2552 1 4 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.874 -0.537 25324 2553 1 4 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.055 2.102 25324 2554 1 4 . 1 1 74 74 GLU H H 74 9.011 9.011 9.007 0.004 25324 2555 1 4 . 1 1 75 75 ASN N N 75 116.136 116.136 122.154 -6.018 25324 2556 1 4 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.695 0.444 25324 2557 1 4 . 1 1 75 75 ASN C C 75 172.703 172.703 173.627 -0.924 25324 2558 1 4 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.379 -0.554 25324 2559 1 4 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.454 3.442 25324 2560 1 4 . 1 1 75 75 ASN H H 75 9.424 9.424 8.889 0.535 25324 2561 1 4 . 1 1 76 76 GLN N N 76 120.762 120.762 122.264 -1.502 25324 2562 1 4 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.449 -0.409 25324 2563 1 4 . 1 1 76 76 GLN C C 76 173.113 173.113 174.027 -0.914 25324 2564 1 4 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.208 0.015 25324 2565 1 4 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.942 -0.594 25324 2566 1 4 . 1 1 76 76 GLN H H 76 7.106 7.106 8.615 -1.509 25324 2567 1 4 . 1 1 77 77 TRP N N 77 125.598 125.598 124.229 1.369 25324 2568 1 4 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.089 0.063 25324 2569 1 4 . 1 1 77 77 TRP C C 77 175.502 175.502 175.777 -0.275 25324 2570 1 4 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.786 -1.022 25324 2571 1 4 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.801 -0.802 25324 2572 1 4 . 1 1 77 77 TRP H H 77 8.181 8.181 8.075 0.106 25324 2573 1 4 . 1 1 78 78 GLY N N 78 107.901 107.901 108.587 -0.686 25324 2574 1 4 . 1 1 78 78 GLY C C 78 174.611 174.611 173.947 0.664 25324 2575 1 4 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.444 -0.542 25324 2576 1 4 . 1 1 78 78 GLY H H 78 8.778 8.778 8.932 -0.154 25324 2577 1 4 . 1 1 79 79 GLY N N 79 109.844 109.844 108.096 1.748 25324 2578 1 4 . 1 1 79 79 GLY C C 79 173.782 173.782 173.933 -0.151 25324 2579 1 4 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.517 -0.724 25324 2580 1 4 . 1 1 79 79 GLY H H 79 8.198 8.198 7.615 0.583 25324 2581 1 4 . 1 1 80 80 ASP N N 80 115.837 115.837 120.224 -4.387 25324 2582 1 4 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.331 -0.090 25324 2583 1 4 . 1 1 80 80 ASP C C 80 177.285 177.285 176.826 0.459 25324 2584 1 4 . 1 1 80 80 ASP CA C 80 56.183 56.183 56.227 -0.044 25324 2585 1 4 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.898 -0.375 25324 2586 1 4 . 1 1 80 80 ASP H H 80 8.132 8.132 8.713 -0.581 25324 2587 1 4 . 1 1 81 81 SER N N 81 112.690 112.690 114.697 -2.007 25324 2588 1 4 . 1 1 81 81 SER HA H 81 4.513 4.513 4.402 0.111 25324 2589 1 4 . 1 1 81 81 SER C C 81 173.684 173.684 173.874 -0.190 25324 2590 1 4 . 1 1 81 81 SER CA C 81 57.232 57.232 58.278 -1.046 25324 2591 1 4 . 1 1 81 81 SER CB C 81 63.170 63.170 63.304 -0.134 25324 2592 1 4 . 1 1 81 81 SER H H 81 8.179 8.179 8.082 0.097 25324 2593 1 4 . 1 1 82 82 ALA N N 82 126.310 126.310 125.317 0.993 25324 2594 1 4 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.430 -0.027 25324 2595 1 4 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.750 0.716 25324 2596 1 4 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.576 -0.378 25324 2597 1 4 . 1 1 82 82 ALA H H 82 7.274 7.274 7.263 0.011 25324 2598 1 4 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.245 0.128 25324 2599 1 4 . 1 1 83 83 PRO C C 83 175.378 175.378 175.332 0.046 25324 2600 1 4 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.206 0.121 25324 2601 1 4 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.515 -0.351 25324 2602 1 4 . 1 1 84 84 TRP N N 84 120.106 120.106 116.956 3.150 25324 2603 1 4 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.382 -0.111 25324 2604 1 4 . 1 1 84 84 TRP C C 84 176.358 176.358 175.953 0.405 25324 2605 1 4 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.939 0.007 25324 2606 1 4 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.759 -1.043 25324 2607 1 4 . 1 1 84 84 TRP H H 84 8.329 8.329 7.999 0.330 25324 2608 1 4 . 1 1 85 85 HIS N N 85 118.543 118.543 120.466 -1.923 25324 2609 1 4 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.919 -0.001 25324 2610 1 4 . 1 1 85 85 HIS C C 85 174.950 174.950 174.934 0.016 25324 2611 1 4 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.025 -1.556 25324 2612 1 4 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.255 -1.582 25324 2613 1 4 . 1 1 85 85 HIS H H 85 9.204 9.204 8.959 0.245 25324 2614 1 4 . 1 1 86 86 SER N N 86 117.803 117.803 116.654 1.149 25324 2615 1 4 . 1 1 86 86 SER HA H 86 4.412 4.412 4.221 0.191 25324 2616 1 4 . 1 1 86 86 SER C C 86 175.691 175.691 174.453 1.238 25324 2617 1 4 . 1 1 86 86 SER CA C 86 60.257 60.257 58.947 1.310 25324 2618 1 4 . 1 1 86 86 SER CB C 86 63.015 63.015 63.490 -0.475 25324 2619 1 4 . 1 1 86 86 SER H H 86 9.168 9.168 8.798 0.370 25324 2620 1 4 . 1 1 87 87 GLY N N 87 115.773 115.773 112.459 3.314 25324 2621 1 4 . 1 1 87 87 GLY C C 87 174.288 174.288 174.151 0.137 25324 2622 1 4 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.899 -0.198 25324 2623 1 4 . 1 1 87 87 GLY H H 87 9.284 9.284 8.826 0.458 25324 2624 1 4 . 1 1 88 88 GLY N N 88 109.162 109.162 109.138 0.024 25324 2625 1 4 . 1 1 88 88 GLY C C 88 171.120 171.120 171.921 -0.801 25324 2626 1 4 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.394 -0.800 25324 2627 1 4 . 1 1 88 88 GLY H H 88 8.054 8.054 8.067 -0.013 25324 2628 1 4 . 1 1 89 89 ASN N N 89 117.048 117.048 120.049 -3.001 25324 2629 1 4 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.832 0.206 25324 2630 1 4 . 1 1 89 89 ASN C C 89 175.287 175.287 174.433 0.854 25324 2631 1 4 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.540 -1.675 25324 2632 1 4 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.179 -1.574 25324 2633 1 4 . 1 1 89 89 ASN H H 89 8.516 8.516 8.232 0.284 25324 2634 1 4 . 1 1 90 90 TRP N N 90 125.844 125.844 121.643 4.201 25324 2635 1 4 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.134 0.119 25324 2636 1 4 . 1 1 90 90 TRP C C 90 175.278 175.278 174.785 0.493 25324 2637 1 4 . 1 1 90 90 TRP CA C 90 54.268 54.268 55.176 -0.908 25324 2638 1 4 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.829 -0.871 25324 2639 1 4 . 1 1 90 90 TRP H H 90 9.282 9.282 9.346 -0.064 25324 2640 1 4 . 1 1 91 91 ILE N N 91 123.134 123.134 121.272 1.862 25324 2641 1 4 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.065 0.381 25324 2642 1 4 . 1 1 91 91 ILE C C 91 175.489 175.489 175.169 0.320 25324 2643 1 4 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.996 0.830 25324 2644 1 4 . 1 1 91 91 ILE CB C 91 39.676 39.676 37.999 1.677 25324 2645 1 4 . 1 1 91 91 ILE H H 91 9.318 9.318 8.734 0.584 25324 2646 1 4 . 1 1 92 92 LEU N N 92 123.452 123.452 128.013 -4.561 25324 2647 1 4 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.701 0.241 25324 2648 1 4 . 1 1 92 92 LEU C C 92 173.620 173.620 174.675 -1.055 25324 2649 1 4 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.402 -1.146 25324 2650 1 4 . 1 1 92 92 LEU CB C 92 43.508 43.508 40.826 2.682 25324 2651 1 4 . 1 1 92 92 LEU H H 92 8.463 8.463 8.861 -0.398 25324 2652 1 4 . 1 1 93 93 GLY N N 93 103.987 103.987 108.130 -4.143 25324 2653 1 4 . 1 1 93 93 GLY C C 93 172.284 172.284 174.112 -1.828 25324 2654 1 4 . 1 1 93 93 GLY CA C 93 43.500 43.500 46.050 -2.550 25324 2655 1 4 . 1 1 93 93 GLY H H 93 2.937 2.937 7.616 -4.679 25324 2656 1 4 . 1 1 94 94 SER N N 94 110.274 110.274 114.039 -3.765 25324 2657 1 4 . 1 1 94 94 SER HA H 94 4.711 4.711 4.334 0.377 25324 2658 1 4 . 1 1 94 94 SER C C 94 174.784 174.784 173.769 1.015 25324 2659 1 4 . 1 1 94 94 SER CA C 94 56.555 56.555 60.116 -3.561 25324 2660 1 4 . 1 1 94 94 SER CB C 94 65.051 65.051 62.827 2.224 25324 2661 1 4 . 1 1 94 94 SER H H 94 7.919 7.919 8.850 -0.931 25324 2662 1 4 . 1 1 95 95 ARG N N 95 123.020 123.020 119.248 3.772 25324 2663 1 4 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.609 0.063 25324 2664 1 4 . 1 1 95 95 ARG C C 95 176.120 176.120 175.505 0.615 25324 2665 1 4 . 1 1 95 95 ARG CA C 95 55.374 55.374 53.988 1.386 25324 2666 1 4 . 1 1 95 95 ARG CB C 95 31.848 31.848 32.623 -0.775 25324 2667 1 4 . 1 1 95 95 ARG H H 95 9.148 9.148 7.330 1.818 25324 2668 1 4 . 1 1 96 96 GLU N N 96 120.357 120.357 123.105 -2.748 25324 2669 1 4 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.235 0.047 25324 2670 1 4 . 1 1 96 96 GLU C C 96 176.278 176.278 176.680 -0.402 25324 2671 1 4 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.694 -2.164 25324 2672 1 4 . 1 1 96 96 GLU CB C 96 30.153 30.153 30.172 -0.019 25324 2673 1 4 . 1 1 96 96 GLU H H 96 8.610 8.610 8.866 -0.256 25324 2674 1 4 . 1 1 97 97 ASN N N 97 117.678 117.678 113.579 4.099 25324 2675 1 4 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.786 -0.174 25324 2676 1 4 . 1 1 97 97 ASN C C 97 173.949 173.949 173.810 0.139 25324 2677 1 4 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.670 0.345 25324 2678 1 4 . 1 1 97 97 ASN CB C 97 38.166 38.166 39.025 -0.859 25324 2679 1 4 . 1 1 97 97 ASN H H 97 8.533 8.533 8.134 0.399 25324 2680 1 4 . 1 1 98 98 GLN N N 98 118.592 118.592 119.024 -0.432 25324 2681 1 4 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.561 -0.201 25324 2682 1 4 . 1 1 98 98 GLN C C 98 173.116 173.116 173.795 -0.679 25324 2683 1 4 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.153 0.475 25324 2684 1 4 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.617 -0.748 25324 2685 1 4 . 1 1 98 98 GLN H H 98 7.663 7.663 7.564 0.099 25324 2686 1 4 . 1 1 99 99 ASN N N 99 122.855 122.855 120.238 2.617 25324 2687 1 4 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.133 0.002 25324 2688 1 4 . 1 1 99 99 ASN C C 99 175.287 175.287 174.874 0.413 25324 2689 1 4 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.038 0.952 25324 2690 1 4 . 1 1 99 99 ASN CB C 99 40.491 40.491 41.351 -0.860 25324 2691 1 4 . 1 1 99 99 ASN H H 99 8.759 8.759 8.625 0.134 25324 2692 1 4 . 1 1 100 100 VAL N N 100 121.385 121.385 115.257 6.128 25324 2693 1 4 . 1 1 100 100 VAL HA H 100 3.748 3.748 4.043 -0.295 25324 2694 1 4 . 1 1 100 100 VAL C C 100 174.956 174.956 175.864 -0.908 25324 2695 1 4 . 1 1 100 100 VAL CA C 100 63.843 63.843 62.724 1.119 25324 2696 1 4 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.650 0.793 25324 2697 1 4 . 1 1 100 100 VAL H H 100 8.717 8.717 7.900 0.817 25324 2698 1 4 . 1 1 101 101 VAL N N 101 112.736 112.736 117.538 -4.802 25324 2699 1 4 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.489 0.156 25324 2700 1 4 . 1 1 101 101 VAL C C 101 175.577 175.577 174.706 0.871 25324 2701 1 4 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.457 -1.494 25324 2702 1 4 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.517 -0.476 25324 2703 1 4 . 1 1 101 101 VAL H H 101 8.802 8.802 8.729 0.073 25324 2704 1 4 . 1 1 102 102 ALA N N 102 122.104 122.104 121.429 0.675 25324 2705 1 4 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.178 -0.371 25324 2706 1 4 . 1 1 102 102 ALA C C 102 176.046 176.046 174.834 1.212 25324 2707 1 4 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.999 2.255 25324 2708 1 4 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.140 -0.515 25324 2709 1 4 . 1 1 102 102 ALA H H 102 7.677 7.677 7.685 -0.008 25324 2710 1 4 . 1 1 103 103 ILE N N 103 118.218 118.218 122.415 -4.197 25324 2711 1 4 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.317 -0.290 25324 2712 1 4 . 1 1 103 103 ILE C C 103 173.118 173.118 173.844 -0.726 25324 2713 1 4 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.438 1.789 25324 2714 1 4 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.346 1.125 25324 2715 1 4 . 1 1 103 103 ILE H H 103 8.102 8.102 8.533 -0.431 25324 2716 1 4 . 1 1 104 104 ASN N N 104 125.938 125.938 126.774 -0.836 25324 2717 1 4 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.437 0.249 25324 2718 1 4 . 1 1 104 104 ASN C C 104 174.870 174.870 173.587 1.283 25324 2719 1 4 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.238 0.315 25324 2720 1 4 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.517 -1.665 25324 2721 1 4 . 1 1 104 104 ASN H H 104 8.668 8.668 8.863 -0.195 25324 2722 1 4 . 1 1 105 105 VAL N N 105 114.631 114.631 120.106 -5.475 25324 2723 1 4 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.143 0.062 25324 2724 1 4 . 1 1 105 105 VAL C C 105 174.788 174.788 173.691 1.097 25324 2725 1 4 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.271 -2.292 25324 2726 1 4 . 1 1 105 105 VAL CB C 105 36.040 36.040 34.820 1.220 25324 2727 1 4 . 1 1 105 105 VAL H H 105 8.933 8.933 8.921 0.012 25324 2728 1 4 . 1 1 106 106 GLU N N 106 118.347 118.347 123.722 -5.375 25324 2729 1 4 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.363 -0.283 25324 2730 1 4 . 1 1 106 106 GLU C C 106 174.777 174.777 174.812 -0.035 25324 2731 1 4 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.039 -0.072 25324 2732 1 4 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.664 -1.021 25324 2733 1 4 . 1 1 106 106 GLU H H 106 8.814 8.814 9.028 -0.214 25324 2734 1 4 . 1 1 107 107 SER N N 107 115.335 115.335 116.787 -1.452 25324 2735 1 4 . 1 1 107 107 SER HA H 107 5.266 5.266 4.843 0.423 25324 2736 1 4 . 1 1 107 107 SER C C 107 175.787 175.787 175.310 0.477 25324 2737 1 4 . 1 1 107 107 SER CA C 107 55.888 55.888 56.567 -0.679 25324 2738 1 4 . 1 1 107 107 SER CB C 107 65.921 65.921 64.814 1.107 25324 2739 1 4 . 1 1 107 107 SER H H 107 8.576 8.576 8.400 0.176 25324 2740 1 4 . 1 1 108 108 GLY N N 108 117.567 117.567 112.484 5.083 25324 2741 1 4 . 1 1 108 108 GLY C C 108 173.959 173.959 174.491 -0.532 25324 2742 1 4 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.069 -0.392 25324 2743 1 4 . 1 1 108 108 GLY H H 108 9.532 9.532 8.721 0.811 25324 2744 1 4 . 1 1 109 109 ASP N N 109 122.108 122.108 121.502 0.606 25324 2745 1 4 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.801 -0.000 25324 2746 1 4 . 1 1 109 109 ASP C C 109 176.203 176.203 175.497 0.706 25324 2747 1 4 . 1 1 109 109 ASP CA C 109 52.134 52.134 53.151 -1.017 25324 2748 1 4 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.340 -2.998 25324 2749 1 4 . 1 1 109 109 ASP H H 109 8.605 8.605 7.750 0.855 25324 2750 1 4 . 1 1 110 110 ASP N N 110 116.197 116.197 117.561 -1.364 25324 2751 1 4 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.548 -0.326 25324 2752 1 4 . 1 1 110 110 ASP C C 110 175.951 175.951 176.377 -0.426 25324 2753 1 4 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.477 1.721 25324 2754 1 4 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.301 -1.671 25324 2755 1 4 . 1 1 110 110 ASP H H 110 9.087 9.087 8.490 0.597 25324 2756 1 4 . 1 1 111 111 GLY N N 111 103.841 103.841 107.714 -3.873 25324 2757 1 4 . 1 1 111 111 GLY C C 111 173.924 173.924 175.091 -1.167 25324 2758 1 4 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.132 0.031 25324 2759 1 4 . 1 1 111 111 GLY H H 111 8.930 8.930 7.877 1.053 25324 2760 1 4 . 1 1 112 112 GLN N N 112 121.626 121.626 118.971 2.655 25324 2761 1 4 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.068 0.002 25324 2762 1 4 . 1 1 112 112 GLN C C 112 176.431 176.431 175.499 0.932 25324 2763 1 4 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.440 -0.167 25324 2764 1 4 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.385 -1.692 25324 2765 1 4 . 1 1 112 112 GLN H H 112 7.351 7.351 8.544 -1.193 25324 2766 1 4 . 1 1 113 113 THR N N 113 112.322 112.322 106.403 5.919 25324 2767 1 4 . 1 1 113 113 THR HA H 113 5.331 5.331 5.413 -0.082 25324 2768 1 4 . 1 1 113 113 THR C C 113 174.452 174.452 172.822 1.630 25324 2769 1 4 . 1 1 113 113 THR CA C 113 59.739 59.739 59.232 0.507 25324 2770 1 4 . 1 1 113 113 THR CB C 113 71.773 71.773 72.225 -0.452 25324 2771 1 4 . 1 1 113 113 THR H H 113 10.053 10.053 7.439 2.614 25324 2772 1 4 . 1 1 114 114 LEU N N 114 122.083 122.083 123.078 -0.995 25324 2773 1 4 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.715 -0.134 25324 2774 1 4 . 1 1 114 114 LEU C C 114 175.113 175.113 175.069 0.044 25324 2775 1 4 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.874 -0.970 25324 2776 1 4 . 1 1 114 114 LEU CB C 114 47.033 47.033 44.422 2.611 25324 2777 1 4 . 1 1 114 114 LEU H H 114 8.978 8.978 8.988 -0.010 25324 2778 1 4 . 1 1 115 115 ASN N N 115 118.846 118.846 120.683 -1.837 25324 2779 1 4 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.816 -0.046 25324 2780 1 4 . 1 1 115 115 ASN C C 115 174.788 174.788 174.942 -0.154 25324 2781 1 4 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.926 0.416 25324 2782 1 4 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.432 0.982 25324 2783 1 4 . 1 1 115 115 ASN H H 115 8.837 8.837 8.105 0.732 25324 2784 1 4 . 1 1 116 116 GLY N N 116 109.661 109.661 109.688 -0.027 25324 2785 1 4 . 1 1 116 116 GLY C C 116 172.452 172.452 172.264 0.188 25324 2786 1 4 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.326 0.145 25324 2787 1 4 . 1 1 116 116 GLY H H 116 8.625 8.625 8.767 -0.142 25324 2788 1 4 . 1 1 117 117 THR N N 117 120.009 120.009 114.248 5.761 25324 2789 1 4 . 1 1 117 117 THR HA H 117 5.556 5.556 5.590 -0.034 25324 2790 1 4 . 1 1 117 117 THR C C 117 171.619 171.619 173.454 -1.835 25324 2791 1 4 . 1 1 117 117 THR CA C 117 59.373 59.373 60.212 -0.839 25324 2792 1 4 . 1 1 117 117 THR CB C 117 72.777 72.777 72.492 0.285 25324 2793 1 4 . 1 1 117 117 THR H H 117 8.911 8.911 9.049 -0.138 25324 2794 1 4 . 1 1 118 118 MET N N 118 115.550 115.550 118.954 -3.404 25324 2795 1 4 . 1 1 118 118 MET HA H 118 4.889 4.889 5.249 -0.360 25324 2796 1 4 . 1 1 118 118 MET C C 118 172.707 172.707 174.184 -1.477 25324 2797 1 4 . 1 1 118 118 MET CA C 118 54.714 54.714 54.319 0.395 25324 2798 1 4 . 1 1 118 118 MET CB C 118 33.663 33.663 37.254 -3.591 25324 2799 1 4 . 1 1 118 118 MET H H 118 9.159 9.159 9.429 -0.270 25324 2800 1 4 . 1 1 119 119 THR N N 119 113.716 113.716 117.147 -3.431 25324 2801 1 4 . 1 1 119 119 THR HA H 119 4.682 4.682 4.878 -0.196 25324 2802 1 4 . 1 1 119 119 THR C C 119 173.952 173.952 173.246 0.706 25324 2803 1 4 . 1 1 119 119 THR CA C 119 61.395 61.395 61.414 -0.019 25324 2804 1 4 . 1 1 119 119 THR CB C 119 71.746 71.746 71.393 0.353 25324 2805 1 4 . 1 1 119 119 THR H H 119 8.685 8.685 8.820 -0.135 25324 2806 1 4 . 1 1 120 120 TYR N N 120 129.153 129.153 125.587 3.566 25324 2807 1 4 . 1 1 120 120 TYR HA H 120 4.800 4.800 5.089 -0.289 25324 2808 1 4 . 1 1 120 120 TYR C C 120 175.214 175.214 176.270 -1.056 25324 2809 1 4 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.263 1.614 25324 2810 1 4 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.926 -0.424 25324 2811 1 4 . 1 1 120 120 TYR H H 120 10.107 10.107 8.350 1.757 25324 2812 1 4 . 1 1 121 121 ALA N N 121 119.947 119.947 124.118 -4.171 25324 2813 1 4 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.268 -0.264 25324 2814 1 4 . 1 1 121 121 ALA C C 121 178.456 178.456 177.780 0.676 25324 2815 1 4 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.798 0.158 25324 2816 1 4 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.148 0.562 25324 2817 1 4 . 1 1 121 121 ALA H H 121 8.704 8.704 8.362 0.342 25324 2818 1 4 . 1 1 122 122 GLY N N 122 111.186 111.186 112.154 -0.968 25324 2819 1 4 . 1 1 122 122 GLY C C 122 173.949 173.949 173.924 0.025 25324 2820 1 4 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.139 -0.137 25324 2821 1 4 . 1 1 122 122 GLY H H 122 8.792 8.792 8.753 0.039 25324 2822 1 4 . 1 1 123 123 GLU N N 123 120.099 120.099 120.090 0.009 25324 2823 1 4 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.672 0.033 25324 2824 1 4 . 1 1 123 123 GLU C C 123 175.912 175.912 175.801 0.111 25324 2825 1 4 . 1 1 123 123 GLU CA C 123 54.414 54.414 55.158 -0.744 25324 2826 1 4 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.668 0.116 25324 2827 1 4 . 1 1 123 123 GLU H H 123 8.072 8.072 7.917 0.155 25324 2828 1 4 . 1 1 124 124 GLY N N 124 105.303 105.303 111.263 -5.960 25324 2829 1 4 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.804 -0.002 25324 2830 1 4 . 1 1 124 124 GLY H H 124 7.939 7.939 8.568 -0.629 25324 2831 1 4 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.916 0.019 25324 2832 1 4 . 1 1 125 125 PRO C C 125 177.788 177.788 176.550 1.238 25324 2833 1 4 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.237 -0.106 25324 2834 1 4 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.378 -0.519 25324 2835 1 4 . 1 1 126 126 ILE N N 126 117.387 117.387 117.899 -0.512 25324 2836 1 4 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.666 0.233 25324 2837 1 4 . 1 1 126 126 ILE C C 126 175.625 175.625 175.088 0.537 25324 2838 1 4 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.126 0.327 25324 2839 1 4 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.508 1.040 25324 2840 1 4 . 1 1 126 126 ILE H H 126 9.599 9.599 9.013 0.586 25324 2841 1 4 . 1 1 127 127 GLY N N 127 106.753 106.753 107.760 -1.007 25324 2842 1 4 . 1 1 127 127 GLY C C 127 173.627 173.627 172.594 1.033 25324 2843 1 4 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.771 1.512 25324 2844 1 4 . 1 1 127 127 GLY H H 127 8.840 8.840 8.803 0.037 25324 2845 1 4 . 1 1 128 128 PHE N N 128 124.826 124.826 126.282 -1.456 25324 2846 1 4 . 1 1 128 128 PHE HA H 128 4.944 4.944 4.998 -0.054 25324 2847 1 4 . 1 1 128 128 PHE C C 128 173.087 173.087 173.174 -0.087 25324 2848 1 4 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.957 0.052 25324 2849 1 4 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.143 0.017 25324 2850 1 4 . 1 1 128 128 PHE H H 128 8.924 8.924 9.196 -0.272 25324 2851 1 4 . 1 1 129 129 LYS N N 129 131.518 131.518 128.266 3.252 25324 2852 1 4 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.842 0.041 25324 2853 1 4 . 1 1 129 129 LYS C C 129 173.863 173.863 174.153 -0.290 25324 2854 1 4 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.228 1.507 25324 2855 1 4 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.403 -0.682 25324 2856 1 4 . 1 1 129 129 LYS H H 129 8.201 8.201 8.042 0.159 25324 2857 1 4 . 1 1 130 130 GLY N N 130 114.030 114.030 113.741 0.289 25324 2858 1 4 . 1 1 130 130 GLY C C 130 171.951 171.951 172.956 -1.005 25324 2859 1 4 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.738 0.049 25324 2860 1 4 . 1 1 130 130 GLY H H 130 9.325 9.325 8.796 0.529 25324 2861 1 4 . 1 1 131 131 THR N N 131 120.583 120.583 121.798 -1.215 25324 2862 1 4 . 1 1 131 131 THR HA H 131 4.939 4.939 4.890 0.049 25324 2863 1 4 . 1 1 131 131 THR C C 131 173.118 173.118 173.943 -0.825 25324 2864 1 4 . 1 1 131 131 THR CA C 131 61.266 61.266 61.291 -0.025 25324 2865 1 4 . 1 1 131 131 THR CB C 131 70.392 70.392 71.976 -1.584 25324 2866 1 4 . 1 1 131 131 THR H H 131 8.916 8.916 8.950 -0.034 25324 2867 1 4 . 1 1 132 132 LEU N N 132 130.774 130.774 128.710 2.064 25324 2868 1 4 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.975 -0.475 25324 2869 1 4 . 1 1 132 132 LEU C C 132 176.574 176.574 177.562 -0.988 25324 2870 1 4 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.879 0.308 25324 2871 1 4 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.638 0.809 25324 2872 1 4 . 1 1 132 132 LEU H H 132 8.527 8.527 8.606 -0.079 25324 2873 1 5 . 1 1 3 3 LEU N N 3 123.202 123.202 124.370 -1.168 25324 2874 1 5 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.845 0.312 25324 2875 1 5 . 1 1 3 3 LEU C C 3 175.786 175.786 175.000 0.786 25324 2876 1 5 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.179 0.105 25324 2877 1 5 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.250 0.080 25324 2878 1 5 . 1 1 3 3 LEU H H 3 8.711 8.711 8.463 0.248 25324 2879 1 5 . 1 1 4 4 TYR N N 4 120.906 120.906 125.093 -4.187 25324 2880 1 5 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.000 0.024 25324 2881 1 5 . 1 1 4 4 TYR C C 4 175.953 175.953 174.758 1.195 25324 2882 1 5 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.689 -0.312 25324 2883 1 5 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.284 -0.629 25324 2884 1 5 . 1 1 4 4 TYR H H 4 9.142 9.142 9.191 -0.049 25324 2885 1 5 . 1 1 5 5 ASN N N 5 120.496 120.496 119.991 0.505 25324 2886 1 5 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.924 0.192 25324 2887 1 5 . 1 1 5 5 ASN C C 5 174.953 174.953 173.690 1.263 25324 2888 1 5 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.708 0.239 25324 2889 1 5 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.943 -2.052 25324 2890 1 5 . 1 1 5 5 ASN H H 5 8.787 8.787 8.980 -0.193 25324 2891 1 5 . 1 1 6 6 VAL N N 6 127.428 127.428 125.279 2.149 25324 2892 1 5 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.498 -0.136 25324 2893 1 5 . 1 1 6 6 VAL C C 6 174.955 174.955 174.626 0.329 25324 2894 1 5 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.795 0.638 25324 2895 1 5 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.782 -0.451 25324 2896 1 5 . 1 1 6 6 VAL H H 6 8.806 8.806 8.868 -0.062 25324 2897 1 5 . 1 1 7 7 GLU N N 7 124.355 124.355 126.953 -2.598 25324 2898 1 5 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.902 0.080 25324 2899 1 5 . 1 1 7 7 GLU C C 7 174.551 174.551 174.819 -0.268 25324 2900 1 5 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.738 -0.949 25324 2901 1 5 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.078 1.488 25324 2902 1 5 . 1 1 7 7 GLU H H 7 8.800 8.800 8.901 -0.101 25324 2903 1 5 . 1 1 8 8 ASN N N 8 116.231 116.231 121.484 -5.253 25324 2904 1 5 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.799 0.242 25324 2905 1 5 . 1 1 8 8 ASN C C 8 172.709 172.709 173.701 -0.992 25324 2906 1 5 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.502 -0.885 25324 2907 1 5 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.683 2.902 25324 2908 1 5 . 1 1 8 8 ASN H H 8 9.320 9.320 9.293 0.027 25324 2909 1 5 . 1 1 9 9 GLN N N 9 120.762 120.762 123.336 -2.574 25324 2910 1 5 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.255 -0.081 25324 2911 1 5 . 1 1 9 9 GLN C C 9 173.454 173.454 173.624 -0.170 25324 2912 1 5 . 1 1 9 9 GLN CA C 9 53.960 53.960 53.979 -0.019 25324 2913 1 5 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.790 -1.099 25324 2914 1 5 . 1 1 9 9 GLN H H 9 6.887 6.887 8.440 -1.553 25324 2915 1 5 . 1 1 10 10 TRP N N 10 127.775 127.775 123.843 3.932 25324 2916 1 5 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.087 -0.099 25324 2917 1 5 . 1 1 10 10 TRP C C 10 175.281 175.281 176.289 -1.008 25324 2918 1 5 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.463 -0.170 25324 2919 1 5 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.423 -1.681 25324 2920 1 5 . 1 1 10 10 TRP H H 10 8.518 8.518 7.737 0.781 25324 2921 1 5 . 1 1 11 11 GLY N N 11 107.838 107.838 111.770 -3.932 25324 2922 1 5 . 1 1 11 11 GLY C C 11 174.733 174.733 174.203 0.530 25324 2923 1 5 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.633 0.203 25324 2924 1 5 . 1 1 11 11 GLY H H 11 8.461 8.461 8.697 -0.236 25324 2925 1 5 . 1 1 12 12 GLY N N 12 109.696 109.696 108.052 1.644 25324 2926 1 5 . 1 1 12 12 GLY C C 12 174.133 174.133 174.178 -0.045 25324 2927 1 5 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.687 -0.898 25324 2928 1 5 . 1 1 12 12 GLY H H 12 8.138 8.138 7.516 0.622 25324 2929 1 5 . 1 1 13 13 SER N N 13 111.308 111.308 115.448 -4.140 25324 2930 1 5 . 1 1 13 13 SER HA H 13 4.092 4.092 4.346 -0.254 25324 2931 1 5 . 1 1 13 13 SER C C 13 175.622 175.622 175.291 0.331 25324 2932 1 5 . 1 1 13 13 SER CA C 13 60.494 60.494 60.290 0.204 25324 2933 1 5 . 1 1 13 13 SER CB C 13 63.028 63.028 63.489 -0.461 25324 2934 1 5 . 1 1 13 13 SER H H 13 8.215 8.215 8.566 -0.351 25324 2935 1 5 . 1 1 14 14 SER N N 14 115.290 115.290 114.826 0.464 25324 2936 1 5 . 1 1 14 14 SER HA H 14 4.566 4.566 4.345 0.221 25324 2937 1 5 . 1 1 14 14 SER C C 14 173.532 173.532 174.243 -0.711 25324 2938 1 5 . 1 1 14 14 SER CA C 14 57.317 57.317 58.359 -1.042 25324 2939 1 5 . 1 1 14 14 SER CB C 14 63.230 63.230 63.324 -0.094 25324 2940 1 5 . 1 1 14 14 SER H H 14 8.213 8.213 7.730 0.483 25324 2941 1 5 . 1 1 15 15 ALA N N 15 126.470 126.470 126.054 0.416 25324 2942 1 5 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.455 -0.052 25324 2943 1 5 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.732 0.732 25324 2944 1 5 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.152 0.077 25324 2945 1 5 . 1 1 15 15 ALA H H 15 7.308 7.308 7.327 -0.019 25324 2946 1 5 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.308 0.101 25324 2947 1 5 . 1 1 16 16 PRO C C 16 175.627 175.627 175.391 0.236 25324 2948 1 5 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.356 0.036 25324 2949 1 5 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.595 -0.458 25324 2950 1 5 . 1 1 17 17 TRP N N 17 120.228 120.228 119.755 0.473 25324 2951 1 5 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.394 -0.076 25324 2952 1 5 . 1 1 17 17 TRP C C 17 175.951 175.951 176.129 -0.178 25324 2953 1 5 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.942 -0.027 25324 2954 1 5 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.872 -1.463 25324 2955 1 5 . 1 1 17 17 TRP H H 17 8.380 8.380 8.109 0.271 25324 2956 1 5 . 1 1 18 18 ASN N N 18 120.663 120.663 121.374 -0.711 25324 2957 1 5 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.039 0.047 25324 2958 1 5 . 1 1 18 18 ASN C C 18 174.793 174.793 174.059 0.734 25324 2959 1 5 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.013 -0.412 25324 2960 1 5 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.686 0.962 25324 2961 1 5 . 1 1 18 18 ASN H H 18 9.094 9.094 8.631 0.463 25324 2962 1 5 . 1 1 19 19 GLU N N 19 122.202 122.202 124.623 -2.421 25324 2963 1 5 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.220 -0.081 25324 2964 1 5 . 1 1 19 19 GLU C C 19 176.869 176.869 176.948 -0.079 25324 2965 1 5 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.628 0.972 25324 2966 1 5 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.895 -0.513 25324 2967 1 5 . 1 1 19 19 GLU H H 19 9.013 9.013 9.022 -0.009 25324 2968 1 5 . 1 1 20 20 GLY N N 20 112.893 112.893 114.552 -1.659 25324 2969 1 5 . 1 1 20 20 GLY C C 20 174.878 174.878 173.522 1.356 25324 2970 1 5 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.704 0.291 25324 2971 1 5 . 1 1 20 20 GLY H H 20 8.926 8.926 8.891 0.035 25324 2972 1 5 . 1 1 21 21 GLY N N 21 110.354 110.354 108.965 1.389 25324 2973 1 5 . 1 1 21 21 GLY C C 21 171.623 171.623 172.214 -0.591 25324 2974 1 5 . 1 1 21 21 GLY CA C 21 44.398 44.398 44.852 -0.454 25324 2975 1 5 . 1 1 21 21 GLY H H 21 8.258 8.258 7.563 0.695 25324 2976 1 5 . 1 1 22 22 GLN N N 22 117.541 117.541 118.800 -1.259 25324 2977 1 5 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.016 0.661 25324 2978 1 5 . 1 1 22 22 GLN C C 22 175.957 175.957 174.598 1.359 25324 2979 1 5 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.841 0.103 25324 2980 1 5 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.198 -1.113 25324 2981 1 5 . 1 1 22 22 GLN H H 22 8.564 8.564 8.501 0.063 25324 2982 1 5 . 1 1 23 23 TRP N N 23 127.208 127.208 122.801 4.407 25324 2983 1 5 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.135 0.064 25324 2984 1 5 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.068 0.463 25324 2985 1 5 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.931 -1.248 25324 2986 1 5 . 1 1 23 23 TRP H H 23 9.347 9.347 8.998 0.349 25324 2987 1 5 . 1 1 24 24 GLU N N 24 123.504 123.504 121.942 1.562 25324 2988 1 5 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.117 0.391 25324 2989 1 5 . 1 1 24 24 GLU C C 24 174.222 174.222 175.253 -1.031 25324 2990 1 5 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.301 0.290 25324 2991 1 5 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.777 -1.162 25324 2992 1 5 . 1 1 24 24 GLU H H 24 9.296 9.296 8.539 0.757 25324 2993 1 5 . 1 1 25 25 ILE N N 25 123.447 123.447 126.860 -3.413 25324 2994 1 5 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.133 0.303 25324 2995 1 5 . 1 1 25 25 ILE C C 25 175.790 175.790 174.655 1.135 25324 2996 1 5 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.900 -0.273 25324 2997 1 5 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.576 0.376 25324 2998 1 5 . 1 1 25 25 ILE H H 25 8.635 8.635 7.987 0.648 25324 2999 1 5 . 1 1 26 26 GLY N N 26 111.544 111.544 113.920 -2.376 25324 3000 1 5 . 1 1 26 26 GLY C C 26 172.122 172.122 175.066 -2.944 25324 3001 1 5 . 1 1 26 26 GLY CA C 26 44.078 44.078 45.005 -0.927 25324 3002 1 5 . 1 1 26 26 GLY H H 26 3.381 3.381 7.493 -4.112 25324 3003 1 5 . 1 1 27 27 SER N N 27 112.279 112.279 118.248 -5.969 25324 3004 1 5 . 1 1 27 27 SER HA H 27 4.876 4.876 4.693 0.183 25324 3005 1 5 . 1 1 27 27 SER C C 27 174.113 174.113 174.445 -0.332 25324 3006 1 5 . 1 1 27 27 SER CA C 27 56.954 56.954 58.590 -1.636 25324 3007 1 5 . 1 1 27 27 SER CB C 27 64.554 64.554 64.278 0.276 25324 3008 1 5 . 1 1 27 27 SER H H 27 8.212 8.212 8.945 -0.733 25324 3009 1 5 . 1 1 28 28 ARG N N 28 120.872 120.872 121.317 -0.445 25324 3010 1 5 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.687 0.076 25324 3011 1 5 . 1 1 28 28 ARG C C 28 176.119 176.119 175.121 0.998 25324 3012 1 5 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.550 -0.433 25324 3013 1 5 . 1 1 28 28 ARG CB C 28 31.830 31.830 32.814 -0.984 25324 3014 1 5 . 1 1 28 28 ARG H H 28 7.849 7.849 8.018 -0.169 25324 3015 1 5 . 1 1 29 29 SER N N 29 118.985 118.985 118.101 0.884 25324 3016 1 5 . 1 1 29 29 SER HA H 29 4.192 4.192 4.346 -0.154 25324 3017 1 5 . 1 1 29 29 SER C C 29 174.622 174.622 175.107 -0.485 25324 3018 1 5 . 1 1 29 29 SER CA C 29 60.072 60.072 59.593 0.479 25324 3019 1 5 . 1 1 29 29 SER CB C 29 62.876 62.876 63.508 -0.631 25324 3020 1 5 . 1 1 29 29 SER H H 29 8.892 8.892 8.884 0.008 25324 3021 1 5 . 1 1 30 30 ASP N N 30 117.632 117.632 119.668 -2.036 25324 3022 1 5 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.582 0.036 25324 3023 1 5 . 1 1 30 30 ASP C C 30 175.101 175.101 176.401 -1.300 25324 3024 1 5 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.432 -2.380 25324 3025 1 5 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.090 -0.567 25324 3026 1 5 . 1 1 30 30 ASP H H 30 8.441 8.441 8.156 0.285 25324 3027 1 5 . 1 1 31 31 GLN N N 31 118.273 118.273 118.260 0.013 25324 3028 1 5 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.508 -0.023 25324 3029 1 5 . 1 1 31 31 GLN C C 31 173.453 173.453 174.271 -0.818 25324 3030 1 5 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.591 0.277 25324 3031 1 5 . 1 1 31 31 GLN CB C 31 33.249 33.249 29.898 3.351 25324 3032 1 5 . 1 1 31 31 GLN H H 31 7.029 7.029 7.894 -0.865 25324 3033 1 5 . 1 1 32 32 ASN N N 32 120.865 120.865 120.404 0.461 25324 3034 1 5 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.074 0.046 25324 3035 1 5 . 1 1 32 32 ASN C C 32 175.198 175.198 174.747 0.451 25324 3036 1 5 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.194 -0.325 25324 3037 1 5 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.600 -0.970 25324 3038 1 5 . 1 1 32 32 ASN H H 32 8.713 8.713 8.708 0.005 25324 3039 1 5 . 1 1 33 33 VAL N N 33 122.111 122.111 120.213 1.898 25324 3040 1 5 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.260 -0.555 25324 3041 1 5 . 1 1 33 33 VAL C C 33 174.950 174.950 176.230 -1.280 25324 3042 1 5 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.930 0.917 25324 3043 1 5 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.059 0.291 25324 3044 1 5 . 1 1 33 33 VAL H H 33 8.542 8.542 8.895 -0.353 25324 3045 1 5 . 1 1 34 34 VAL N N 34 113.282 113.282 119.547 -6.265 25324 3046 1 5 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.543 0.102 25324 3047 1 5 . 1 1 34 34 VAL C C 34 175.574 175.574 174.835 0.739 25324 3048 1 5 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.282 -1.308 25324 3049 1 5 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.319 -0.290 25324 3050 1 5 . 1 1 34 34 VAL H H 34 8.744 8.744 8.798 -0.054 25324 3051 1 5 . 1 1 35 35 ALA N N 35 122.102 122.102 121.023 1.079 25324 3052 1 5 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.008 -0.205 25324 3053 1 5 . 1 1 35 35 ALA C C 35 175.947 175.947 174.840 1.107 25324 3054 1 5 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.342 1.908 25324 3055 1 5 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.380 -0.752 25324 3056 1 5 . 1 1 35 35 ALA H H 35 7.677 7.677 7.744 -0.067 25324 3057 1 5 . 1 1 36 36 ILE N N 36 118.005 118.005 120.641 -2.636 25324 3058 1 5 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.439 -0.411 25324 3059 1 5 . 1 1 36 36 ILE C C 36 173.116 173.116 173.801 -0.685 25324 3060 1 5 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.014 1.168 25324 3061 1 5 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.735 0.750 25324 3062 1 5 . 1 1 36 36 ILE H H 36 8.126 8.126 8.960 -0.834 25324 3063 1 5 . 1 1 37 37 ASN N N 37 125.632 125.632 126.448 -0.816 25324 3064 1 5 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.581 0.100 25324 3065 1 5 . 1 1 37 37 ASN C C 37 174.854 174.854 173.804 1.050 25324 3066 1 5 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.421 0.109 25324 3067 1 5 . 1 1 37 37 ASN CB C 37 38.853 38.853 40.752 -1.899 25324 3068 1 5 . 1 1 37 37 ASN H H 37 8.577 8.577 9.134 -0.557 25324 3069 1 5 . 1 1 38 38 VAL N N 38 114.223 114.223 118.724 -4.501 25324 3070 1 5 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.947 0.256 25324 3071 1 5 . 1 1 38 38 VAL C C 38 174.854 174.854 173.742 1.112 25324 3072 1 5 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.235 -2.255 25324 3073 1 5 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.432 0.612 25324 3074 1 5 . 1 1 38 38 VAL H H 38 8.874 8.874 8.816 0.058 25324 3075 1 5 . 1 1 39 39 GLU N N 39 118.277 118.277 121.755 -3.478 25324 3076 1 5 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.434 -0.352 25324 3077 1 5 . 1 1 39 39 GLU C C 39 174.548 174.548 175.720 -1.172 25324 3078 1 5 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.089 0.904 25324 3079 1 5 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.901 -1.323 25324 3080 1 5 . 1 1 39 39 GLU H H 39 8.761 8.761 9.225 -0.464 25324 3081 1 5 . 1 1 40 40 SER N N 40 114.960 114.960 117.936 -2.976 25324 3082 1 5 . 1 1 40 40 SER HA H 40 5.265 5.265 4.938 0.327 25324 3083 1 5 . 1 1 40 40 SER C C 40 175.783 175.783 175.376 0.407 25324 3084 1 5 . 1 1 40 40 SER CA C 40 55.880 55.880 58.025 -2.145 25324 3085 1 5 . 1 1 40 40 SER CB C 40 65.911 65.911 63.564 2.347 25324 3086 1 5 . 1 1 40 40 SER H H 40 8.500 8.500 8.649 -0.149 25324 3087 1 5 . 1 1 41 41 GLY N N 41 117.567 117.567 111.862 5.705 25324 3088 1 5 . 1 1 41 41 GLY C C 41 174.119 174.119 174.705 -0.586 25324 3089 1 5 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.566 -0.878 25324 3090 1 5 . 1 1 41 41 GLY H H 41 9.533 9.533 8.586 0.947 25324 3091 1 5 . 1 1 42 42 ASP N N 42 122.141 122.141 120.989 1.152 25324 3092 1 5 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.902 -0.102 25324 3093 1 5 . 1 1 42 42 ASP C C 42 176.121 176.121 176.330 -0.209 25324 3094 1 5 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.280 -1.134 25324 3095 1 5 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.515 -3.161 25324 3096 1 5 . 1 1 42 42 ASP H H 42 8.644 8.644 7.945 0.699 25324 3097 1 5 . 1 1 43 43 ASP N N 43 116.025 116.025 120.613 -4.588 25324 3098 1 5 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.549 -0.320 25324 3099 1 5 . 1 1 43 43 ASP C C 43 176.018 176.018 176.695 -0.677 25324 3100 1 5 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.498 0.751 25324 3101 1 5 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.755 -0.196 25324 3102 1 5 . 1 1 43 43 ASP H H 43 9.111 9.111 8.743 0.368 25324 3103 1 5 . 1 1 44 44 GLY N N 44 104.263 104.263 107.627 -3.364 25324 3104 1 5 . 1 1 44 44 GLY C C 44 173.922 173.922 175.453 -1.531 25324 3105 1 5 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.881 -0.580 25324 3106 1 5 . 1 1 44 44 GLY H H 44 9.063 9.063 8.180 0.883 25324 3107 1 5 . 1 1 45 45 GLN N N 45 121.691 121.691 118.411 3.280 25324 3108 1 5 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.115 -0.029 25324 3109 1 5 . 1 1 45 45 GLN C C 45 176.284 176.284 175.371 0.913 25324 3110 1 5 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.347 -0.229 25324 3111 1 5 . 1 1 45 45 GLN CB C 45 27.674 27.674 28.613 -0.939 25324 3112 1 5 . 1 1 45 45 GLN H H 45 7.356 7.356 8.437 -1.081 25324 3113 1 5 . 1 1 46 46 THR N N 46 111.843 111.843 108.938 2.905 25324 3114 1 5 . 1 1 46 46 THR HA H 46 5.355 5.355 5.476 -0.121 25324 3115 1 5 . 1 1 46 46 THR C C 46 174.451 174.451 173.548 0.903 25324 3116 1 5 . 1 1 46 46 THR CA C 46 59.644 59.644 59.863 -0.219 25324 3117 1 5 . 1 1 46 46 THR CB C 46 72.714 72.714 71.419 1.295 25324 3118 1 5 . 1 1 46 46 THR H H 46 10.123 10.123 7.663 2.460 25324 3119 1 5 . 1 1 47 47 LEU N N 47 119.302 119.302 124.817 -5.515 25324 3120 1 5 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.763 0.044 25324 3121 1 5 . 1 1 47 47 LEU C C 47 175.487 175.487 174.884 0.603 25324 3122 1 5 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.955 -0.885 25324 3123 1 5 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.593 3.410 25324 3124 1 5 . 1 1 47 47 LEU H H 47 8.364 8.364 8.909 -0.545 25324 3125 1 5 . 1 1 48 48 ASN N N 48 116.844 116.844 120.853 -4.009 25324 3126 1 5 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.961 -0.232 25324 3127 1 5 . 1 1 48 48 ASN C C 48 174.460 174.460 175.097 -0.637 25324 3128 1 5 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.623 1.116 25324 3129 1 5 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.565 0.848 25324 3130 1 5 . 1 1 48 48 ASN H H 48 8.748 8.748 9.026 -0.278 25324 3131 1 5 . 1 1 49 49 GLY N N 49 109.417 109.417 109.373 0.044 25324 3132 1 5 . 1 1 49 49 GLY C C 49 172.126 172.126 172.089 0.037 25324 3133 1 5 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.340 0.151 25324 3134 1 5 . 1 1 49 49 GLY H H 49 8.744 8.744 9.056 -0.312 25324 3135 1 5 . 1 1 50 50 THR N N 50 119.162 119.162 113.055 6.107 25324 3136 1 5 . 1 1 50 50 THR HA H 50 5.556 5.556 5.632 -0.076 25324 3137 1 5 . 1 1 50 50 THR C C 50 171.790 171.790 173.395 -1.605 25324 3138 1 5 . 1 1 50 50 THR CA C 50 59.371 59.371 59.961 -0.590 25324 3139 1 5 . 1 1 50 50 THR CB C 50 72.799 72.799 72.383 0.416 25324 3140 1 5 . 1 1 50 50 THR H H 50 8.799 8.799 8.957 -0.158 25324 3141 1 5 . 1 1 51 51 MET N N 51 115.232 115.232 121.954 -6.722 25324 3142 1 5 . 1 1 51 51 MET HA H 51 4.886 4.886 5.007 -0.121 25324 3143 1 5 . 1 1 51 51 MET C C 51 172.708 172.708 174.896 -2.188 25324 3144 1 5 . 1 1 51 51 MET CA C 51 54.722 54.722 54.731 -0.009 25324 3145 1 5 . 1 1 51 51 MET CB C 51 34.557 34.557 37.822 -3.264 25324 3146 1 5 . 1 1 51 51 MET H H 51 9.062 9.062 9.081 -0.019 25324 3147 1 5 . 1 1 52 52 THR N N 52 113.697 113.697 117.170 -3.473 25324 3148 1 5 . 1 1 52 52 THR HA H 52 4.682 4.682 4.987 -0.305 25324 3149 1 5 . 1 1 52 52 THR C C 52 173.952 173.952 173.497 0.455 25324 3150 1 5 . 1 1 52 52 THR CA C 52 61.395 61.395 61.307 0.088 25324 3151 1 5 . 1 1 52 52 THR CB C 52 71.734 71.734 71.038 0.696 25324 3152 1 5 . 1 1 52 52 THR H H 52 8.685 8.685 8.687 -0.002 25324 3153 1 5 . 1 1 53 53 TYR N N 53 129.086 129.086 125.820 3.266 25324 3154 1 5 . 1 1 53 53 TYR HA H 53 4.800 4.800 5.108 -0.308 25324 3155 1 5 . 1 1 53 53 TYR C C 53 175.214 175.214 176.066 -0.852 25324 3156 1 5 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.421 1.460 25324 3157 1 5 . 1 1 53 53 TYR CB C 53 40.512 40.512 40.502 0.010 25324 3158 1 5 . 1 1 53 53 TYR H H 53 10.112 10.112 8.621 1.491 25324 3159 1 5 . 1 1 54 54 ALA N N 54 119.947 119.947 123.561 -3.614 25324 3160 1 5 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.374 -0.372 25324 3161 1 5 . 1 1 54 54 ALA C C 54 178.285 178.285 178.089 0.196 25324 3162 1 5 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.580 0.391 25324 3163 1 5 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.918 -0.201 25324 3164 1 5 . 1 1 54 54 ALA H H 54 8.704 8.704 8.584 0.120 25324 3165 1 5 . 1 1 55 55 GLY N N 55 110.940 110.940 110.640 0.300 25324 3166 1 5 . 1 1 55 55 GLY C C 55 173.903 173.903 174.330 -0.427 25324 3167 1 5 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.700 -0.684 25324 3168 1 5 . 1 1 55 55 GLY H H 55 8.745 8.745 8.751 -0.006 25324 3169 1 5 . 1 1 56 56 GLU N N 56 120.073 120.073 119.680 0.393 25324 3170 1 5 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.781 -0.072 25324 3171 1 5 . 1 1 56 56 GLU C C 56 175.906 175.906 176.082 -0.176 25324 3172 1 5 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.022 -0.599 25324 3173 1 5 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.742 0.082 25324 3174 1 5 . 1 1 56 56 GLU H H 56 8.039 8.039 7.959 0.080 25324 3175 1 5 . 1 1 57 57 GLY N N 57 105.298 105.298 107.973 -2.675 25324 3176 1 5 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.332 0.470 25324 3177 1 5 . 1 1 57 57 GLY H H 57 7.937 7.937 8.247 -0.310 25324 3178 1 5 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.918 0.016 25324 3179 1 5 . 1 1 58 58 PRO C C 58 177.785 177.785 176.461 1.324 25324 3180 1 5 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.202 -0.070 25324 3181 1 5 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.207 -0.367 25324 3182 1 5 . 1 1 59 59 ILE N N 59 117.386 117.386 116.655 0.731 25324 3183 1 5 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.710 0.278 25324 3184 1 5 . 1 1 59 59 ILE C C 59 175.688 175.688 175.222 0.466 25324 3185 1 5 . 1 1 59 59 ILE CA C 59 59.543 59.543 58.732 0.811 25324 3186 1 5 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.939 0.349 25324 3187 1 5 . 1 1 59 59 ILE H H 59 9.600 9.600 8.743 0.857 25324 3188 1 5 . 1 1 60 60 GLY N N 60 107.164 107.164 107.742 -0.578 25324 3189 1 5 . 1 1 60 60 GLY C C 60 173.787 173.787 172.463 1.324 25324 3190 1 5 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.298 1.937 25324 3191 1 5 . 1 1 60 60 GLY H H 60 8.957 8.957 8.497 0.460 25324 3192 1 5 . 1 1 61 61 PHE N N 61 124.597 124.597 125.113 -0.516 25324 3193 1 5 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.773 -0.550 25324 3194 1 5 . 1 1 61 61 PHE C C 61 173.126 173.126 173.253 -0.127 25324 3195 1 5 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.315 0.546 25324 3196 1 5 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.451 -0.234 25324 3197 1 5 . 1 1 61 61 PHE H H 61 8.788 8.788 9.221 -0.433 25324 3198 1 5 . 1 1 62 62 ARG N N 62 129.706 129.706 127.389 2.317 25324 3199 1 5 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.191 -0.059 25324 3200 1 5 . 1 1 62 62 ARG C C 62 172.456 172.456 172.873 -0.417 25324 3201 1 5 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.872 1.082 25324 3202 1 5 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.270 -1.400 25324 3203 1 5 . 1 1 62 62 ARG H H 62 8.405 8.405 8.647 -0.242 25324 3204 1 5 . 1 1 63 63 ALA N N 63 122.744 122.744 128.821 -6.077 25324 3205 1 5 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.387 -0.042 25324 3206 1 5 . 1 1 63 63 ALA C C 63 176.120 176.120 175.643 0.477 25324 3207 1 5 . 1 1 63 63 ALA CA C 63 49.919 49.919 49.943 -0.024 25324 3208 1 5 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.963 1.810 25324 3209 1 5 . 1 1 63 63 ALA H H 63 8.628 8.628 8.717 -0.089 25324 3210 1 5 . 1 1 64 64 THR N N 64 116.855 116.855 117.267 -0.412 25324 3211 1 5 . 1 1 64 64 THR HA H 64 4.848 4.848 5.360 -0.512 25324 3212 1 5 . 1 1 64 64 THR C C 64 172.957 172.957 173.507 -0.550 25324 3213 1 5 . 1 1 64 64 THR CA C 64 61.211 61.211 60.962 0.249 25324 3214 1 5 . 1 1 64 64 THR CB C 64 71.064 71.064 72.172 -1.108 25324 3215 1 5 . 1 1 64 64 THR H H 64 8.315 8.315 8.517 -0.202 25324 3216 1 5 . 1 1 65 65 LEU N N 65 129.360 129.360 128.935 0.425 25324 3217 1 5 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.709 -0.347 25324 3218 1 5 . 1 1 65 65 LEU C C 65 176.459 176.459 175.759 0.700 25324 3219 1 5 . 1 1 65 65 LEU CA C 65 55.687 55.687 55.069 0.618 25324 3220 1 5 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.246 -0.535 25324 3221 1 5 . 1 1 65 65 LEU H H 65 8.877 8.877 8.808 0.069 25324 3222 1 5 . 1 1 66 66 LEU N N 66 128.683 128.683 128.053 0.630 25324 3223 1 5 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.461 -0.085 25324 3224 1 5 . 1 1 66 66 LEU C C 66 177.621 177.621 177.015 0.606 25324 3225 1 5 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.768 -1.068 25324 3226 1 5 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.531 -0.229 25324 3227 1 5 . 1 1 66 66 LEU H H 66 9.320 9.320 9.016 0.304 25324 3228 1 5 . 1 1 67 67 GLY N N 67 105.361 105.361 105.445 -0.084 25324 3229 1 5 . 1 1 67 67 GLY C C 67 173.618 173.618 174.061 -0.443 25324 3230 1 5 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.483 -2.116 25324 3231 1 5 . 1 1 67 67 GLY H H 67 6.639 6.639 7.681 -1.042 25324 3232 1 5 . 1 1 68 68 ASN N N 68 121.848 121.848 116.977 4.871 25324 3233 1 5 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.807 -0.476 25324 3234 1 5 . 1 1 68 68 ASN C C 68 174.316 174.316 174.317 -0.001 25324 3235 1 5 . 1 1 68 68 ASN CA C 68 54.552 54.552 53.135 1.417 25324 3236 1 5 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.391 -2.226 25324 3237 1 5 . 1 1 68 68 ASN H H 68 9.236 9.236 7.855 1.381 25324 3238 1 5 . 1 1 69 69 ASN N N 69 109.509 109.509 116.522 -7.013 25324 3239 1 5 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.866 -0.786 25324 3240 1 5 . 1 1 69 69 ASN C C 69 171.456 171.456 174.281 -2.825 25324 3241 1 5 . 1 1 69 69 ASN CA C 69 55.750 55.750 53.584 2.167 25324 3242 1 5 . 1 1 69 69 ASN CB C 69 37.306 37.306 39.545 -2.239 25324 3243 1 5 . 1 1 69 69 ASN H H 69 8.651 8.651 8.431 0.220 25324 3244 1 5 . 1 1 70 70 SER N N 70 113.479 113.479 115.973 -2.494 25324 3245 1 5 . 1 1 70 70 SER HA H 70 5.437 5.437 5.009 0.428 25324 3246 1 5 . 1 1 70 70 SER C C 70 173.750 173.750 173.142 0.608 25324 3247 1 5 . 1 1 70 70 SER CA C 70 57.139 57.139 59.288 -2.149 25324 3248 1 5 . 1 1 70 70 SER CB C 70 63.818 63.818 63.553 0.265 25324 3249 1 5 . 1 1 70 70 SER H H 70 7.693 7.693 7.746 -0.053 25324 3250 1 5 . 1 1 71 71 TYR N N 71 123.132 123.132 124.622 -1.490 25324 3251 1 5 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.051 0.092 25324 3252 1 5 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.704 -0.056 25324 3253 1 5 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.557 -0.112 25324 3254 1 5 . 1 1 71 71 TYR H H 71 9.326 9.326 9.528 -0.202 25324 3255 1 5 . 1 1 72 72 GLU N N 72 122.396 122.396 122.595 -0.199 25324 3256 1 5 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.855 -0.049 25324 3257 1 5 . 1 1 72 72 GLU C C 72 175.698 175.698 175.017 0.681 25324 3258 1 5 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.013 0.154 25324 3259 1 5 . 1 1 72 72 GLU CB C 72 30.184 30.184 32.066 -1.882 25324 3260 1 5 . 1 1 72 72 GLU H H 72 8.624 8.624 9.017 -0.393 25324 3261 1 5 . 1 1 73 73 VAL N N 73 128.513 128.513 127.247 1.266 25324 3262 1 5 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.201 -0.002 25324 3263 1 5 . 1 1 73 73 VAL C C 73 175.369 175.369 174.717 0.652 25324 3264 1 5 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.853 0.627 25324 3265 1 5 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.639 0.694 25324 3266 1 5 . 1 1 73 73 VAL H H 73 8.564 8.564 9.093 -0.529 25324 3267 1 5 . 1 1 74 74 GLU N N 74 124.842 124.842 127.163 -2.321 25324 3268 1 5 . 1 1 74 74 GLU HA H 74 5.087 5.087 4.979 0.108 25324 3269 1 5 . 1 1 74 74 GLU C C 74 174.415 174.415 174.878 -0.463 25324 3270 1 5 . 1 1 74 74 GLU CA C 74 54.337 54.337 55.025 -0.688 25324 3271 1 5 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.093 2.063 25324 3272 1 5 . 1 1 74 74 GLU H H 74 9.011 9.011 9.015 -0.004 25324 3273 1 5 . 1 1 75 75 ASN N N 75 116.136 116.136 122.304 -6.168 25324 3274 1 5 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.580 0.559 25324 3275 1 5 . 1 1 75 75 ASN C C 75 172.703 172.703 173.484 -0.781 25324 3276 1 5 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.526 0.299 25324 3277 1 5 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.441 3.455 25324 3278 1 5 . 1 1 75 75 ASN H H 75 9.424 9.424 9.089 0.335 25324 3279 1 5 . 1 1 76 76 GLN N N 76 120.762 120.762 120.943 -0.181 25324 3280 1 5 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.411 -0.371 25324 3281 1 5 . 1 1 76 76 GLN C C 76 173.113 173.113 174.137 -1.024 25324 3282 1 5 . 1 1 76 76 GLN CA C 76 54.223 54.223 53.877 0.346 25324 3283 1 5 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.311 -0.963 25324 3284 1 5 . 1 1 76 76 GLN H H 76 7.106 7.106 8.778 -1.672 25324 3285 1 5 . 1 1 77 77 TRP N N 77 125.598 125.598 126.474 -0.876 25324 3286 1 5 . 1 1 77 77 TRP HA H 77 5.152 5.152 4.962 0.190 25324 3287 1 5 . 1 1 77 77 TRP C C 77 175.502 175.502 175.534 -0.032 25324 3288 1 5 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.186 -0.422 25324 3289 1 5 . 1 1 77 77 TRP CB C 77 29.999 29.999 29.653 0.346 25324 3290 1 5 . 1 1 77 77 TRP H H 77 8.181 8.181 8.272 -0.091 25324 3291 1 5 . 1 1 78 78 GLY N N 78 107.901 107.901 111.950 -4.049 25324 3292 1 5 . 1 1 78 78 GLY C C 78 174.611 174.611 173.429 1.182 25324 3293 1 5 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.357 -0.455 25324 3294 1 5 . 1 1 78 78 GLY H H 78 8.778 8.778 8.025 0.753 25324 3295 1 5 . 1 1 79 79 GLY N N 79 109.844 109.844 106.604 3.240 25324 3296 1 5 . 1 1 79 79 GLY C C 79 173.782 173.782 173.948 -0.166 25324 3297 1 5 . 1 1 79 79 GLY CA C 79 43.793 43.793 45.492 -1.699 25324 3298 1 5 . 1 1 79 79 GLY H H 79 8.198 8.198 8.211 -0.013 25324 3299 1 5 . 1 1 80 80 ASP N N 80 115.837 115.837 118.883 -3.046 25324 3300 1 5 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.569 -0.328 25324 3301 1 5 . 1 1 80 80 ASP C C 80 177.285 177.285 175.198 2.087 25324 3302 1 5 . 1 1 80 80 ASP CA C 80 56.183 56.183 54.139 2.044 25324 3303 1 5 . 1 1 80 80 ASP CB C 80 40.523 40.523 42.196 -1.673 25324 3304 1 5 . 1 1 80 80 ASP H H 80 8.132 8.132 7.604 0.528 25324 3305 1 5 . 1 1 81 81 SER N N 81 112.690 112.690 115.957 -3.267 25324 3306 1 5 . 1 1 81 81 SER HA H 81 4.513 4.513 4.119 0.394 25324 3307 1 5 . 1 1 81 81 SER C C 81 173.684 173.684 173.113 0.571 25324 3308 1 5 . 1 1 81 81 SER CA C 81 57.232 57.232 58.856 -1.624 25324 3309 1 5 . 1 1 81 81 SER CB C 81 63.170 63.170 62.437 0.733 25324 3310 1 5 . 1 1 81 81 SER H H 81 8.179 8.179 8.642 -0.463 25324 3311 1 5 . 1 1 82 82 ALA N N 82 126.310 126.310 122.703 3.607 25324 3312 1 5 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.433 -0.030 25324 3313 1 5 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.725 -0.259 25324 3314 1 5 . 1 1 82 82 ALA CB C 82 18.198 18.198 19.229 -1.030 25324 3315 1 5 . 1 1 82 82 ALA H H 82 7.274 7.274 7.783 -0.509 25324 3316 1 5 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.227 0.146 25324 3317 1 5 . 1 1 83 83 PRO C C 83 175.378 175.378 175.320 0.058 25324 3318 1 5 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.652 -0.325 25324 3319 1 5 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.329 -0.165 25324 3320 1 5 . 1 1 84 84 TRP N N 84 120.106 120.106 120.122 -0.016 25324 3321 1 5 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.592 -0.321 25324 3322 1 5 . 1 1 84 84 TRP C C 84 176.358 176.358 175.930 0.428 25324 3323 1 5 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.674 0.272 25324 3324 1 5 . 1 1 84 84 TRP CB C 84 29.716 29.716 31.400 -1.684 25324 3325 1 5 . 1 1 84 84 TRP H H 84 8.329 8.329 7.965 0.364 25324 3326 1 5 . 1 1 85 85 HIS N N 85 118.543 118.543 119.924 -1.381 25324 3327 1 5 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.975 -0.057 25324 3328 1 5 . 1 1 85 85 HIS C C 85 174.950 174.950 174.844 0.106 25324 3329 1 5 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.037 -1.568 25324 3330 1 5 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.790 -2.117 25324 3331 1 5 . 1 1 85 85 HIS H H 85 9.204 9.204 8.993 0.211 25324 3332 1 5 . 1 1 86 86 SER N N 86 117.803 117.803 118.767 -0.964 25324 3333 1 5 . 1 1 86 86 SER HA H 86 4.412 4.412 4.187 0.225 25324 3334 1 5 . 1 1 86 86 SER C C 86 175.691 175.691 174.959 0.732 25324 3335 1 5 . 1 1 86 86 SER CA C 86 60.257 60.257 60.198 0.059 25324 3336 1 5 . 1 1 86 86 SER CB C 86 63.015 63.015 63.988 -0.973 25324 3337 1 5 . 1 1 86 86 SER H H 86 9.168 9.168 9.130 0.038 25324 3338 1 5 . 1 1 87 87 GLY N N 87 115.773 115.773 112.325 3.448 25324 3339 1 5 . 1 1 87 87 GLY C C 87 174.288 174.288 174.074 0.214 25324 3340 1 5 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.799 -0.098 25324 3341 1 5 . 1 1 87 87 GLY H H 87 9.284 9.284 9.121 0.163 25324 3342 1 5 . 1 1 88 88 GLY N N 88 109.162 109.162 109.174 -0.012 25324 3343 1 5 . 1 1 88 88 GLY C C 88 171.120 171.120 171.735 -0.615 25324 3344 1 5 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.914 -0.320 25324 3345 1 5 . 1 1 88 88 GLY H H 88 8.054 8.054 7.910 0.144 25324 3346 1 5 . 1 1 89 89 ASN N N 89 117.048 117.048 119.758 -2.710 25324 3347 1 5 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.853 0.185 25324 3348 1 5 . 1 1 89 89 ASN C C 89 175.287 175.287 175.071 0.216 25324 3349 1 5 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.083 -1.218 25324 3350 1 5 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.132 -1.526 25324 3351 1 5 . 1 1 89 89 ASN H H 89 8.516 8.516 8.685 -0.169 25324 3352 1 5 . 1 1 90 90 TRP N N 90 125.844 125.844 123.815 2.029 25324 3353 1 5 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.222 0.031 25324 3354 1 5 . 1 1 90 90 TRP C C 90 175.278 175.278 175.260 0.018 25324 3355 1 5 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.166 0.102 25324 3356 1 5 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.447 -0.489 25324 3357 1 5 . 1 1 90 90 TRP H H 90 9.282 9.282 9.375 -0.093 25324 3358 1 5 . 1 1 91 91 ILE N N 91 123.134 123.134 121.212 1.922 25324 3359 1 5 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.144 0.302 25324 3360 1 5 . 1 1 91 91 ILE C C 91 175.489 175.489 175.456 0.033 25324 3361 1 5 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.803 0.023 25324 3362 1 5 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.673 1.003 25324 3363 1 5 . 1 1 91 91 ILE H H 91 9.318 9.318 8.463 0.855 25324 3364 1 5 . 1 1 92 92 LEU N N 92 123.452 123.452 127.699 -4.247 25324 3365 1 5 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.615 0.327 25324 3366 1 5 . 1 1 92 92 LEU C C 92 173.620 173.620 174.894 -1.274 25324 3367 1 5 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.478 -1.222 25324 3368 1 5 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.114 2.394 25324 3369 1 5 . 1 1 92 92 LEU H H 92 8.463 8.463 8.945 -0.482 25324 3370 1 5 . 1 1 93 93 GLY N N 93 103.987 103.987 108.077 -4.090 25324 3371 1 5 . 1 1 93 93 GLY C C 93 172.284 172.284 173.906 -1.622 25324 3372 1 5 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.402 -1.902 25324 3373 1 5 . 1 1 93 93 GLY H H 93 2.937 2.937 7.751 -4.814 25324 3374 1 5 . 1 1 94 94 SER N N 94 110.274 110.274 112.816 -2.542 25324 3375 1 5 . 1 1 94 94 SER HA H 94 4.711 4.711 4.358 0.353 25324 3376 1 5 . 1 1 94 94 SER C C 94 174.784 174.784 173.405 1.379 25324 3377 1 5 . 1 1 94 94 SER CA C 94 56.555 56.555 60.014 -3.459 25324 3378 1 5 . 1 1 94 94 SER CB C 94 65.051 65.051 62.696 2.355 25324 3379 1 5 . 1 1 94 94 SER H H 94 7.919 7.919 8.690 -0.771 25324 3380 1 5 . 1 1 95 95 ARG N N 95 123.020 123.020 120.200 2.820 25324 3381 1 5 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.717 -0.045 25324 3382 1 5 . 1 1 95 95 ARG C C 95 176.120 176.120 177.046 -0.926 25324 3383 1 5 . 1 1 95 95 ARG CA C 95 55.374 55.374 54.241 1.133 25324 3384 1 5 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.508 0.340 25324 3385 1 5 . 1 1 95 95 ARG H H 95 9.148 9.148 7.544 1.604 25324 3386 1 5 . 1 1 96 96 GLU N N 96 120.357 120.357 124.112 -3.755 25324 3387 1 5 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.083 0.199 25324 3388 1 5 . 1 1 96 96 GLU C C 96 176.278 176.278 176.609 -0.331 25324 3389 1 5 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.835 -2.305 25324 3390 1 5 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.590 0.563 25324 3391 1 5 . 1 1 96 96 GLU H H 96 8.610 8.610 8.858 -0.248 25324 3392 1 5 . 1 1 97 97 ASN N N 97 117.678 117.678 117.914 -0.236 25324 3393 1 5 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.910 -0.298 25324 3394 1 5 . 1 1 97 97 ASN C C 97 173.949 173.949 173.824 0.125 25324 3395 1 5 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.778 0.237 25324 3396 1 5 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.728 -0.562 25324 3397 1 5 . 1 1 97 97 ASN H H 97 8.533 8.533 8.268 0.265 25324 3398 1 5 . 1 1 98 98 GLN N N 98 118.592 118.592 118.351 0.241 25324 3399 1 5 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.501 -0.141 25324 3400 1 5 . 1 1 98 98 GLN C C 98 173.116 173.116 172.803 0.313 25324 3401 1 5 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.833 -0.205 25324 3402 1 5 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.349 -0.479 25324 3403 1 5 . 1 1 98 98 GLN H H 98 7.663 7.663 7.636 0.027 25324 3404 1 5 . 1 1 99 99 ASN N N 99 122.855 122.855 120.632 2.223 25324 3405 1 5 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.195 -0.060 25324 3406 1 5 . 1 1 99 99 ASN C C 99 175.287 175.287 174.580 0.707 25324 3407 1 5 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.140 0.850 25324 3408 1 5 . 1 1 99 99 ASN CB C 99 40.491 40.491 41.751 -1.260 25324 3409 1 5 . 1 1 99 99 ASN H H 99 8.759 8.759 8.562 0.197 25324 3410 1 5 . 1 1 100 100 VAL N N 100 121.385 121.385 116.372 5.013 25324 3411 1 5 . 1 1 100 100 VAL HA H 100 3.748 3.748 4.190 -0.442 25324 3412 1 5 . 1 1 100 100 VAL C C 100 174.956 174.956 176.216 -1.260 25324 3413 1 5 . 1 1 100 100 VAL CA C 100 63.843 63.843 62.651 1.192 25324 3414 1 5 . 1 1 100 100 VAL CB C 100 32.443 32.443 32.151 0.292 25324 3415 1 5 . 1 1 100 100 VAL H H 100 8.717 8.717 7.931 0.786 25324 3416 1 5 . 1 1 101 101 VAL N N 101 112.736 112.736 117.379 -4.643 25324 3417 1 5 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.504 0.141 25324 3418 1 5 . 1 1 101 101 VAL C C 101 175.577 175.577 175.017 0.560 25324 3419 1 5 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.329 -1.366 25324 3420 1 5 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.691 -0.650 25324 3421 1 5 . 1 1 101 101 VAL H H 101 8.802 8.802 8.710 0.092 25324 3422 1 5 . 1 1 102 102 ALA N N 102 122.104 122.104 122.632 -0.528 25324 3423 1 5 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.113 -0.306 25324 3424 1 5 . 1 1 102 102 ALA C C 102 176.046 176.046 174.989 1.057 25324 3425 1 5 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.646 2.608 25324 3426 1 5 . 1 1 102 102 ALA CB C 102 21.625 21.625 21.997 -0.371 25324 3427 1 5 . 1 1 102 102 ALA H H 102 7.677 7.677 7.756 -0.079 25324 3428 1 5 . 1 1 103 103 ILE N N 103 118.218 118.218 123.169 -4.951 25324 3429 1 5 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.527 -0.500 25324 3430 1 5 . 1 1 103 103 ILE C C 103 173.118 173.118 173.872 -0.754 25324 3431 1 5 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.526 1.701 25324 3432 1 5 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.394 1.077 25324 3433 1 5 . 1 1 103 103 ILE H H 103 8.102 8.102 8.867 -0.765 25324 3434 1 5 . 1 1 104 104 ASN N N 104 125.938 125.938 126.716 -0.778 25324 3435 1 5 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.360 0.326 25324 3436 1 5 . 1 1 104 104 ASN C C 104 174.870 174.870 173.695 1.175 25324 3437 1 5 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.367 0.186 25324 3438 1 5 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.601 -1.749 25324 3439 1 5 . 1 1 104 104 ASN H H 104 8.668 8.668 9.045 -0.377 25324 3440 1 5 . 1 1 105 105 VAL N N 105 114.631 114.631 120.535 -5.904 25324 3441 1 5 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.101 0.104 25324 3442 1 5 . 1 1 105 105 VAL C C 105 174.788 174.788 173.845 0.943 25324 3443 1 5 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.269 -2.290 25324 3444 1 5 . 1 1 105 105 VAL CB C 105 36.040 36.040 34.424 1.616 25324 3445 1 5 . 1 1 105 105 VAL H H 105 8.933 8.933 8.999 -0.066 25324 3446 1 5 . 1 1 106 106 GLU N N 106 118.347 118.347 125.244 -6.897 25324 3447 1 5 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.030 0.050 25324 3448 1 5 . 1 1 106 106 GLU C C 106 174.777 174.777 174.780 -0.003 25324 3449 1 5 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.373 -0.406 25324 3450 1 5 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.212 -0.569 25324 3451 1 5 . 1 1 106 106 GLU H H 106 8.814 8.814 8.863 -0.049 25324 3452 1 5 . 1 1 107 107 SER N N 107 115.335 115.335 118.298 -2.963 25324 3453 1 5 . 1 1 107 107 SER HA H 107 5.266 5.266 4.766 0.500 25324 3454 1 5 . 1 1 107 107 SER C C 107 175.787 175.787 174.588 1.199 25324 3455 1 5 . 1 1 107 107 SER CA C 107 55.888 55.888 56.470 -0.582 25324 3456 1 5 . 1 1 107 107 SER CB C 107 65.921 65.921 64.783 1.138 25324 3457 1 5 . 1 1 107 107 SER H H 107 8.576 8.576 8.412 0.164 25324 3458 1 5 . 1 1 108 108 GLY N N 108 117.567 117.567 112.101 5.466 25324 3459 1 5 . 1 1 108 108 GLY C C 108 173.959 173.959 174.637 -0.678 25324 3460 1 5 . 1 1 108 108 GLY CA C 108 44.677 44.677 44.876 -0.199 25324 3461 1 5 . 1 1 108 108 GLY H H 108 9.532 9.532 8.707 0.825 25324 3462 1 5 . 1 1 109 109 ASP N N 109 122.108 122.108 121.367 0.741 25324 3463 1 5 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.827 -0.026 25324 3464 1 5 . 1 1 109 109 ASP C C 109 176.203 176.203 175.702 0.501 25324 3465 1 5 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.915 -0.781 25324 3466 1 5 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.669 -3.327 25324 3467 1 5 . 1 1 109 109 ASP H H 109 8.605 8.605 7.618 0.987 25324 3468 1 5 . 1 1 110 110 ASP N N 110 116.197 116.197 117.271 -1.074 25324 3469 1 5 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.543 -0.321 25324 3470 1 5 . 1 1 110 110 ASP C C 110 175.951 175.951 176.312 -0.361 25324 3471 1 5 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.834 1.363 25324 3472 1 5 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.628 -1.998 25324 3473 1 5 . 1 1 110 110 ASP H H 110 9.087 9.087 8.527 0.560 25324 3474 1 5 . 1 1 111 111 GLY N N 111 103.841 103.841 107.040 -3.199 25324 3475 1 5 . 1 1 111 111 GLY C C 111 173.924 173.924 175.095 -1.171 25324 3476 1 5 . 1 1 111 111 GLY CA C 111 45.163 45.163 44.998 0.165 25324 3477 1 5 . 1 1 111 111 GLY H H 111 8.930 8.930 8.380 0.550 25324 3478 1 5 . 1 1 112 112 GLN N N 112 121.626 121.626 119.376 2.250 25324 3479 1 5 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.112 -0.042 25324 3480 1 5 . 1 1 112 112 GLN C C 112 176.431 176.431 175.871 0.560 25324 3481 1 5 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.498 -0.225 25324 3482 1 5 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.287 -1.594 25324 3483 1 5 . 1 1 112 112 GLN H H 112 7.351 7.351 8.654 -1.303 25324 3484 1 5 . 1 1 113 113 THR N N 113 112.322 112.322 106.613 5.709 25324 3485 1 5 . 1 1 113 113 THR HA H 113 5.331 5.331 5.177 0.154 25324 3486 1 5 . 1 1 113 113 THR C C 113 174.452 174.452 172.710 1.742 25324 3487 1 5 . 1 1 113 113 THR CA C 113 59.739 59.739 59.306 0.433 25324 3488 1 5 . 1 1 113 113 THR CB C 113 71.773 71.773 72.265 -0.492 25324 3489 1 5 . 1 1 113 113 THR H H 113 10.053 10.053 7.474 2.579 25324 3490 1 5 . 1 1 114 114 LEU N N 114 122.083 122.083 123.274 -1.191 25324 3491 1 5 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.678 -0.097 25324 3492 1 5 . 1 1 114 114 LEU C C 114 175.113 175.113 173.982 1.131 25324 3493 1 5 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.458 -1.553 25324 3494 1 5 . 1 1 114 114 LEU CB C 114 47.033 47.033 45.315 1.718 25324 3495 1 5 . 1 1 114 114 LEU H H 114 8.978 8.978 9.081 -0.103 25324 3496 1 5 . 1 1 115 115 ASN N N 115 118.846 118.846 124.324 -5.478 25324 3497 1 5 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.748 0.022 25324 3498 1 5 . 1 1 115 115 ASN C C 115 174.788 174.788 174.876 -0.088 25324 3499 1 5 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.412 0.930 25324 3500 1 5 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.785 0.629 25324 3501 1 5 . 1 1 115 115 ASN H H 115 8.837 8.837 7.970 0.867 25324 3502 1 5 . 1 1 116 116 GLY N N 116 109.661 109.661 107.824 1.837 25324 3503 1 5 . 1 1 116 116 GLY C C 116 172.452 172.452 172.424 0.028 25324 3504 1 5 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.341 0.130 25324 3505 1 5 . 1 1 116 116 GLY H H 116 8.625 8.625 8.962 -0.337 25324 3506 1 5 . 1 1 117 117 THR N N 117 120.009 120.009 114.174 5.835 25324 3507 1 5 . 1 1 117 117 THR HA H 117 5.556 5.556 5.380 0.176 25324 3508 1 5 . 1 1 117 117 THR C C 117 171.619 171.619 173.326 -1.707 25324 3509 1 5 . 1 1 117 117 THR CA C 117 59.373 59.373 60.302 -0.929 25324 3510 1 5 . 1 1 117 117 THR CB C 117 72.777 72.777 72.519 0.258 25324 3511 1 5 . 1 1 117 117 THR H H 117 8.911 8.911 8.974 -0.063 25324 3512 1 5 . 1 1 118 118 MET N N 118 115.550 115.550 118.571 -3.021 25324 3513 1 5 . 1 1 118 118 MET HA H 118 4.889 4.889 5.457 -0.568 25324 3514 1 5 . 1 1 118 118 MET C C 118 172.707 172.707 174.140 -1.433 25324 3515 1 5 . 1 1 118 118 MET CA C 118 54.714 54.714 54.619 0.095 25324 3516 1 5 . 1 1 118 118 MET CB C 118 33.663 33.663 37.364 -3.701 25324 3517 1 5 . 1 1 118 118 MET H H 118 9.159 9.159 9.382 -0.223 25324 3518 1 5 . 1 1 119 119 THR N N 119 113.716 113.716 117.677 -3.961 25324 3519 1 5 . 1 1 119 119 THR HA H 119 4.682 4.682 5.262 -0.580 25324 3520 1 5 . 1 1 119 119 THR C C 119 173.952 173.952 173.847 0.105 25324 3521 1 5 . 1 1 119 119 THR CA C 119 61.395 61.395 61.306 0.089 25324 3522 1 5 . 1 1 119 119 THR CB C 119 71.746 71.746 71.595 0.151 25324 3523 1 5 . 1 1 119 119 THR H H 119 8.685 8.685 8.864 -0.179 25324 3524 1 5 . 1 1 120 120 TYR N N 120 129.153 129.153 125.165 3.988 25324 3525 1 5 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.752 0.048 25324 3526 1 5 . 1 1 120 120 TYR C C 120 175.214 175.214 177.522 -2.308 25324 3527 1 5 . 1 1 120 120 TYR CA C 120 58.877 58.877 59.010 -0.133 25324 3528 1 5 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.203 1.299 25324 3529 1 5 . 1 1 120 120 TYR H H 120 10.107 10.107 8.163 1.944 25324 3530 1 5 . 1 1 121 121 ALA N N 121 119.947 119.947 124.529 -4.582 25324 3531 1 5 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.131 -0.127 25324 3532 1 5 . 1 1 121 121 ALA C C 121 178.456 178.456 177.152 1.304 25324 3533 1 5 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.416 -0.460 25324 3534 1 5 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.972 -0.262 25324 3535 1 5 . 1 1 121 121 ALA H H 121 8.704 8.704 8.419 0.285 25324 3536 1 5 . 1 1 122 122 GLY N N 122 111.186 111.186 103.448 7.738 25324 3537 1 5 . 1 1 122 122 GLY C C 122 173.949 173.949 174.026 -0.077 25324 3538 1 5 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.166 -0.164 25324 3539 1 5 . 1 1 122 122 GLY H H 122 8.792 8.792 8.280 0.512 25324 3540 1 5 . 1 1 123 123 GLU N N 123 120.099 120.099 120.041 0.058 25324 3541 1 5 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.467 0.238 25324 3542 1 5 . 1 1 123 123 GLU C C 123 175.912 175.912 177.084 -1.172 25324 3543 1 5 . 1 1 123 123 GLU CA C 123 54.414 54.414 55.969 -1.555 25324 3544 1 5 . 1 1 123 123 GLU CB C 123 32.784 32.784 30.382 2.402 25324 3545 1 5 . 1 1 123 123 GLU H H 123 8.072 8.072 8.251 -0.179 25324 3546 1 5 . 1 1 124 124 GLY N N 124 105.303 105.303 108.614 -3.311 25324 3547 1 5 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.338 -0.536 25324 3548 1 5 . 1 1 124 124 GLY H H 124 7.939 7.939 7.632 0.307 25324 3549 1 5 . 1 1 125 125 PRO HA H 125 4.935 4.935 5.247 -0.312 25324 3550 1 5 . 1 1 125 125 PRO C C 125 177.788 177.788 176.242 1.546 25324 3551 1 5 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.439 0.692 25324 3552 1 5 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.906 -0.047 25324 3553 1 5 . 1 1 126 126 ILE N N 126 117.387 117.387 119.214 -1.827 25324 3554 1 5 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.765 0.134 25324 3555 1 5 . 1 1 126 126 ILE C C 126 175.625 175.625 174.859 0.766 25324 3556 1 5 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.048 0.405 25324 3557 1 5 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.493 1.055 25324 3558 1 5 . 1 1 126 126 ILE H H 126 9.599 9.599 9.052 0.547 25324 3559 1 5 . 1 1 127 127 GLY N N 127 106.753 106.753 108.285 -1.532 25324 3560 1 5 . 1 1 127 127 GLY C C 127 173.627 173.627 172.687 0.940 25324 3561 1 5 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.656 1.627 25324 3562 1 5 . 1 1 127 127 GLY H H 127 8.840 8.840 8.814 0.026 25324 3563 1 5 . 1 1 128 128 PHE N N 128 124.826 124.826 126.154 -1.328 25324 3564 1 5 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.170 -0.226 25324 3565 1 5 . 1 1 128 128 PHE C C 128 173.087 173.087 173.352 -0.265 25324 3566 1 5 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.544 0.465 25324 3567 1 5 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.312 -0.152 25324 3568 1 5 . 1 1 128 128 PHE H H 128 8.924 8.924 9.012 -0.088 25324 3569 1 5 . 1 1 129 129 LYS N N 129 131.518 131.518 128.151 3.367 25324 3570 1 5 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.804 0.079 25324 3571 1 5 . 1 1 129 129 LYS C C 129 173.863 173.863 173.908 -0.045 25324 3572 1 5 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.485 1.250 25324 3573 1 5 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.561 -0.840 25324 3574 1 5 . 1 1 129 129 LYS H H 129 8.201 8.201 8.100 0.101 25324 3575 1 5 . 1 1 130 130 GLY N N 130 114.030 114.030 113.541 0.489 25324 3576 1 5 . 1 1 130 130 GLY C C 130 171.951 171.951 172.458 -0.507 25324 3577 1 5 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.694 0.093 25324 3578 1 5 . 1 1 130 130 GLY H H 130 9.325 9.325 8.756 0.569 25324 3579 1 5 . 1 1 131 131 THR N N 131 120.583 120.583 120.905 -0.322 25324 3580 1 5 . 1 1 131 131 THR HA H 131 4.939 4.939 4.740 0.199 25324 3581 1 5 . 1 1 131 131 THR C C 131 173.118 173.118 173.366 -0.248 25324 3582 1 5 . 1 1 131 131 THR CA C 131 61.266 61.266 61.427 -0.161 25324 3583 1 5 . 1 1 131 131 THR CB C 131 70.392 70.392 72.378 -1.986 25324 3584 1 5 . 1 1 131 131 THR H H 131 8.916 8.916 8.811 0.105 25324 3585 1 5 . 1 1 132 132 LEU N N 132 130.774 130.774 129.449 1.325 25324 3586 1 5 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.906 -0.406 25324 3587 1 5 . 1 1 132 132 LEU C C 132 176.574 176.574 176.039 0.535 25324 3588 1 5 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.503 0.684 25324 3589 1 5 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.313 0.134 25324 3590 1 5 . 1 1 132 132 LEU H H 132 8.527 8.527 8.796 -0.269 25324 3591 1 6 . 1 1 3 3 LEU N N 3 123.202 123.202 123.921 -0.719 25324 3592 1 6 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.917 0.240 25324 3593 1 6 . 1 1 3 3 LEU C C 3 175.786 175.786 174.991 0.795 25324 3594 1 6 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.456 -0.172 25324 3595 1 6 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.209 0.121 25324 3596 1 6 . 1 1 3 3 LEU H H 3 8.711 8.711 8.258 0.453 25324 3597 1 6 . 1 1 4 4 TYR N N 4 120.906 120.906 125.292 -4.386 25324 3598 1 6 . 1 1 4 4 TYR HA H 4 5.024 5.024 4.922 0.102 25324 3599 1 6 . 1 1 4 4 TYR C C 4 175.953 175.953 174.588 1.365 25324 3600 1 6 . 1 1 4 4 TYR CA C 4 56.377 56.377 57.118 -0.741 25324 3601 1 6 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.028 -0.373 25324 3602 1 6 . 1 1 4 4 TYR H H 4 9.142 9.142 9.516 -0.374 25324 3603 1 6 . 1 1 5 5 ASN N N 5 120.496 120.496 121.299 -0.803 25324 3604 1 6 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.926 0.190 25324 3605 1 6 . 1 1 5 5 ASN C C 5 174.953 174.953 173.905 1.048 25324 3606 1 6 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.307 0.639 25324 3607 1 6 . 1 1 5 5 ASN CB C 5 38.891 38.891 39.668 -0.777 25324 3608 1 6 . 1 1 5 5 ASN H H 5 8.787 8.787 9.015 -0.228 25324 3609 1 6 . 1 1 6 6 VAL N N 6 127.428 127.428 127.800 -0.372 25324 3610 1 6 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.117 0.245 25324 3611 1 6 . 1 1 6 6 VAL C C 6 174.955 174.955 174.664 0.291 25324 3612 1 6 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.601 -0.168 25324 3613 1 6 . 1 1 6 6 VAL CB C 6 33.331 33.331 31.440 1.891 25324 3614 1 6 . 1 1 6 6 VAL H H 6 8.806 8.806 7.836 0.970 25324 3615 1 6 . 1 1 7 7 GLU N N 7 124.355 124.355 128.369 -4.014 25324 3616 1 6 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.529 0.453 25324 3617 1 6 . 1 1 7 7 GLU C C 7 174.551 174.551 175.047 -0.496 25324 3618 1 6 . 1 1 7 7 GLU CA C 7 53.789 53.789 55.682 -1.893 25324 3619 1 6 . 1 1 7 7 GLU CB C 7 34.567 34.567 31.547 3.020 25324 3620 1 6 . 1 1 7 7 GLU H H 7 8.800 8.800 8.713 0.087 25324 3621 1 6 . 1 1 8 8 ASN N N 8 116.231 116.231 120.797 -4.566 25324 3622 1 6 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.725 0.316 25324 3623 1 6 . 1 1 8 8 ASN C C 8 172.709 172.709 173.429 -0.720 25324 3624 1 6 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.172 -0.555 25324 3625 1 6 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.700 1.885 25324 3626 1 6 . 1 1 8 8 ASN H H 8 9.320 9.320 9.021 0.299 25324 3627 1 6 . 1 1 9 9 GLN N N 9 120.762 120.762 121.041 -0.279 25324 3628 1 6 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.424 -0.250 25324 3629 1 6 . 1 1 9 9 GLN C C 9 173.454 173.454 174.471 -1.017 25324 3630 1 6 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.214 -0.254 25324 3631 1 6 . 1 1 9 9 GLN CB C 9 30.691 30.691 29.999 0.692 25324 3632 1 6 . 1 1 9 9 GLN H H 9 6.887 6.887 8.562 -1.675 25324 3633 1 6 . 1 1 10 10 TRP N N 10 127.775 127.775 125.514 2.261 25324 3634 1 6 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.072 -0.084 25324 3635 1 6 . 1 1 10 10 TRP C C 10 175.281 175.281 175.626 -0.345 25324 3636 1 6 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.342 -0.049 25324 3637 1 6 . 1 1 10 10 TRP CB C 10 29.742 29.742 29.795 -0.053 25324 3638 1 6 . 1 1 10 10 TRP H H 10 8.518 8.518 8.172 0.346 25324 3639 1 6 . 1 1 11 11 GLY N N 11 107.838 107.838 108.915 -1.077 25324 3640 1 6 . 1 1 11 11 GLY C C 11 174.733 174.733 174.256 0.477 25324 3641 1 6 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.476 0.360 25324 3642 1 6 . 1 1 11 11 GLY H H 11 8.461 8.461 8.194 0.267 25324 3643 1 6 . 1 1 12 12 GLY N N 12 109.696 109.696 108.120 1.576 25324 3644 1 6 . 1 1 12 12 GLY C C 12 174.133 174.133 174.834 -0.701 25324 3645 1 6 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.400 -0.611 25324 3646 1 6 . 1 1 12 12 GLY H H 12 8.138 8.138 7.399 0.739 25324 3647 1 6 . 1 1 13 13 SER N N 13 111.308 111.308 114.501 -3.193 25324 3648 1 6 . 1 1 13 13 SER HA H 13 4.092 4.092 4.445 -0.353 25324 3649 1 6 . 1 1 13 13 SER C C 13 175.622 175.622 175.412 0.210 25324 3650 1 6 . 1 1 13 13 SER CA C 13 60.494 60.494 59.916 0.578 25324 3651 1 6 . 1 1 13 13 SER CB C 13 63.028 63.028 63.564 -0.536 25324 3652 1 6 . 1 1 13 13 SER H H 13 8.215 8.215 8.573 -0.358 25324 3653 1 6 . 1 1 14 14 SER N N 14 115.290 115.290 115.323 -0.033 25324 3654 1 6 . 1 1 14 14 SER HA H 14 4.566 4.566 4.438 0.128 25324 3655 1 6 . 1 1 14 14 SER C C 14 173.532 173.532 174.508 -0.976 25324 3656 1 6 . 1 1 14 14 SER CA C 14 57.317 57.317 57.818 -0.501 25324 3657 1 6 . 1 1 14 14 SER CB C 14 63.230 63.230 63.223 0.007 25324 3658 1 6 . 1 1 14 14 SER H H 14 8.213 8.213 7.811 0.402 25324 3659 1 6 . 1 1 15 15 ALA N N 15 126.470 126.470 126.684 -0.214 25324 3660 1 6 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.430 -0.027 25324 3661 1 6 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.896 0.568 25324 3662 1 6 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.358 -0.129 25324 3663 1 6 . 1 1 15 15 ALA H H 15 7.308 7.308 7.342 -0.034 25324 3664 1 6 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.284 0.125 25324 3665 1 6 . 1 1 16 16 PRO C C 16 175.627 175.627 175.641 -0.014 25324 3666 1 6 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.306 0.085 25324 3667 1 6 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.608 -0.470 25324 3668 1 6 . 1 1 17 17 TRP N N 17 120.228 120.228 119.013 1.215 25324 3669 1 6 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.686 -0.368 25324 3670 1 6 . 1 1 17 17 TRP C C 17 175.951 175.951 176.458 -0.507 25324 3671 1 6 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.979 -0.064 25324 3672 1 6 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.411 -1.002 25324 3673 1 6 . 1 1 17 17 TRP H H 17 8.380 8.380 8.129 0.251 25324 3674 1 6 . 1 1 18 18 ASN N N 18 120.663 120.663 119.326 1.337 25324 3675 1 6 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.001 0.085 25324 3676 1 6 . 1 1 18 18 ASN C C 18 174.793 174.793 173.682 1.111 25324 3677 1 6 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.207 -0.606 25324 3678 1 6 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.082 1.566 25324 3679 1 6 . 1 1 18 18 ASN H H 18 9.094 9.094 8.849 0.245 25324 3680 1 6 . 1 1 19 19 GLU N N 19 122.202 122.202 121.989 0.213 25324 3681 1 6 . 1 1 19 19 GLU HA H 19 4.139 4.139 5.056 -0.917 25324 3682 1 6 . 1 1 19 19 GLU C C 19 176.869 176.869 176.442 0.427 25324 3683 1 6 . 1 1 19 19 GLU CA C 19 58.600 58.600 55.402 3.198 25324 3684 1 6 . 1 1 19 19 GLU CB C 19 29.382 29.382 30.512 -1.130 25324 3685 1 6 . 1 1 19 19 GLU H H 19 9.013 9.013 8.631 0.382 25324 3686 1 6 . 1 1 20 20 GLY N N 20 112.893 112.893 110.711 2.182 25324 3687 1 6 . 1 1 20 20 GLY C C 20 174.878 174.878 173.314 1.564 25324 3688 1 6 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.926 0.069 25324 3689 1 6 . 1 1 20 20 GLY H H 20 8.926 8.926 8.701 0.225 25324 3690 1 6 . 1 1 21 21 GLY N N 21 110.354 110.354 107.953 2.401 25324 3691 1 6 . 1 1 21 21 GLY C C 21 171.623 171.623 172.056 -0.433 25324 3692 1 6 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.331 -0.933 25324 3693 1 6 . 1 1 21 21 GLY H H 21 8.258 8.258 7.857 0.401 25324 3694 1 6 . 1 1 22 22 GLN N N 22 117.541 117.541 118.251 -0.710 25324 3695 1 6 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.050 0.627 25324 3696 1 6 . 1 1 22 22 GLN C C 22 175.957 175.957 174.729 1.228 25324 3697 1 6 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.623 0.321 25324 3698 1 6 . 1 1 22 22 GLN CB C 22 31.085 31.085 31.479 -0.394 25324 3699 1 6 . 1 1 22 22 GLN H H 22 8.564 8.564 8.620 -0.056 25324 3700 1 6 . 1 1 23 23 TRP N N 23 127.208 127.208 123.872 3.336 25324 3701 1 6 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.051 0.148 25324 3702 1 6 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.697 -0.166 25324 3703 1 6 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.390 -0.707 25324 3704 1 6 . 1 1 23 23 TRP H H 23 9.347 9.347 8.919 0.428 25324 3705 1 6 . 1 1 24 24 GLU N N 24 123.504 123.504 119.823 3.681 25324 3706 1 6 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.257 0.251 25324 3707 1 6 . 1 1 24 24 GLU C C 24 174.222 174.222 176.350 -2.128 25324 3708 1 6 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.081 0.509 25324 3709 1 6 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.423 -1.808 25324 3710 1 6 . 1 1 24 24 GLU H H 24 9.296 9.296 8.529 0.767 25324 3711 1 6 . 1 1 25 25 ILE N N 25 123.447 123.447 126.160 -2.713 25324 3712 1 6 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.795 -0.359 25324 3713 1 6 . 1 1 25 25 ILE C C 25 175.790 175.790 174.873 0.917 25324 3714 1 6 . 1 1 25 25 ILE CA C 25 59.627 59.627 61.112 -1.485 25324 3715 1 6 . 1 1 25 25 ILE CB C 25 40.952 40.952 38.935 2.017 25324 3716 1 6 . 1 1 25 25 ILE H H 25 8.635 8.635 7.895 0.740 25324 3717 1 6 . 1 1 26 26 GLY N N 26 111.544 111.544 107.681 3.863 25324 3718 1 6 . 1 1 26 26 GLY C C 26 172.122 172.122 173.661 -1.539 25324 3719 1 6 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.120 -0.042 25324 3720 1 6 . 1 1 26 26 GLY H H 26 3.381 3.381 7.517 -4.136 25324 3721 1 6 . 1 1 27 27 SER N N 27 112.279 112.279 117.060 -4.781 25324 3722 1 6 . 1 1 27 27 SER HA H 27 4.876 4.876 4.608 0.268 25324 3723 1 6 . 1 1 27 27 SER C C 27 174.113 174.113 174.798 -0.685 25324 3724 1 6 . 1 1 27 27 SER CA C 27 56.954 56.954 58.101 -1.147 25324 3725 1 6 . 1 1 27 27 SER CB C 27 64.554 64.554 64.796 -0.242 25324 3726 1 6 . 1 1 27 27 SER H H 27 8.212 8.212 8.664 -0.452 25324 3727 1 6 . 1 1 28 28 ARG N N 28 120.872 120.872 122.121 -1.249 25324 3728 1 6 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.643 0.120 25324 3729 1 6 . 1 1 28 28 ARG C C 28 176.119 176.119 175.164 0.955 25324 3730 1 6 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.519 -0.402 25324 3731 1 6 . 1 1 28 28 ARG CB C 28 31.830 31.830 32.417 -0.587 25324 3732 1 6 . 1 1 28 28 ARG H H 28 7.849 7.849 8.083 -0.234 25324 3733 1 6 . 1 1 29 29 SER N N 29 118.985 118.985 118.600 0.385 25324 3734 1 6 . 1 1 29 29 SER HA H 29 4.192 4.192 4.430 -0.238 25324 3735 1 6 . 1 1 29 29 SER C C 29 174.622 174.622 174.165 0.457 25324 3736 1 6 . 1 1 29 29 SER CA C 29 60.072 60.072 59.054 1.018 25324 3737 1 6 . 1 1 29 29 SER CB C 29 62.876 62.876 63.688 -0.812 25324 3738 1 6 . 1 1 29 29 SER H H 29 8.892 8.892 8.730 0.162 25324 3739 1 6 . 1 1 30 30 ASP N N 30 117.632 117.632 120.700 -3.068 25324 3740 1 6 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.345 0.273 25324 3741 1 6 . 1 1 30 30 ASP C C 30 175.101 175.101 174.706 0.395 25324 3742 1 6 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.433 -2.381 25324 3743 1 6 . 1 1 30 30 ASP CB C 30 40.523 40.523 39.946 0.577 25324 3744 1 6 . 1 1 30 30 ASP H H 30 8.441 8.441 8.755 -0.314 25324 3745 1 6 . 1 1 31 31 GLN N N 31 118.273 118.273 117.196 1.077 25324 3746 1 6 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.509 -0.024 25324 3747 1 6 . 1 1 31 31 GLN C C 31 173.453 173.453 173.660 -0.207 25324 3748 1 6 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.170 -0.302 25324 3749 1 6 . 1 1 31 31 GLN CB C 31 33.249 33.249 29.959 3.290 25324 3750 1 6 . 1 1 31 31 GLN H H 31 7.029 7.029 7.777 -0.748 25324 3751 1 6 . 1 1 32 32 ASN N N 32 120.865 120.865 119.805 1.060 25324 3752 1 6 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.962 0.158 25324 3753 1 6 . 1 1 32 32 ASN C C 32 175.198 175.198 174.746 0.452 25324 3754 1 6 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.182 -0.313 25324 3755 1 6 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.227 -0.597 25324 3756 1 6 . 1 1 32 32 ASN H H 32 8.713 8.713 8.274 0.439 25324 3757 1 6 . 1 1 33 33 VAL N N 33 122.111 122.111 121.375 0.736 25324 3758 1 6 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.297 -0.592 25324 3759 1 6 . 1 1 33 33 VAL C C 33 174.950 174.950 175.874 -0.924 25324 3760 1 6 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.473 1.374 25324 3761 1 6 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.599 0.751 25324 3762 1 6 . 1 1 33 33 VAL H H 33 8.542 8.542 8.872 -0.330 25324 3763 1 6 . 1 1 34 34 VAL N N 34 113.282 113.282 119.065 -5.783 25324 3764 1 6 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.416 0.229 25324 3765 1 6 . 1 1 34 34 VAL C C 34 175.574 175.574 174.507 1.067 25324 3766 1 6 . 1 1 34 34 VAL CA C 34 59.974 59.974 60.975 -1.001 25324 3767 1 6 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.542 0.487 25324 3768 1 6 . 1 1 34 34 VAL H H 34 8.744 8.744 8.949 -0.205 25324 3769 1 6 . 1 1 35 35 ALA N N 35 122.102 122.102 121.425 0.677 25324 3770 1 6 . 1 1 35 35 ALA HA H 35 4.803 4.803 4.817 -0.014 25324 3771 1 6 . 1 1 35 35 ALA C C 35 175.947 175.947 174.827 1.120 25324 3772 1 6 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.683 1.567 25324 3773 1 6 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.335 -0.707 25324 3774 1 6 . 1 1 35 35 ALA H H 35 7.677 7.677 7.796 -0.119 25324 3775 1 6 . 1 1 36 36 ILE N N 36 118.005 118.005 120.517 -2.512 25324 3776 1 6 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.265 -0.237 25324 3777 1 6 . 1 1 36 36 ILE C C 36 173.116 173.116 173.801 -0.685 25324 3778 1 6 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.310 0.872 25324 3779 1 6 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.531 0.954 25324 3780 1 6 . 1 1 36 36 ILE H H 36 8.126 8.126 8.834 -0.708 25324 3781 1 6 . 1 1 37 37 ASN N N 37 125.632 125.632 126.172 -0.540 25324 3782 1 6 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.759 -0.078 25324 3783 1 6 . 1 1 37 37 ASN C C 37 174.854 174.854 174.327 0.527 25324 3784 1 6 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.504 0.026 25324 3785 1 6 . 1 1 37 37 ASN CB C 37 38.853 38.853 40.185 -1.332 25324 3786 1 6 . 1 1 37 37 ASN H H 37 8.577 8.577 9.013 -0.436 25324 3787 1 6 . 1 1 38 38 VAL N N 38 114.223 114.223 117.988 -3.765 25324 3788 1 6 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.629 0.574 25324 3789 1 6 . 1 1 38 38 VAL C C 38 174.854 174.854 173.443 1.411 25324 3790 1 6 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.503 -1.523 25324 3791 1 6 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.266 0.778 25324 3792 1 6 . 1 1 38 38 VAL H H 38 8.874 8.874 7.904 0.970 25324 3793 1 6 . 1 1 39 39 GLU N N 39 118.277 118.277 119.138 -0.861 25324 3794 1 6 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.112 -0.030 25324 3795 1 6 . 1 1 39 39 GLU C C 39 174.548 174.548 175.431 -0.883 25324 3796 1 6 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.955 1.038 25324 3797 1 6 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.170 -0.592 25324 3798 1 6 . 1 1 39 39 GLU H H 39 8.761 8.761 9.197 -0.436 25324 3799 1 6 . 1 1 40 40 SER N N 40 114.960 114.960 118.653 -3.693 25324 3800 1 6 . 1 1 40 40 SER HA H 40 5.265 5.265 5.237 0.028 25324 3801 1 6 . 1 1 40 40 SER C C 40 175.783 175.783 175.002 0.781 25324 3802 1 6 . 1 1 40 40 SER CA C 40 55.880 55.880 57.450 -1.570 25324 3803 1 6 . 1 1 40 40 SER CB C 40 65.911 65.911 63.861 2.050 25324 3804 1 6 . 1 1 40 40 SER H H 40 8.500 8.500 8.494 0.006 25324 3805 1 6 . 1 1 41 41 GLY N N 41 117.567 117.567 109.857 7.710 25324 3806 1 6 . 1 1 41 41 GLY C C 41 174.119 174.119 174.741 -0.622 25324 3807 1 6 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.333 -0.645 25324 3808 1 6 . 1 1 41 41 GLY H H 41 9.533 9.533 8.428 1.105 25324 3809 1 6 . 1 1 42 42 ASP N N 42 122.141 122.141 121.273 0.868 25324 3810 1 6 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.898 -0.098 25324 3811 1 6 . 1 1 42 42 ASP C C 42 176.121 176.121 177.053 -0.932 25324 3812 1 6 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.661 -1.515 25324 3813 1 6 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.232 -2.878 25324 3814 1 6 . 1 1 42 42 ASP H H 42 8.644 8.644 8.260 0.384 25324 3815 1 6 . 1 1 43 43 ASP N N 43 116.025 116.025 120.721 -4.696 25324 3816 1 6 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.512 -0.283 25324 3817 1 6 . 1 1 43 43 ASP C C 43 176.018 176.018 176.510 -0.492 25324 3818 1 6 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.645 0.604 25324 3819 1 6 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.189 -0.630 25324 3820 1 6 . 1 1 43 43 ASP H H 43 9.111 9.111 8.744 0.367 25324 3821 1 6 . 1 1 44 44 GLY N N 44 104.263 104.263 107.426 -3.163 25324 3822 1 6 . 1 1 44 44 GLY C C 44 173.922 173.922 175.250 -1.328 25324 3823 1 6 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.929 -0.628 25324 3824 1 6 . 1 1 44 44 GLY H H 44 9.063 9.063 8.204 0.859 25324 3825 1 6 . 1 1 45 45 GLN N N 45 121.691 121.691 118.266 3.425 25324 3826 1 6 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.328 -0.242 25324 3827 1 6 . 1 1 45 45 GLN C C 45 176.284 176.284 175.463 0.821 25324 3828 1 6 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.778 0.340 25324 3829 1 6 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.003 -1.329 25324 3830 1 6 . 1 1 45 45 GLN H H 45 7.356 7.356 8.630 -1.274 25324 3831 1 6 . 1 1 46 46 THR N N 46 111.843 111.843 110.337 1.506 25324 3832 1 6 . 1 1 46 46 THR HA H 46 5.355 5.355 5.306 0.049 25324 3833 1 6 . 1 1 46 46 THR C C 46 174.451 174.451 173.466 0.985 25324 3834 1 6 . 1 1 46 46 THR CA C 46 59.644 59.644 60.348 -0.704 25324 3835 1 6 . 1 1 46 46 THR CB C 46 72.714 72.714 70.937 1.777 25324 3836 1 6 . 1 1 46 46 THR H H 46 10.123 10.123 7.661 2.462 25324 3837 1 6 . 1 1 47 47 LEU N N 47 119.302 119.302 125.813 -6.511 25324 3838 1 6 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.955 -0.148 25324 3839 1 6 . 1 1 47 47 LEU C C 47 175.487 175.487 174.989 0.498 25324 3840 1 6 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.889 -0.819 25324 3841 1 6 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.868 3.135 25324 3842 1 6 . 1 1 47 47 LEU H H 47 8.364 8.364 8.953 -0.589 25324 3843 1 6 . 1 1 48 48 ASN N N 48 116.844 116.844 118.235 -1.391 25324 3844 1 6 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.162 -0.433 25324 3845 1 6 . 1 1 48 48 ASN C C 48 174.460 174.460 174.812 -0.352 25324 3846 1 6 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.661 1.078 25324 3847 1 6 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.588 0.825 25324 3848 1 6 . 1 1 48 48 ASN H H 48 8.748 8.748 9.048 -0.300 25324 3849 1 6 . 1 1 49 49 GLY N N 49 109.417 109.417 107.424 1.993 25324 3850 1 6 . 1 1 49 49 GLY C C 49 172.126 172.126 172.584 -0.458 25324 3851 1 6 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.284 0.207 25324 3852 1 6 . 1 1 49 49 GLY H H 49 8.744 8.744 8.794 -0.050 25324 3853 1 6 . 1 1 50 50 THR N N 50 119.162 119.162 114.751 4.411 25324 3854 1 6 . 1 1 50 50 THR HA H 50 5.556 5.556 5.596 -0.040 25324 3855 1 6 . 1 1 50 50 THR C C 50 171.790 171.790 172.770 -0.980 25324 3856 1 6 . 1 1 50 50 THR CA C 50 59.371 59.371 60.398 -1.027 25324 3857 1 6 . 1 1 50 50 THR CB C 50 72.799 72.799 72.638 0.161 25324 3858 1 6 . 1 1 50 50 THR H H 50 8.799 8.799 8.204 0.595 25324 3859 1 6 . 1 1 51 51 MET N N 51 115.232 115.232 122.020 -6.788 25324 3860 1 6 . 1 1 51 51 MET HA H 51 4.886 4.886 4.818 0.068 25324 3861 1 6 . 1 1 51 51 MET C C 51 172.708 172.708 173.521 -0.813 25324 3862 1 6 . 1 1 51 51 MET CA C 51 54.722 54.722 54.140 0.582 25324 3863 1 6 . 1 1 51 51 MET CB C 51 34.557 34.557 37.345 -2.788 25324 3864 1 6 . 1 1 51 51 MET H H 51 9.062 9.062 9.337 -0.275 25324 3865 1 6 . 1 1 52 52 THR N N 52 113.697 113.697 121.169 -7.472 25324 3866 1 6 . 1 1 52 52 THR HA H 52 4.682 4.682 4.845 -0.163 25324 3867 1 6 . 1 1 52 52 THR C C 52 173.952 173.952 173.569 0.383 25324 3868 1 6 . 1 1 52 52 THR CA C 52 61.395 61.395 61.306 0.089 25324 3869 1 6 . 1 1 52 52 THR CB C 52 71.734 71.734 71.388 0.346 25324 3870 1 6 . 1 1 52 52 THR H H 52 8.685 8.685 8.834 -0.149 25324 3871 1 6 . 1 1 53 53 TYR N N 53 129.086 129.086 125.637 3.449 25324 3872 1 6 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.893 -0.093 25324 3873 1 6 . 1 1 53 53 TYR C C 53 175.214 175.214 176.248 -1.034 25324 3874 1 6 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.911 0.970 25324 3875 1 6 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.773 0.739 25324 3876 1 6 . 1 1 53 53 TYR H H 53 10.112 10.112 8.942 1.170 25324 3877 1 6 . 1 1 54 54 ALA N N 54 119.947 119.947 123.632 -3.685 25324 3878 1 6 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.360 -0.358 25324 3879 1 6 . 1 1 54 54 ALA C C 54 178.285 178.285 177.782 0.503 25324 3880 1 6 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.465 0.506 25324 3881 1 6 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.893 -0.176 25324 3882 1 6 . 1 1 54 54 ALA H H 54 8.704 8.704 8.745 -0.041 25324 3883 1 6 . 1 1 55 55 GLY N N 55 110.940 110.940 110.883 0.057 25324 3884 1 6 . 1 1 55 55 GLY C C 55 173.903 173.903 174.523 -0.620 25324 3885 1 6 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.572 -0.556 25324 3886 1 6 . 1 1 55 55 GLY H H 55 8.745 8.745 8.772 -0.027 25324 3887 1 6 . 1 1 56 56 GLU N N 56 120.073 120.073 121.458 -1.385 25324 3888 1 6 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.710 -0.001 25324 3889 1 6 . 1 1 56 56 GLU C C 56 175.906 175.906 176.385 -0.479 25324 3890 1 6 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.992 -0.569 25324 3891 1 6 . 1 1 56 56 GLU CB C 56 32.824 32.824 31.764 1.060 25324 3892 1 6 . 1 1 56 56 GLU H H 56 8.039 8.039 7.707 0.332 25324 3893 1 6 . 1 1 57 57 GLY N N 57 105.298 105.298 107.767 -2.469 25324 3894 1 6 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.779 0.023 25324 3895 1 6 . 1 1 57 57 GLY H H 57 7.937 7.937 8.293 -0.356 25324 3896 1 6 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.475 0.459 25324 3897 1 6 . 1 1 58 58 PRO C C 58 177.785 177.785 175.935 1.850 25324 3898 1 6 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.234 -0.102 25324 3899 1 6 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.285 -0.445 25324 3900 1 6 . 1 1 59 59 ILE N N 59 117.386 117.386 121.362 -3.976 25324 3901 1 6 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.478 0.510 25324 3902 1 6 . 1 1 59 59 ILE C C 59 175.688 175.688 175.620 0.068 25324 3903 1 6 . 1 1 59 59 ILE CA C 59 59.543 59.543 60.255 -0.712 25324 3904 1 6 . 1 1 59 59 ILE CB C 59 42.288 42.288 42.567 -0.279 25324 3905 1 6 . 1 1 59 59 ILE H H 59 9.600 9.600 8.340 1.260 25324 3906 1 6 . 1 1 60 60 GLY N N 60 107.164 107.164 112.243 -5.079 25324 3907 1 6 . 1 1 60 60 GLY C C 60 173.787 173.787 172.577 1.210 25324 3908 1 6 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.608 1.627 25324 3909 1 6 . 1 1 60 60 GLY H H 60 8.957 8.957 9.151 -0.194 25324 3910 1 6 . 1 1 61 61 PHE N N 61 124.597 124.597 127.134 -2.537 25324 3911 1 6 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.657 -0.434 25324 3912 1 6 . 1 1 61 61 PHE C C 61 173.126 173.126 173.671 -0.545 25324 3913 1 6 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.256 0.605 25324 3914 1 6 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.091 0.126 25324 3915 1 6 . 1 1 61 61 PHE H H 61 8.788 8.788 9.024 -0.236 25324 3916 1 6 . 1 1 62 62 ARG N N 62 129.706 129.706 127.976 1.730 25324 3917 1 6 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.457 -0.325 25324 3918 1 6 . 1 1 62 62 ARG C C 62 172.456 172.456 173.137 -0.681 25324 3919 1 6 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.056 0.898 25324 3920 1 6 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.222 -1.353 25324 3921 1 6 . 1 1 62 62 ARG H H 62 8.405 8.405 8.286 0.119 25324 3922 1 6 . 1 1 63 63 ALA N N 63 122.744 122.744 128.934 -6.190 25324 3923 1 6 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.396 -0.051 25324 3924 1 6 . 1 1 63 63 ALA C C 63 176.120 176.120 175.437 0.683 25324 3925 1 6 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.297 -0.378 25324 3926 1 6 . 1 1 63 63 ALA CB C 63 24.773 24.773 23.144 1.629 25324 3927 1 6 . 1 1 63 63 ALA H H 63 8.628 8.628 8.972 -0.344 25324 3928 1 6 . 1 1 64 64 THR N N 64 116.855 116.855 117.639 -0.784 25324 3929 1 6 . 1 1 64 64 THR HA H 64 4.848 4.848 5.305 -0.457 25324 3930 1 6 . 1 1 64 64 THR C C 64 172.957 172.957 173.679 -0.722 25324 3931 1 6 . 1 1 64 64 THR CA C 64 61.211 61.211 61.078 0.133 25324 3932 1 6 . 1 1 64 64 THR CB C 64 71.064 71.064 71.666 -0.602 25324 3933 1 6 . 1 1 64 64 THR H H 64 8.315 8.315 8.612 -0.297 25324 3934 1 6 . 1 1 65 65 LEU N N 65 129.360 129.360 129.267 0.093 25324 3935 1 6 . 1 1 65 65 LEU HA H 65 3.362 3.362 4.030 -0.668 25324 3936 1 6 . 1 1 65 65 LEU C C 65 176.459 176.459 175.935 0.524 25324 3937 1 6 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.188 1.499 25324 3938 1 6 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.400 0.311 25324 3939 1 6 . 1 1 65 65 LEU H H 65 8.877 8.877 8.994 -0.117 25324 3940 1 6 . 1 1 66 66 LEU N N 66 128.683 128.683 126.844 1.839 25324 3941 1 6 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.428 -0.053 25324 3942 1 6 . 1 1 66 66 LEU C C 66 177.621 177.621 176.659 0.962 25324 3943 1 6 . 1 1 66 66 LEU CA C 66 54.700 54.700 54.992 -0.292 25324 3944 1 6 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.520 -0.218 25324 3945 1 6 . 1 1 66 66 LEU H H 66 9.320 9.320 8.600 0.720 25324 3946 1 6 . 1 1 67 67 GLY N N 67 105.361 105.361 105.780 -0.419 25324 3947 1 6 . 1 1 67 67 GLY C C 67 173.618 173.618 173.667 -0.049 25324 3948 1 6 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.381 -1.014 25324 3949 1 6 . 1 1 67 67 GLY H H 67 6.639 6.639 7.277 -0.638 25324 3950 1 6 . 1 1 68 68 ASN N N 68 121.848 121.848 117.878 3.970 25324 3951 1 6 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.257 0.074 25324 3952 1 6 . 1 1 68 68 ASN C C 68 174.316 174.316 175.434 -1.118 25324 3953 1 6 . 1 1 68 68 ASN CA C 68 54.552 54.552 53.977 0.574 25324 3954 1 6 . 1 1 68 68 ASN CB C 68 37.165 37.165 37.183 -0.018 25324 3955 1 6 . 1 1 68 68 ASN H H 68 9.236 9.236 8.866 0.370 25324 3956 1 6 . 1 1 69 69 ASN N N 69 109.509 109.509 108.870 0.639 25324 3957 1 6 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.378 -0.298 25324 3958 1 6 . 1 1 69 69 ASN C C 69 171.456 171.456 174.271 -2.815 25324 3959 1 6 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.636 1.114 25324 3960 1 6 . 1 1 69 69 ASN CB C 69 37.306 37.306 38.172 -0.866 25324 3961 1 6 . 1 1 69 69 ASN H H 69 8.651 8.651 8.673 -0.022 25324 3962 1 6 . 1 1 70 70 SER N N 70 113.479 113.479 115.283 -1.804 25324 3963 1 6 . 1 1 70 70 SER HA H 70 5.437 5.437 5.365 0.072 25324 3964 1 6 . 1 1 70 70 SER C C 70 173.750 173.750 173.535 0.215 25324 3965 1 6 . 1 1 70 70 SER CA C 70 57.139 57.139 58.537 -1.398 25324 3966 1 6 . 1 1 70 70 SER CB C 70 63.818 63.818 64.066 -0.248 25324 3967 1 6 . 1 1 70 70 SER H H 70 7.693 7.693 7.546 0.147 25324 3968 1 6 . 1 1 71 71 TYR N N 71 123.132 123.132 124.957 -1.825 25324 3969 1 6 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.070 0.073 25324 3970 1 6 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.693 -0.045 25324 3971 1 6 . 1 1 71 71 TYR CB C 71 42.445 42.445 41.706 0.739 25324 3972 1 6 . 1 1 71 71 TYR H H 71 9.326 9.326 9.553 -0.227 25324 3973 1 6 . 1 1 72 72 GLU N N 72 122.396 122.396 123.593 -1.197 25324 3974 1 6 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.831 -0.025 25324 3975 1 6 . 1 1 72 72 GLU C C 72 175.698 175.698 175.226 0.472 25324 3976 1 6 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.343 -0.176 25324 3977 1 6 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.332 -1.148 25324 3978 1 6 . 1 1 72 72 GLU H H 72 8.624 8.624 9.210 -0.586 25324 3979 1 6 . 1 1 73 73 VAL N N 73 128.513 128.513 127.965 0.548 25324 3980 1 6 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.275 -0.076 25324 3981 1 6 . 1 1 73 73 VAL C C 73 175.369 175.369 174.417 0.952 25324 3982 1 6 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.743 0.737 25324 3983 1 6 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.489 0.844 25324 3984 1 6 . 1 1 73 73 VAL H H 73 8.564 8.564 9.038 -0.474 25324 3985 1 6 . 1 1 74 74 GLU N N 74 124.842 124.842 125.891 -1.049 25324 3986 1 6 . 1 1 74 74 GLU HA H 74 5.087 5.087 4.997 0.090 25324 3987 1 6 . 1 1 74 74 GLU C C 74 174.415 174.415 174.934 -0.519 25324 3988 1 6 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.933 -0.596 25324 3989 1 6 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.796 1.361 25324 3990 1 6 . 1 1 74 74 GLU H H 74 9.011 9.011 8.976 0.035 25324 3991 1 6 . 1 1 75 75 ASN N N 75 116.136 116.136 121.390 -5.254 25324 3992 1 6 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.891 0.248 25324 3993 1 6 . 1 1 75 75 ASN C C 75 172.703 172.703 173.669 -0.966 25324 3994 1 6 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.843 -0.018 25324 3995 1 6 . 1 1 75 75 ASN CB C 75 45.896 45.896 43.203 2.693 25324 3996 1 6 . 1 1 75 75 ASN H H 75 9.424 9.424 9.393 0.031 25324 3997 1 6 . 1 1 76 76 GLN N N 76 120.762 120.762 120.565 0.197 25324 3998 1 6 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.341 -0.301 25324 3999 1 6 . 1 1 76 76 GLN C C 76 173.113 173.113 173.385 -0.272 25324 4000 1 6 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.398 -0.174 25324 4001 1 6 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.308 -0.960 25324 4002 1 6 . 1 1 76 76 GLN H H 76 7.106 7.106 8.834 -1.728 25324 4003 1 6 . 1 1 77 77 TRP N N 77 125.598 125.598 122.744 2.854 25324 4004 1 6 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.008 0.144 25324 4005 1 6 . 1 1 77 77 TRP C C 77 175.502 175.502 176.258 -0.756 25324 4006 1 6 . 1 1 77 77 TRP CA C 77 55.764 55.764 55.947 -0.183 25324 4007 1 6 . 1 1 77 77 TRP CB C 77 29.999 29.999 31.420 -1.421 25324 4008 1 6 . 1 1 77 77 TRP H H 77 8.181 8.181 7.686 0.495 25324 4009 1 6 . 1 1 78 78 GLY N N 78 107.901 107.901 109.195 -1.294 25324 4010 1 6 . 1 1 78 78 GLY C C 78 174.611 174.611 174.219 0.392 25324 4011 1 6 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.207 -0.305 25324 4012 1 6 . 1 1 78 78 GLY H H 78 8.778 8.778 9.252 -0.474 25324 4013 1 6 . 1 1 79 79 GLY N N 79 109.844 109.844 107.287 2.557 25324 4014 1 6 . 1 1 79 79 GLY C C 79 173.782 173.782 173.453 0.329 25324 4015 1 6 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.472 -0.679 25324 4016 1 6 . 1 1 79 79 GLY H H 79 8.198 8.198 7.439 0.759 25324 4017 1 6 . 1 1 80 80 ASP N N 80 115.837 115.837 116.113 -0.276 25324 4018 1 6 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.800 -0.559 25324 4019 1 6 . 1 1 80 80 ASP C C 80 177.285 177.285 176.476 0.809 25324 4020 1 6 . 1 1 80 80 ASP CA C 80 56.183 56.183 54.346 1.837 25324 4021 1 6 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.816 -0.293 25324 4022 1 6 . 1 1 80 80 ASP H H 80 8.132 8.132 8.554 -0.422 25324 4023 1 6 . 1 1 81 81 SER N N 81 112.690 112.690 114.947 -2.257 25324 4024 1 6 . 1 1 81 81 SER HA H 81 4.513 4.513 4.399 0.114 25324 4025 1 6 . 1 1 81 81 SER C C 81 173.684 173.684 174.226 -0.542 25324 4026 1 6 . 1 1 81 81 SER CA C 81 57.232 57.232 58.771 -1.539 25324 4027 1 6 . 1 1 81 81 SER CB C 81 63.170 63.170 63.089 0.081 25324 4028 1 6 . 1 1 81 81 SER H H 81 8.179 8.179 8.220 -0.041 25324 4029 1 6 . 1 1 82 82 ALA N N 82 126.310 126.310 125.287 1.023 25324 4030 1 6 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.483 -0.080 25324 4031 1 6 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.309 1.157 25324 4032 1 6 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.849 -0.651 25324 4033 1 6 . 1 1 82 82 ALA H H 82 7.274 7.274 7.155 0.119 25324 4034 1 6 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.194 0.179 25324 4035 1 6 . 1 1 83 83 PRO C C 83 175.378 175.378 176.349 -0.971 25324 4036 1 6 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.417 -0.090 25324 4037 1 6 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.251 -0.087 25324 4038 1 6 . 1 1 84 84 TRP N N 84 120.106 120.106 122.613 -2.507 25324 4039 1 6 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.348 -0.077 25324 4040 1 6 . 1 1 84 84 TRP C C 84 176.358 176.358 176.282 0.076 25324 4041 1 6 . 1 1 84 84 TRP CA C 84 56.946 56.946 58.028 -1.082 25324 4042 1 6 . 1 1 84 84 TRP CB C 84 29.716 29.716 29.361 0.355 25324 4043 1 6 . 1 1 84 84 TRP H H 84 8.329 8.329 8.062 0.267 25324 4044 1 6 . 1 1 85 85 HIS N N 85 118.543 118.543 121.447 -2.904 25324 4045 1 6 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.955 -0.037 25324 4046 1 6 . 1 1 85 85 HIS C C 85 174.950 174.950 175.301 -0.351 25324 4047 1 6 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.288 -1.819 25324 4048 1 6 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.423 -1.750 25324 4049 1 6 . 1 1 85 85 HIS H H 85 9.204 9.204 9.286 -0.082 25324 4050 1 6 . 1 1 86 86 SER N N 86 117.803 117.803 117.225 0.578 25324 4051 1 6 . 1 1 86 86 SER HA H 86 4.412 4.412 4.200 0.212 25324 4052 1 6 . 1 1 86 86 SER C C 86 175.691 175.691 174.637 1.054 25324 4053 1 6 . 1 1 86 86 SER CA C 86 60.257 60.257 60.209 0.048 25324 4054 1 6 . 1 1 86 86 SER CB C 86 63.015 63.015 63.778 -0.763 25324 4055 1 6 . 1 1 86 86 SER H H 86 9.168 9.168 9.056 0.112 25324 4056 1 6 . 1 1 87 87 GLY N N 87 115.773 115.773 109.009 6.764 25324 4057 1 6 . 1 1 87 87 GLY C C 87 174.288 174.288 173.413 0.875 25324 4058 1 6 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.176 -0.475 25324 4059 1 6 . 1 1 87 87 GLY H H 87 9.284 9.284 8.657 0.627 25324 4060 1 6 . 1 1 88 88 GLY N N 88 109.162 109.162 107.628 1.534 25324 4061 1 6 . 1 1 88 88 GLY C C 88 171.120 171.120 171.558 -0.438 25324 4062 1 6 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.121 -0.527 25324 4063 1 6 . 1 1 88 88 GLY H H 88 8.054 8.054 7.938 0.116 25324 4064 1 6 . 1 1 89 89 ASN N N 89 117.048 117.048 119.664 -2.616 25324 4065 1 6 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.875 0.163 25324 4066 1 6 . 1 1 89 89 ASN C C 89 175.287 175.287 174.882 0.405 25324 4067 1 6 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.016 -1.151 25324 4068 1 6 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.420 -0.815 25324 4069 1 6 . 1 1 89 89 ASN H H 89 8.516 8.516 8.738 -0.222 25324 4070 1 6 . 1 1 90 90 TRP N N 90 125.844 125.844 124.555 1.289 25324 4071 1 6 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.097 0.156 25324 4072 1 6 . 1 1 90 90 TRP C C 90 175.278 175.278 175.211 0.067 25324 4073 1 6 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.220 0.048 25324 4074 1 6 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.649 0.309 25324 4075 1 6 . 1 1 90 90 TRP H H 90 9.282 9.282 9.343 -0.061 25324 4076 1 6 . 1 1 91 91 ILE N N 91 123.134 123.134 121.381 1.753 25324 4077 1 6 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.082 0.364 25324 4078 1 6 . 1 1 91 91 ILE C C 91 175.489 175.489 175.417 0.072 25324 4079 1 6 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.823 0.003 25324 4080 1 6 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.705 0.971 25324 4081 1 6 . 1 1 91 91 ILE H H 91 9.318 9.318 8.610 0.708 25324 4082 1 6 . 1 1 92 92 LEU N N 92 123.452 123.452 129.015 -5.563 25324 4083 1 6 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.597 0.345 25324 4084 1 6 . 1 1 92 92 LEU C C 92 173.620 173.620 174.187 -0.567 25324 4085 1 6 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.510 -1.254 25324 4086 1 6 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.932 1.576 25324 4087 1 6 . 1 1 92 92 LEU H H 92 8.463 8.463 8.891 -0.428 25324 4088 1 6 . 1 1 93 93 GLY N N 93 103.987 103.987 107.526 -3.539 25324 4089 1 6 . 1 1 93 93 GLY C C 93 172.284 172.284 174.058 -1.774 25324 4090 1 6 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.455 -1.955 25324 4091 1 6 . 1 1 93 93 GLY H H 93 2.937 2.937 6.622 -3.685 25324 4092 1 6 . 1 1 94 94 SER N N 94 110.274 110.274 118.713 -8.439 25324 4093 1 6 . 1 1 94 94 SER HA H 94 4.711 4.711 4.842 -0.131 25324 4094 1 6 . 1 1 94 94 SER C C 94 174.784 174.784 175.336 -0.552 25324 4095 1 6 . 1 1 94 94 SER CA C 94 56.555 56.555 59.539 -2.984 25324 4096 1 6 . 1 1 94 94 SER CB C 94 65.051 65.051 64.869 0.182 25324 4097 1 6 . 1 1 94 94 SER H H 94 7.919 7.919 9.715 -1.796 25324 4098 1 6 . 1 1 95 95 ARG N N 95 123.020 123.020 121.898 1.122 25324 4099 1 6 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.524 0.148 25324 4100 1 6 . 1 1 95 95 ARG C C 95 176.120 176.120 176.419 -0.299 25324 4101 1 6 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.071 0.303 25324 4102 1 6 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.798 0.050 25324 4103 1 6 . 1 1 95 95 ARG H H 95 9.148 9.148 7.672 1.476 25324 4104 1 6 . 1 1 96 96 GLU N N 96 120.357 120.357 124.773 -4.416 25324 4105 1 6 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.078 0.204 25324 4106 1 6 . 1 1 96 96 GLU C C 96 176.278 176.278 176.392 -0.114 25324 4107 1 6 . 1 1 96 96 GLU CA C 96 56.530 56.530 59.024 -2.494 25324 4108 1 6 . 1 1 96 96 GLU CB C 96 30.153 30.153 30.140 0.013 25324 4109 1 6 . 1 1 96 96 GLU H H 96 8.610 8.610 8.921 -0.311 25324 4110 1 6 . 1 1 97 97 ASN N N 97 117.678 117.678 116.787 0.891 25324 4111 1 6 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.849 -0.237 25324 4112 1 6 . 1 1 97 97 ASN C C 97 173.949 173.949 174.334 -0.385 25324 4113 1 6 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.884 0.131 25324 4114 1 6 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.604 -0.438 25324 4115 1 6 . 1 1 97 97 ASN H H 97 8.533 8.533 8.241 0.292 25324 4116 1 6 . 1 1 98 98 GLN N N 98 118.592 118.592 118.844 -0.252 25324 4117 1 6 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.492 -0.132 25324 4118 1 6 . 1 1 98 98 GLN C C 98 173.116 173.116 172.908 0.208 25324 4119 1 6 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.852 -0.224 25324 4120 1 6 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.216 -0.347 25324 4121 1 6 . 1 1 98 98 GLN H H 98 7.663 7.663 7.405 0.258 25324 4122 1 6 . 1 1 99 99 ASN N N 99 122.855 122.855 122.479 0.376 25324 4123 1 6 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.227 -0.092 25324 4124 1 6 . 1 1 99 99 ASN C C 99 175.287 175.287 175.153 0.134 25324 4125 1 6 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.137 0.853 25324 4126 1 6 . 1 1 99 99 ASN CB C 99 40.491 40.491 41.224 -0.733 25324 4127 1 6 . 1 1 99 99 ASN H H 99 8.759 8.759 8.579 0.180 25324 4128 1 6 . 1 1 100 100 VAL N N 100 121.385 121.385 116.238 5.147 25324 4129 1 6 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.916 -0.168 25324 4130 1 6 . 1 1 100 100 VAL C C 100 174.956 174.956 175.263 -0.307 25324 4131 1 6 . 1 1 100 100 VAL CA C 100 63.843 63.843 61.666 2.177 25324 4132 1 6 . 1 1 100 100 VAL CB C 100 32.443 32.443 32.066 0.377 25324 4133 1 6 . 1 1 100 100 VAL H H 100 8.717 8.717 7.957 0.760 25324 4134 1 6 . 1 1 101 101 VAL N N 101 112.736 112.736 113.416 -0.680 25324 4135 1 6 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.482 0.163 25324 4136 1 6 . 1 1 101 101 VAL C C 101 175.577 175.577 174.809 0.768 25324 4137 1 6 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.521 -1.558 25324 4138 1 6 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.724 -0.683 25324 4139 1 6 . 1 1 101 101 VAL H H 101 8.802 8.802 8.795 0.007 25324 4140 1 6 . 1 1 102 102 ALA N N 102 122.104 122.104 121.824 0.280 25324 4141 1 6 . 1 1 102 102 ALA HA H 102 4.807 4.807 4.989 -0.182 25324 4142 1 6 . 1 1 102 102 ALA C C 102 176.046 176.046 174.906 1.140 25324 4143 1 6 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.782 2.472 25324 4144 1 6 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.217 -0.592 25324 4145 1 6 . 1 1 102 102 ALA H H 102 7.677 7.677 7.814 -0.137 25324 4146 1 6 . 1 1 103 103 ILE N N 103 118.218 118.218 122.588 -4.370 25324 4147 1 6 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.303 -0.276 25324 4148 1 6 . 1 1 103 103 ILE C C 103 173.118 173.118 173.994 -0.876 25324 4149 1 6 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.458 1.769 25324 4150 1 6 . 1 1 103 103 ILE CB C 103 42.471 42.471 40.953 1.518 25324 4151 1 6 . 1 1 103 103 ILE H H 103 8.102 8.102 8.570 -0.468 25324 4152 1 6 . 1 1 104 104 ASN N N 104 125.938 125.938 126.723 -0.785 25324 4153 1 6 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.326 0.360 25324 4154 1 6 . 1 1 104 104 ASN C C 104 174.870 174.870 173.654 1.216 25324 4155 1 6 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.571 -0.018 25324 4156 1 6 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.145 -1.293 25324 4157 1 6 . 1 1 104 104 ASN H H 104 8.668 8.668 8.743 -0.075 25324 4158 1 6 . 1 1 105 105 VAL N N 105 114.631 114.631 118.401 -3.770 25324 4159 1 6 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.156 0.049 25324 4160 1 6 . 1 1 105 105 VAL C C 105 174.788 174.788 173.301 1.487 25324 4161 1 6 . 1 1 105 105 VAL CA C 105 57.979 57.979 59.612 -1.633 25324 4162 1 6 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.997 0.043 25324 4163 1 6 . 1 1 105 105 VAL H H 105 8.933 8.933 9.050 -0.117 25324 4164 1 6 . 1 1 106 106 GLU N N 106 118.347 118.347 123.593 -5.246 25324 4165 1 6 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.204 -0.124 25324 4166 1 6 . 1 1 106 106 GLU C C 106 174.777 174.777 174.319 0.458 25324 4167 1 6 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.149 -0.182 25324 4168 1 6 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.431 -0.788 25324 4169 1 6 . 1 1 106 106 GLU H H 106 8.814 8.814 9.161 -0.347 25324 4170 1 6 . 1 1 107 107 SER N N 107 115.335 115.335 118.098 -2.763 25324 4171 1 6 . 1 1 107 107 SER HA H 107 5.266 5.266 4.974 0.292 25324 4172 1 6 . 1 1 107 107 SER C C 107 175.787 175.787 174.734 1.053 25324 4173 1 6 . 1 1 107 107 SER CA C 107 55.888 55.888 56.782 -0.894 25324 4174 1 6 . 1 1 107 107 SER CB C 107 65.921 65.921 65.225 0.696 25324 4175 1 6 . 1 1 107 107 SER H H 107 8.576 8.576 8.363 0.213 25324 4176 1 6 . 1 1 108 108 GLY N N 108 117.567 117.567 111.876 5.691 25324 4177 1 6 . 1 1 108 108 GLY C C 108 173.959 173.959 174.452 -0.493 25324 4178 1 6 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.013 -0.336 25324 4179 1 6 . 1 1 108 108 GLY H H 108 9.532 9.532 8.691 0.841 25324 4180 1 6 . 1 1 109 109 ASP N N 109 122.108 122.108 121.474 0.634 25324 4181 1 6 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.817 -0.016 25324 4182 1 6 . 1 1 109 109 ASP C C 109 176.203 176.203 175.425 0.778 25324 4183 1 6 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.588 -0.454 25324 4184 1 6 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.570 -3.228 25324 4185 1 6 . 1 1 109 109 ASP H H 109 8.605 8.605 7.791 0.814 25324 4186 1 6 . 1 1 110 110 ASP N N 110 116.197 116.197 117.857 -1.660 25324 4187 1 6 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.553 -0.331 25324 4188 1 6 . 1 1 110 110 ASP C C 110 175.951 175.951 176.412 -0.461 25324 4189 1 6 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.374 1.824 25324 4190 1 6 . 1 1 110 110 ASP CB C 110 38.630 38.630 39.941 -1.311 25324 4191 1 6 . 1 1 110 110 ASP H H 110 9.087 9.087 8.449 0.638 25324 4192 1 6 . 1 1 111 111 GLY N N 111 103.841 103.841 108.211 -4.370 25324 4193 1 6 . 1 1 111 111 GLY C C 111 173.924 173.924 175.361 -1.437 25324 4194 1 6 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.547 -0.384 25324 4195 1 6 . 1 1 111 111 GLY H H 111 8.930 8.930 8.429 0.501 25324 4196 1 6 . 1 1 112 112 GLN N N 112 121.626 121.626 119.306 2.320 25324 4197 1 6 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.037 0.033 25324 4198 1 6 . 1 1 112 112 GLN C C 112 176.431 176.431 175.405 1.026 25324 4199 1 6 . 1 1 112 112 GLN CA C 112 58.273 58.273 59.088 -0.815 25324 4200 1 6 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.175 -1.482 25324 4201 1 6 . 1 1 112 112 GLN H H 112 7.351 7.351 8.673 -1.322 25324 4202 1 6 . 1 1 113 113 THR N N 113 112.322 112.322 108.766 3.556 25324 4203 1 6 . 1 1 113 113 THR HA H 113 5.331 5.331 5.400 -0.069 25324 4204 1 6 . 1 1 113 113 THR C C 113 174.452 174.452 173.141 1.311 25324 4205 1 6 . 1 1 113 113 THR CA C 113 59.739 59.739 60.045 -0.307 25324 4206 1 6 . 1 1 113 113 THR CB C 113 71.773 71.773 71.222 0.550 25324 4207 1 6 . 1 1 113 113 THR H H 113 10.053 10.053 7.472 2.581 25324 4208 1 6 . 1 1 114 114 LEU N N 114 122.083 122.083 125.811 -3.728 25324 4209 1 6 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.684 -0.103 25324 4210 1 6 . 1 1 114 114 LEU C C 114 175.113 175.113 175.236 -0.123 25324 4211 1 6 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.995 -1.090 25324 4212 1 6 . 1 1 114 114 LEU CB C 114 47.033 47.033 43.679 3.354 25324 4213 1 6 . 1 1 114 114 LEU H H 114 8.978 8.978 9.080 -0.102 25324 4214 1 6 . 1 1 115 115 ASN N N 115 118.846 118.846 121.605 -2.759 25324 4215 1 6 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.643 0.127 25324 4216 1 6 . 1 1 115 115 ASN C C 115 174.788 174.788 175.094 -0.306 25324 4217 1 6 . 1 1 115 115 ASN CA C 115 52.342 52.342 52.387 -0.045 25324 4218 1 6 . 1 1 115 115 ASN CB C 115 43.414 43.414 41.448 1.966 25324 4219 1 6 . 1 1 115 115 ASN H H 115 8.837 8.837 8.160 0.677 25324 4220 1 6 . 1 1 116 116 GLY N N 116 109.661 109.661 110.314 -0.653 25324 4221 1 6 . 1 1 116 116 GLY C C 116 172.452 172.452 172.301 0.151 25324 4222 1 6 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.386 0.085 25324 4223 1 6 . 1 1 116 116 GLY H H 116 8.625 8.625 8.784 -0.159 25324 4224 1 6 . 1 1 117 117 THR N N 117 120.009 120.009 112.891 7.118 25324 4225 1 6 . 1 1 117 117 THR HA H 117 5.556 5.556 5.679 -0.123 25324 4226 1 6 . 1 1 117 117 THR C C 117 171.619 171.619 173.106 -1.487 25324 4227 1 6 . 1 1 117 117 THR CA C 117 59.373 59.373 60.123 -0.750 25324 4228 1 6 . 1 1 117 117 THR CB C 117 72.777 72.777 72.960 -0.183 25324 4229 1 6 . 1 1 117 117 THR H H 117 8.911 8.911 9.024 -0.113 25324 4230 1 6 . 1 1 118 118 MET N N 118 115.550 115.550 117.691 -2.141 25324 4231 1 6 . 1 1 118 118 MET HA H 118 4.889 4.889 5.374 -0.485 25324 4232 1 6 . 1 1 118 118 MET C C 118 172.707 172.707 174.137 -1.430 25324 4233 1 6 . 1 1 118 118 MET CA C 118 54.714 54.714 54.490 0.224 25324 4234 1 6 . 1 1 118 118 MET CB C 118 33.663 33.663 37.451 -3.788 25324 4235 1 6 . 1 1 118 118 MET H H 118 9.159 9.159 9.022 0.137 25324 4236 1 6 . 1 1 119 119 THR N N 119 113.716 113.716 116.510 -2.794 25324 4237 1 6 . 1 1 119 119 THR HA H 119 4.682 4.682 4.885 -0.203 25324 4238 1 6 . 1 1 119 119 THR C C 119 173.952 173.952 173.291 0.661 25324 4239 1 6 . 1 1 119 119 THR CA C 119 61.395 61.395 61.518 -0.123 25324 4240 1 6 . 1 1 119 119 THR CB C 119 71.746 71.746 71.604 0.142 25324 4241 1 6 . 1 1 119 119 THR H H 119 8.685 8.685 8.805 -0.120 25324 4242 1 6 . 1 1 120 120 TYR N N 120 129.153 129.153 125.115 4.038 25324 4243 1 6 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.765 0.035 25324 4244 1 6 . 1 1 120 120 TYR C C 120 175.214 175.214 177.443 -2.229 25324 4245 1 6 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.372 0.505 25324 4246 1 6 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.391 0.111 25324 4247 1 6 . 1 1 120 120 TYR H H 120 10.107 10.107 8.173 1.934 25324 4248 1 6 . 1 1 121 121 ALA N N 121 119.947 119.947 124.533 -4.586 25324 4249 1 6 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.155 -0.151 25324 4250 1 6 . 1 1 121 121 ALA C C 121 178.456 178.456 177.324 1.132 25324 4251 1 6 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.409 -0.453 25324 4252 1 6 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.921 -0.211 25324 4253 1 6 . 1 1 121 121 ALA H H 121 8.704 8.704 8.499 0.205 25324 4254 1 6 . 1 1 122 122 GLY N N 122 111.186 111.186 105.881 5.305 25324 4255 1 6 . 1 1 122 122 GLY C C 122 173.949 173.949 173.390 0.559 25324 4256 1 6 . 1 1 122 122 GLY CA C 122 45.002 45.002 44.480 0.522 25324 4257 1 6 . 1 1 122 122 GLY H H 122 8.792 8.792 8.346 0.446 25324 4258 1 6 . 1 1 123 123 GLU N N 123 120.099 120.099 120.817 -0.718 25324 4259 1 6 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.514 0.191 25324 4260 1 6 . 1 1 123 123 GLU C C 123 175.912 175.912 175.903 0.009 25324 4261 1 6 . 1 1 123 123 GLU CA C 123 54.414 54.414 55.508 -1.094 25324 4262 1 6 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.718 0.067 25324 4263 1 6 . 1 1 123 123 GLU H H 123 8.072 8.072 7.650 0.422 25324 4264 1 6 . 1 1 124 124 GLY N N 124 105.303 105.303 110.536 -5.233 25324 4265 1 6 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.877 -0.075 25324 4266 1 6 . 1 1 124 124 GLY H H 124 7.939 7.939 8.479 -0.540 25324 4267 1 6 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.949 -0.014 25324 4268 1 6 . 1 1 125 125 PRO C C 125 177.788 177.788 176.402 1.386 25324 4269 1 6 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.131 0.000 25324 4270 1 6 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.360 -0.501 25324 4271 1 6 . 1 1 126 126 ILE N N 126 117.387 117.387 117.509 -0.122 25324 4272 1 6 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.684 0.215 25324 4273 1 6 . 1 1 126 126 ILE C C 126 175.625 175.625 175.088 0.537 25324 4274 1 6 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.129 0.324 25324 4275 1 6 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.355 1.194 25324 4276 1 6 . 1 1 126 126 ILE H H 126 9.599 9.599 8.842 0.757 25324 4277 1 6 . 1 1 127 127 GLY N N 127 106.753 106.753 108.035 -1.282 25324 4278 1 6 . 1 1 127 127 GLY C C 127 173.627 173.627 172.638 0.989 25324 4279 1 6 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.580 1.703 25324 4280 1 6 . 1 1 127 127 GLY H H 127 8.840 8.840 8.436 0.404 25324 4281 1 6 . 1 1 128 128 PHE N N 128 124.826 124.826 126.514 -1.688 25324 4282 1 6 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.386 -0.442 25324 4283 1 6 . 1 1 128 128 PHE C C 128 173.087 173.087 173.406 -0.319 25324 4284 1 6 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.250 0.759 25324 4285 1 6 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.180 -0.020 25324 4286 1 6 . 1 1 128 128 PHE H H 128 8.924 8.924 9.283 -0.359 25324 4287 1 6 . 1 1 129 129 LYS N N 129 131.518 131.518 129.080 2.438 25324 4288 1 6 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.795 0.088 25324 4289 1 6 . 1 1 129 129 LYS C C 129 173.863 173.863 174.430 -0.567 25324 4290 1 6 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.144 1.591 25324 4291 1 6 . 1 1 129 129 LYS CB C 129 34.721 34.721 34.824 -0.103 25324 4292 1 6 . 1 1 129 129 LYS H H 129 8.201 8.201 8.607 -0.406 25324 4293 1 6 . 1 1 130 130 GLY N N 130 114.030 114.030 113.280 0.750 25324 4294 1 6 . 1 1 130 130 GLY C C 130 171.951 171.951 172.912 -0.961 25324 4295 1 6 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.861 -0.074 25324 4296 1 6 . 1 1 130 130 GLY H H 130 9.325 9.325 8.256 1.069 25324 4297 1 6 . 1 1 131 131 THR N N 131 120.583 120.583 122.618 -2.035 25324 4298 1 6 . 1 1 131 131 THR HA H 131 4.939 4.939 5.013 -0.074 25324 4299 1 6 . 1 1 131 131 THR C C 131 173.118 173.118 174.134 -1.016 25324 4300 1 6 . 1 1 131 131 THR CA C 131 61.266 61.266 61.149 0.117 25324 4301 1 6 . 1 1 131 131 THR CB C 131 70.392 70.392 72.108 -1.716 25324 4302 1 6 . 1 1 131 131 THR H H 131 8.916 8.916 8.869 0.047 25324 4303 1 6 . 1 1 132 132 LEU N N 132 130.774 130.774 128.258 2.516 25324 4304 1 6 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.600 -0.100 25324 4305 1 6 . 1 1 132 132 LEU C C 132 176.574 176.574 177.015 -0.441 25324 4306 1 6 . 1 1 132 132 LEU CA C 132 56.187 56.187 56.142 0.045 25324 4307 1 6 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.731 0.716 25324 4308 1 6 . 1 1 132 132 LEU H H 132 8.527 8.527 8.516 0.011 25324 4309 1 7 . 1 1 3 3 LEU N N 3 123.202 123.202 121.420 1.782 25324 4310 1 7 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.843 0.314 25324 4311 1 7 . 1 1 3 3 LEU C C 3 175.786 175.786 174.577 1.209 25324 4312 1 7 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.041 0.243 25324 4313 1 7 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.519 -0.189 25324 4314 1 7 . 1 1 3 3 LEU H H 3 8.711 8.711 8.111 0.600 25324 4315 1 7 . 1 1 4 4 TYR N N 4 120.906 120.906 123.905 -2.999 25324 4316 1 7 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.236 -0.212 25324 4317 1 7 . 1 1 4 4 TYR C C 4 175.953 175.953 175.189 0.764 25324 4318 1 7 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.194 0.183 25324 4319 1 7 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.622 -0.967 25324 4320 1 7 . 1 1 4 4 TYR H H 4 9.142 9.142 9.519 -0.377 25324 4321 1 7 . 1 1 5 5 ASN N N 5 120.496 120.496 119.659 0.837 25324 4322 1 7 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.997 0.119 25324 4323 1 7 . 1 1 5 5 ASN C C 5 174.953 174.953 173.703 1.250 25324 4324 1 7 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.187 -0.240 25324 4325 1 7 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.995 -2.104 25324 4326 1 7 . 1 1 5 5 ASN H H 5 8.787 8.787 8.905 -0.118 25324 4327 1 7 . 1 1 6 6 VAL N N 6 127.428 127.428 124.062 3.366 25324 4328 1 7 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.559 -0.197 25324 4329 1 7 . 1 1 6 6 VAL C C 6 174.955 174.955 174.602 0.353 25324 4330 1 7 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.356 1.077 25324 4331 1 7 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.995 0.336 25324 4332 1 7 . 1 1 6 6 VAL H H 6 8.806 8.806 8.545 0.261 25324 4333 1 7 . 1 1 7 7 GLU N N 7 124.355 124.355 126.253 -1.898 25324 4334 1 7 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.770 0.212 25324 4335 1 7 . 1 1 7 7 GLU C C 7 174.551 174.551 174.791 -0.240 25324 4336 1 7 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.659 -0.870 25324 4337 1 7 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.544 2.023 25324 4338 1 7 . 1 1 7 7 GLU H H 7 8.800 8.800 8.923 -0.123 25324 4339 1 7 . 1 1 8 8 ASN N N 8 116.231 116.231 121.926 -5.695 25324 4340 1 7 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.661 0.380 25324 4341 1 7 . 1 1 8 8 ASN C C 8 172.709 172.709 173.708 -0.999 25324 4342 1 7 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.341 -0.724 25324 4343 1 7 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.418 3.167 25324 4344 1 7 . 1 1 8 8 ASN H H 8 9.320 9.320 9.062 0.258 25324 4345 1 7 . 1 1 9 9 GLN N N 9 120.762 120.762 124.463 -3.701 25324 4346 1 7 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.500 -0.326 25324 4347 1 7 . 1 1 9 9 GLN C C 9 173.454 173.454 173.989 -0.535 25324 4348 1 7 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.207 -0.247 25324 4349 1 7 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.006 -0.315 25324 4350 1 7 . 1 1 9 9 GLN H H 9 6.887 6.887 8.468 -1.581 25324 4351 1 7 . 1 1 10 10 TRP N N 10 127.775 127.775 125.429 2.346 25324 4352 1 7 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.077 -0.089 25324 4353 1 7 . 1 1 10 10 TRP C C 10 175.281 175.281 175.295 -0.014 25324 4354 1 7 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.768 -0.475 25324 4355 1 7 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.789 -1.047 25324 4356 1 7 . 1 1 10 10 TRP H H 10 8.518 8.518 7.894 0.624 25324 4357 1 7 . 1 1 11 11 GLY N N 11 107.838 107.838 109.221 -1.383 25324 4358 1 7 . 1 1 11 11 GLY C C 11 174.733 174.733 175.040 -0.307 25324 4359 1 7 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.671 0.165 25324 4360 1 7 . 1 1 11 11 GLY H H 11 8.461 8.461 8.331 0.130 25324 4361 1 7 . 1 1 12 12 GLY N N 12 109.696 109.696 108.895 0.801 25324 4362 1 7 . 1 1 12 12 GLY C C 12 174.133 174.133 174.165 -0.032 25324 4363 1 7 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.431 -0.642 25324 4364 1 7 . 1 1 12 12 GLY H H 12 8.138 8.138 8.086 0.052 25324 4365 1 7 . 1 1 13 13 SER N N 13 111.308 111.308 117.286 -5.978 25324 4366 1 7 . 1 1 13 13 SER HA H 13 4.092 4.092 4.244 -0.152 25324 4367 1 7 . 1 1 13 13 SER C C 13 175.622 175.622 174.412 1.210 25324 4368 1 7 . 1 1 13 13 SER CA C 13 60.494 60.494 59.055 1.439 25324 4369 1 7 . 1 1 13 13 SER CB C 13 63.028 63.028 63.559 -0.531 25324 4370 1 7 . 1 1 13 13 SER H H 13 8.215 8.215 8.358 -0.143 25324 4371 1 7 . 1 1 14 14 SER N N 14 115.290 115.290 115.081 0.209 25324 4372 1 7 . 1 1 14 14 SER HA H 14 4.566 4.566 4.170 0.396 25324 4373 1 7 . 1 1 14 14 SER C C 14 173.532 173.532 173.257 0.275 25324 4374 1 7 . 1 1 14 14 SER CA C 14 57.317 57.317 59.002 -1.685 25324 4375 1 7 . 1 1 14 14 SER CB C 14 63.230 63.230 61.810 1.420 25324 4376 1 7 . 1 1 14 14 SER H H 14 8.213 8.213 8.547 -0.334 25324 4377 1 7 . 1 1 15 15 ALA N N 15 126.470 126.470 125.177 1.293 25324 4378 1 7 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.379 0.024 25324 4379 1 7 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.205 0.259 25324 4380 1 7 . 1 1 15 15 ALA CB C 15 18.229 18.229 19.188 -0.959 25324 4381 1 7 . 1 1 15 15 ALA H H 15 7.308 7.308 7.213 0.095 25324 4382 1 7 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.316 0.093 25324 4383 1 7 . 1 1 16 16 PRO C C 16 175.627 175.627 175.482 0.145 25324 4384 1 7 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.154 0.238 25324 4385 1 7 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.462 -0.325 25324 4386 1 7 . 1 1 17 17 TRP N N 17 120.228 120.228 119.493 0.735 25324 4387 1 7 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.498 -0.180 25324 4388 1 7 . 1 1 17 17 TRP C C 17 175.951 175.951 175.917 0.034 25324 4389 1 7 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.627 0.288 25324 4390 1 7 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.742 -1.333 25324 4391 1 7 . 1 1 17 17 TRP H H 17 8.380 8.380 8.184 0.196 25324 4392 1 7 . 1 1 18 18 ASN N N 18 120.663 120.663 122.975 -2.312 25324 4393 1 7 . 1 1 18 18 ASN HA H 18 5.086 5.086 4.982 0.104 25324 4394 1 7 . 1 1 18 18 ASN C C 18 174.793 174.793 174.380 0.413 25324 4395 1 7 . 1 1 18 18 ASN CA C 18 51.601 51.601 51.880 -0.279 25324 4396 1 7 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.297 2.351 25324 4397 1 7 . 1 1 18 18 ASN H H 18 9.094 9.094 8.722 0.372 25324 4398 1 7 . 1 1 19 19 GLU N N 19 122.202 122.202 124.562 -2.360 25324 4399 1 7 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.734 -0.595 25324 4400 1 7 . 1 1 19 19 GLU C C 19 176.869 176.869 176.813 0.056 25324 4401 1 7 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.570 2.030 25324 4402 1 7 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.726 -0.344 25324 4403 1 7 . 1 1 19 19 GLU H H 19 9.013 9.013 8.934 0.079 25324 4404 1 7 . 1 1 20 20 GLY N N 20 112.893 112.893 111.554 1.339 25324 4405 1 7 . 1 1 20 20 GLY C C 20 174.878 174.878 172.992 1.886 25324 4406 1 7 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.966 0.029 25324 4407 1 7 . 1 1 20 20 GLY H H 20 8.926 8.926 8.407 0.519 25324 4408 1 7 . 1 1 21 21 GLY N N 21 110.354 110.354 107.244 3.110 25324 4409 1 7 . 1 1 21 21 GLY C C 21 171.623 171.623 171.848 -0.225 25324 4410 1 7 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.463 -1.065 25324 4411 1 7 . 1 1 21 21 GLY H H 21 8.258 8.258 7.577 0.681 25324 4412 1 7 . 1 1 22 22 GLN N N 22 117.541 117.541 117.932 -0.391 25324 4413 1 7 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.105 0.572 25324 4414 1 7 . 1 1 22 22 GLN C C 22 175.957 175.957 174.510 1.447 25324 4415 1 7 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.731 0.213 25324 4416 1 7 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.134 -1.049 25324 4417 1 7 . 1 1 22 22 GLN H H 22 8.564 8.564 8.620 -0.056 25324 4418 1 7 . 1 1 23 23 TRP N N 23 127.208 127.208 123.385 3.823 25324 4419 1 7 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.087 0.112 25324 4420 1 7 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.329 0.202 25324 4421 1 7 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.361 -0.678 25324 4422 1 7 . 1 1 23 23 TRP H H 23 9.347 9.347 8.950 0.397 25324 4423 1 7 . 1 1 24 24 GLU N N 24 123.504 123.504 121.869 1.635 25324 4424 1 7 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.354 0.154 25324 4425 1 7 . 1 1 24 24 GLU C C 24 174.222 174.222 175.342 -1.120 25324 4426 1 7 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.214 0.377 25324 4427 1 7 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.443 -1.828 25324 4428 1 7 . 1 1 24 24 GLU H H 24 9.296 9.296 8.545 0.751 25324 4429 1 7 . 1 1 25 25 ILE N N 25 123.447 123.447 126.987 -3.540 25324 4430 1 7 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.367 0.069 25324 4431 1 7 . 1 1 25 25 ILE C C 25 175.790 175.790 174.348 1.442 25324 4432 1 7 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.969 -0.342 25324 4433 1 7 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.582 0.370 25324 4434 1 7 . 1 1 25 25 ILE H H 25 8.635 8.635 8.588 0.047 25324 4435 1 7 . 1 1 26 26 GLY N N 26 111.544 111.544 112.607 -1.063 25324 4436 1 7 . 1 1 26 26 GLY C C 26 172.122 172.122 173.237 -1.115 25324 4437 1 7 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.534 -0.456 25324 4438 1 7 . 1 1 26 26 GLY H H 26 3.381 3.381 6.423 -3.042 25324 4439 1 7 . 1 1 27 27 SER N N 27 112.279 112.279 116.176 -3.897 25324 4440 1 7 . 1 1 27 27 SER HA H 27 4.876 4.876 4.763 0.113 25324 4441 1 7 . 1 1 27 27 SER C C 27 174.113 174.113 174.713 -0.600 25324 4442 1 7 . 1 1 27 27 SER CA C 27 56.954 56.954 59.123 -2.169 25324 4443 1 7 . 1 1 27 27 SER CB C 27 64.554 64.554 65.919 -1.365 25324 4444 1 7 . 1 1 27 27 SER H H 27 8.212 8.212 8.836 -0.624 25324 4445 1 7 . 1 1 28 28 ARG N N 28 120.872 120.872 124.495 -3.623 25324 4446 1 7 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.403 0.360 25324 4447 1 7 . 1 1 28 28 ARG C C 28 176.119 176.119 176.149 -0.030 25324 4448 1 7 . 1 1 28 28 ARG CA C 28 55.117 55.117 56.244 -1.127 25324 4449 1 7 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.966 0.864 25324 4450 1 7 . 1 1 28 28 ARG H H 28 7.849 7.849 8.644 -0.795 25324 4451 1 7 . 1 1 29 29 SER N N 29 118.985 118.985 117.103 1.882 25324 4452 1 7 . 1 1 29 29 SER HA H 29 4.192 4.192 4.488 -0.296 25324 4453 1 7 . 1 1 29 29 SER C C 29 174.622 174.622 174.675 -0.053 25324 4454 1 7 . 1 1 29 29 SER CA C 29 60.072 60.072 59.641 0.431 25324 4455 1 7 . 1 1 29 29 SER CB C 29 62.876 62.876 63.442 -0.566 25324 4456 1 7 . 1 1 29 29 SER H H 29 8.892 8.892 8.677 0.215 25324 4457 1 7 . 1 1 30 30 ASP N N 30 117.632 117.632 120.086 -2.454 25324 4458 1 7 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.731 -0.113 25324 4459 1 7 . 1 1 30 30 ASP C C 30 175.101 175.101 175.219 -0.118 25324 4460 1 7 . 1 1 30 30 ASP CA C 30 53.052 53.052 54.605 -1.554 25324 4461 1 7 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.100 -0.577 25324 4462 1 7 . 1 1 30 30 ASP H H 30 8.441 8.441 8.143 0.298 25324 4463 1 7 . 1 1 31 31 GLN N N 31 118.273 118.273 118.817 -0.544 25324 4464 1 7 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.577 -0.092 25324 4465 1 7 . 1 1 31 31 GLN C C 31 173.453 173.453 174.116 -0.663 25324 4466 1 7 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.264 -0.396 25324 4467 1 7 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.306 2.943 25324 4468 1 7 . 1 1 31 31 GLN H H 31 7.029 7.029 7.599 -0.570 25324 4469 1 7 . 1 1 32 32 ASN N N 32 120.865 120.865 121.149 -0.284 25324 4470 1 7 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.950 0.170 25324 4471 1 7 . 1 1 32 32 ASN C C 32 175.198 175.198 174.627 0.571 25324 4472 1 7 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.752 -0.883 25324 4473 1 7 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.524 -0.894 25324 4474 1 7 . 1 1 32 32 ASN H H 32 8.713 8.713 8.554 0.159 25324 4475 1 7 . 1 1 33 33 VAL N N 33 122.111 122.111 120.706 1.405 25324 4476 1 7 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.033 -0.328 25324 4477 1 7 . 1 1 33 33 VAL C C 33 174.950 174.950 175.449 -0.499 25324 4478 1 7 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.892 0.955 25324 4479 1 7 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.673 -0.324 25324 4480 1 7 . 1 1 33 33 VAL H H 33 8.542 8.542 8.771 -0.229 25324 4481 1 7 . 1 1 34 34 VAL N N 34 113.282 113.282 119.109 -5.827 25324 4482 1 7 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.463 0.182 25324 4483 1 7 . 1 1 34 34 VAL C C 34 175.574 175.574 174.400 1.174 25324 4484 1 7 . 1 1 34 34 VAL CA C 34 59.974 59.974 60.957 -0.983 25324 4485 1 7 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.348 -0.319 25324 4486 1 7 . 1 1 34 34 VAL H H 34 8.744 8.744 8.628 0.116 25324 4487 1 7 . 1 1 35 35 ALA N N 35 122.102 122.102 120.986 1.116 25324 4488 1 7 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.124 -0.321 25324 4489 1 7 . 1 1 35 35 ALA C C 35 175.947 175.947 174.925 1.022 25324 4490 1 7 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.013 2.237 25324 4491 1 7 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.290 -0.662 25324 4492 1 7 . 1 1 35 35 ALA H H 35 7.677 7.677 7.760 -0.083 25324 4493 1 7 . 1 1 36 36 ILE N N 36 118.005 118.005 121.677 -3.672 25324 4494 1 7 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.331 -0.303 25324 4495 1 7 . 1 1 36 36 ILE C C 36 173.116 173.116 173.788 -0.672 25324 4496 1 7 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.082 1.100 25324 4497 1 7 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.835 0.650 25324 4498 1 7 . 1 1 36 36 ILE H H 36 8.126 8.126 8.636 -0.510 25324 4499 1 7 . 1 1 37 37 ASN N N 37 125.632 125.632 125.993 -0.361 25324 4500 1 7 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.825 -0.144 25324 4501 1 7 . 1 1 37 37 ASN C C 37 174.854 174.854 173.380 1.474 25324 4502 1 7 . 1 1 37 37 ASN CA C 37 52.530 52.530 51.996 0.534 25324 4503 1 7 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.646 -2.793 25324 4504 1 7 . 1 1 37 37 ASN H H 37 8.577 8.577 8.760 -0.183 25324 4505 1 7 . 1 1 38 38 VAL N N 38 114.223 114.223 119.695 -5.472 25324 4506 1 7 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.969 0.234 25324 4507 1 7 . 1 1 38 38 VAL C C 38 174.854 174.854 173.247 1.607 25324 4508 1 7 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.995 -2.015 25324 4509 1 7 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.235 0.809 25324 4510 1 7 . 1 1 38 38 VAL H H 38 8.874 8.874 8.726 0.148 25324 4511 1 7 . 1 1 39 39 GLU N N 39 118.277 118.277 122.882 -4.605 25324 4512 1 7 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.145 -0.063 25324 4513 1 7 . 1 1 39 39 GLU C C 39 174.548 174.548 175.610 -1.062 25324 4514 1 7 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.855 1.137 25324 4515 1 7 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.247 -0.669 25324 4516 1 7 . 1 1 39 39 GLU H H 39 8.761 8.761 9.330 -0.569 25324 4517 1 7 . 1 1 40 40 SER N N 40 114.960 114.960 120.789 -5.829 25324 4518 1 7 . 1 1 40 40 SER HA H 40 5.265 5.265 4.991 0.274 25324 4519 1 7 . 1 1 40 40 SER C C 40 175.783 175.783 175.116 0.667 25324 4520 1 7 . 1 1 40 40 SER CA C 40 55.880 55.880 57.848 -1.968 25324 4521 1 7 . 1 1 40 40 SER CB C 40 65.911 65.911 63.600 2.311 25324 4522 1 7 . 1 1 40 40 SER H H 40 8.500 8.500 8.536 -0.036 25324 4523 1 7 . 1 1 41 41 GLY N N 41 117.567 117.567 111.565 6.002 25324 4524 1 7 . 1 1 41 41 GLY C C 41 174.119 174.119 174.697 -0.578 25324 4525 1 7 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.333 -0.645 25324 4526 1 7 . 1 1 41 41 GLY H H 41 9.533 9.533 8.590 0.943 25324 4527 1 7 . 1 1 42 42 ASP N N 42 122.141 122.141 121.104 1.037 25324 4528 1 7 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.789 0.011 25324 4529 1 7 . 1 1 42 42 ASP C C 42 176.121 176.121 176.348 -0.227 25324 4530 1 7 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.447 -1.301 25324 4531 1 7 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.413 -3.058 25324 4532 1 7 . 1 1 42 42 ASP H H 42 8.644 8.644 8.157 0.487 25324 4533 1 7 . 1 1 43 43 ASP N N 43 116.025 116.025 120.988 -4.963 25324 4534 1 7 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.438 -0.208 25324 4535 1 7 . 1 1 43 43 ASP C C 43 176.018 176.018 176.664 -0.646 25324 4536 1 7 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.234 0.015 25324 4537 1 7 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.825 -0.266 25324 4538 1 7 . 1 1 43 43 ASP H H 43 9.111 9.111 8.709 0.402 25324 4539 1 7 . 1 1 44 44 GLY N N 44 104.263 104.263 109.508 -5.245 25324 4540 1 7 . 1 1 44 44 GLY C C 44 173.922 173.922 174.965 -1.043 25324 4541 1 7 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.610 -0.309 25324 4542 1 7 . 1 1 44 44 GLY H H 44 9.063 9.063 8.441 0.622 25324 4543 1 7 . 1 1 45 45 GLN N N 45 121.691 121.691 118.385 3.306 25324 4544 1 7 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.482 -0.396 25324 4545 1 7 . 1 1 45 45 GLN C C 45 176.284 176.284 174.836 1.448 25324 4546 1 7 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.524 0.594 25324 4547 1 7 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.426 -1.752 25324 4548 1 7 . 1 1 45 45 GLN H H 45 7.356 7.356 8.602 -1.246 25324 4549 1 7 . 1 1 46 46 THR N N 46 111.843 111.843 109.875 1.968 25324 4550 1 7 . 1 1 46 46 THR HA H 46 5.355 5.355 5.570 -0.215 25324 4551 1 7 . 1 1 46 46 THR C C 46 174.451 174.451 173.442 1.009 25324 4552 1 7 . 1 1 46 46 THR CA C 46 59.644 59.644 59.935 -0.291 25324 4553 1 7 . 1 1 46 46 THR CB C 46 72.714 72.714 71.707 1.007 25324 4554 1 7 . 1 1 46 46 THR H H 46 10.123 10.123 7.627 2.496 25324 4555 1 7 . 1 1 47 47 LEU N N 47 119.302 119.302 123.379 -4.077 25324 4556 1 7 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.839 -0.032 25324 4557 1 7 . 1 1 47 47 LEU C C 47 175.487 175.487 174.804 0.683 25324 4558 1 7 . 1 1 47 47 LEU CA C 47 53.070 53.070 54.012 -0.942 25324 4559 1 7 . 1 1 47 47 LEU CB C 47 48.003 48.003 45.036 2.967 25324 4560 1 7 . 1 1 47 47 LEU H H 47 8.364 8.364 8.983 -0.619 25324 4561 1 7 . 1 1 48 48 ASN N N 48 116.844 116.844 120.412 -3.568 25324 4562 1 7 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.016 -0.287 25324 4563 1 7 . 1 1 48 48 ASN C C 48 174.460 174.460 174.792 -0.332 25324 4564 1 7 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.794 0.945 25324 4565 1 7 . 1 1 48 48 ASN CB C 48 43.413 43.413 43.009 0.404 25324 4566 1 7 . 1 1 48 48 ASN H H 48 8.748 8.748 8.960 -0.212 25324 4567 1 7 . 1 1 49 49 GLY N N 49 109.417 109.417 109.254 0.163 25324 4568 1 7 . 1 1 49 49 GLY C C 49 172.126 172.126 172.127 -0.001 25324 4569 1 7 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.258 0.233 25324 4570 1 7 . 1 1 49 49 GLY H H 49 8.744 8.744 8.940 -0.196 25324 4571 1 7 . 1 1 50 50 THR N N 50 119.162 119.162 117.391 1.771 25324 4572 1 7 . 1 1 50 50 THR HA H 50 5.556 5.556 5.319 0.237 25324 4573 1 7 . 1 1 50 50 THR C C 50 171.790 171.790 172.810 -1.020 25324 4574 1 7 . 1 1 50 50 THR CA C 50 59.371 59.371 62.146 -2.775 25324 4575 1 7 . 1 1 50 50 THR CB C 50 72.799 72.799 71.788 1.011 25324 4576 1 7 . 1 1 50 50 THR H H 50 8.799 8.799 8.926 -0.127 25324 4577 1 7 . 1 1 51 51 MET N N 51 115.232 115.232 127.050 -11.818 25324 4578 1 7 . 1 1 51 51 MET HA H 51 4.886 4.886 4.855 0.031 25324 4579 1 7 . 1 1 51 51 MET C C 51 172.708 172.708 174.007 -1.299 25324 4580 1 7 . 1 1 51 51 MET CA C 51 54.722 54.722 54.207 0.515 25324 4581 1 7 . 1 1 51 51 MET CB C 51 34.557 34.557 36.443 -1.886 25324 4582 1 7 . 1 1 51 51 MET H H 51 9.062 9.062 9.273 -0.211 25324 4583 1 7 . 1 1 52 52 THR N N 52 113.697 113.697 122.697 -9.000 25324 4584 1 7 . 1 1 52 52 THR HA H 52 4.682 4.682 4.756 -0.074 25324 4585 1 7 . 1 1 52 52 THR C C 52 173.952 173.952 173.398 0.554 25324 4586 1 7 . 1 1 52 52 THR CA C 52 61.395 61.395 61.328 0.067 25324 4587 1 7 . 1 1 52 52 THR CB C 52 71.734 71.734 70.720 1.014 25324 4588 1 7 . 1 1 52 52 THR H H 52 8.685 8.685 8.784 -0.099 25324 4589 1 7 . 1 1 53 53 TYR N N 53 129.086 129.086 126.066 3.020 25324 4590 1 7 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.690 0.110 25324 4591 1 7 . 1 1 53 53 TYR C C 53 175.214 175.214 176.384 -1.170 25324 4592 1 7 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.466 0.415 25324 4593 1 7 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.718 0.794 25324 4594 1 7 . 1 1 53 53 TYR H H 53 10.112 10.112 8.719 1.393 25324 4595 1 7 . 1 1 54 54 ALA N N 54 119.947 119.947 123.960 -4.013 25324 4596 1 7 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.307 -0.305 25324 4597 1 7 . 1 1 54 54 ALA C C 54 178.285 178.285 177.632 0.653 25324 4598 1 7 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.072 0.899 25324 4599 1 7 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.788 0.929 25324 4600 1 7 . 1 1 54 54 ALA H H 54 8.704 8.704 8.656 0.048 25324 4601 1 7 . 1 1 55 55 GLY N N 55 110.940 110.940 111.904 -0.964 25324 4602 1 7 . 1 1 55 55 GLY C C 55 173.903 173.903 174.338 -0.435 25324 4603 1 7 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.258 -0.242 25324 4604 1 7 . 1 1 55 55 GLY H H 55 8.745 8.745 8.409 0.336 25324 4605 1 7 . 1 1 56 56 GLU N N 56 120.073 120.073 120.293 -0.220 25324 4606 1 7 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.688 0.021 25324 4607 1 7 . 1 1 56 56 GLU C C 56 175.906 175.906 176.442 -0.536 25324 4608 1 7 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.142 -0.719 25324 4609 1 7 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.185 0.639 25324 4610 1 7 . 1 1 56 56 GLU H H 56 8.039 8.039 7.746 0.293 25324 4611 1 7 . 1 1 57 57 GLY N N 57 105.298 105.298 108.962 -3.664 25324 4612 1 7 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.944 -0.142 25324 4613 1 7 . 1 1 57 57 GLY H H 57 7.937 7.937 8.422 -0.485 25324 4614 1 7 . 1 1 58 58 PRO HA H 58 4.934 4.934 5.017 -0.083 25324 4615 1 7 . 1 1 58 58 PRO C C 58 177.785 177.785 176.460 1.325 25324 4616 1 7 . 1 1 58 58 PRO CA C 58 63.132 63.132 62.743 0.389 25324 4617 1 7 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.819 -0.979 25324 4618 1 7 . 1 1 59 59 ILE N N 59 117.386 117.386 116.123 1.263 25324 4619 1 7 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.722 0.266 25324 4620 1 7 . 1 1 59 59 ILE C C 59 175.688 175.688 175.002 0.686 25324 4621 1 7 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.168 0.375 25324 4622 1 7 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.335 0.953 25324 4623 1 7 . 1 1 59 59 ILE H H 59 9.600 9.600 8.972 0.628 25324 4624 1 7 . 1 1 60 60 GLY N N 60 107.164 107.164 107.919 -0.755 25324 4625 1 7 . 1 1 60 60 GLY C C 60 173.787 173.787 172.477 1.310 25324 4626 1 7 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.316 1.919 25324 4627 1 7 . 1 1 60 60 GLY H H 60 8.957 8.957 8.337 0.620 25324 4628 1 7 . 1 1 61 61 PHE N N 61 124.597 124.597 126.574 -1.977 25324 4629 1 7 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.782 -0.559 25324 4630 1 7 . 1 1 61 61 PHE C C 61 173.126 173.126 173.641 -0.515 25324 4631 1 7 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.033 0.828 25324 4632 1 7 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.175 0.042 25324 4633 1 7 . 1 1 61 61 PHE H H 61 8.788 8.788 9.124 -0.336 25324 4634 1 7 . 1 1 62 62 ARG N N 62 129.706 129.706 128.026 1.680 25324 4635 1 7 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.200 -0.068 25324 4636 1 7 . 1 1 62 62 ARG C C 62 172.456 172.456 173.094 -0.638 25324 4637 1 7 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.831 1.123 25324 4638 1 7 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.113 -1.243 25324 4639 1 7 . 1 1 62 62 ARG H H 62 8.405 8.405 8.638 -0.233 25324 4640 1 7 . 1 1 63 63 ALA N N 63 122.744 122.744 129.559 -6.815 25324 4641 1 7 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.227 0.118 25324 4642 1 7 . 1 1 63 63 ALA C C 63 176.120 176.120 175.558 0.562 25324 4643 1 7 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.107 -0.188 25324 4644 1 7 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.898 1.875 25324 4645 1 7 . 1 1 63 63 ALA H H 63 8.628 8.628 8.975 -0.347 25324 4646 1 7 . 1 1 64 64 THR N N 64 116.855 116.855 119.034 -2.179 25324 4647 1 7 . 1 1 64 64 THR HA H 64 4.848 4.848 5.059 -0.211 25324 4648 1 7 . 1 1 64 64 THR C C 64 172.957 172.957 173.462 -0.505 25324 4649 1 7 . 1 1 64 64 THR CA C 64 61.211 61.211 61.261 -0.050 25324 4650 1 7 . 1 1 64 64 THR CB C 64 71.064 71.064 71.335 -0.271 25324 4651 1 7 . 1 1 64 64 THR H H 64 8.315 8.315 8.807 -0.492 25324 4652 1 7 . 1 1 65 65 LEU N N 65 129.360 129.360 129.622 -0.262 25324 4653 1 7 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.930 -0.568 25324 4654 1 7 . 1 1 65 65 LEU C C 65 176.459 176.459 175.979 0.480 25324 4655 1 7 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.464 1.223 25324 4656 1 7 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.542 0.169 25324 4657 1 7 . 1 1 65 65 LEU H H 65 8.877 8.877 9.097 -0.220 25324 4658 1 7 . 1 1 66 66 LEU N N 66 128.683 128.683 126.879 1.804 25324 4659 1 7 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.496 -0.120 25324 4660 1 7 . 1 1 66 66 LEU C C 66 177.621 177.621 176.597 1.024 25324 4661 1 7 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.072 -0.372 25324 4662 1 7 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.752 -0.450 25324 4663 1 7 . 1 1 66 66 LEU H H 66 9.320 9.320 9.003 0.317 25324 4664 1 7 . 1 1 67 67 GLY N N 67 105.361 105.361 105.147 0.214 25324 4665 1 7 . 1 1 67 67 GLY C C 67 173.618 173.618 173.276 0.342 25324 4666 1 7 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.257 -0.890 25324 4667 1 7 . 1 1 67 67 GLY H H 67 6.639 6.639 7.379 -0.740 25324 4668 1 7 . 1 1 68 68 ASN N N 68 121.848 121.848 118.269 3.579 25324 4669 1 7 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.310 0.021 25324 4670 1 7 . 1 1 68 68 ASN C C 68 174.316 174.316 174.810 -0.494 25324 4671 1 7 . 1 1 68 68 ASN CA C 68 54.552 54.552 54.116 0.436 25324 4672 1 7 . 1 1 68 68 ASN CB C 68 37.165 37.165 37.102 0.063 25324 4673 1 7 . 1 1 68 68 ASN H H 68 9.236 9.236 8.829 0.407 25324 4674 1 7 . 1 1 69 69 ASN N N 69 109.509 109.509 108.638 0.871 25324 4675 1 7 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.288 -0.208 25324 4676 1 7 . 1 1 69 69 ASN C C 69 171.456 171.456 174.183 -2.727 25324 4677 1 7 . 1 1 69 69 ASN CA C 69 55.750 55.750 55.045 0.704 25324 4678 1 7 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.445 -0.139 25324 4679 1 7 . 1 1 69 69 ASN H H 69 8.651 8.651 8.677 -0.026 25324 4680 1 7 . 1 1 70 70 SER N N 70 113.479 113.479 115.651 -2.172 25324 4681 1 7 . 1 1 70 70 SER HA H 70 5.437 5.437 4.967 0.470 25324 4682 1 7 . 1 1 70 70 SER C C 70 173.750 173.750 173.226 0.524 25324 4683 1 7 . 1 1 70 70 SER CA C 70 57.139 57.139 59.349 -2.210 25324 4684 1 7 . 1 1 70 70 SER CB C 70 63.818 63.818 64.078 -0.260 25324 4685 1 7 . 1 1 70 70 SER H H 70 7.693 7.693 7.597 0.096 25324 4686 1 7 . 1 1 71 71 TYR N N 71 123.132 123.132 125.359 -2.227 25324 4687 1 7 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.167 -0.024 25324 4688 1 7 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.763 -0.115 25324 4689 1 7 . 1 1 71 71 TYR CB C 71 42.445 42.445 40.859 1.586 25324 4690 1 7 . 1 1 71 71 TYR H H 71 9.326 9.326 9.553 -0.227 25324 4691 1 7 . 1 1 72 72 GLU N N 72 122.396 122.396 123.525 -1.129 25324 4692 1 7 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.609 0.197 25324 4693 1 7 . 1 1 72 72 GLU C C 72 175.698 175.698 175.333 0.365 25324 4694 1 7 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.423 -0.256 25324 4695 1 7 . 1 1 72 72 GLU CB C 72 30.184 30.184 30.526 -0.342 25324 4696 1 7 . 1 1 72 72 GLU H H 72 8.624 8.624 9.183 -0.559 25324 4697 1 7 . 1 1 73 73 VAL N N 73 128.513 128.513 128.582 -0.069 25324 4698 1 7 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.564 -0.365 25324 4699 1 7 . 1 1 73 73 VAL C C 73 175.369 175.369 174.813 0.556 25324 4700 1 7 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.989 0.491 25324 4701 1 7 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.444 -0.111 25324 4702 1 7 . 1 1 73 73 VAL H H 73 8.564 8.564 9.176 -0.612 25324 4703 1 7 . 1 1 74 74 GLU N N 74 124.842 124.842 126.742 -1.900 25324 4704 1 7 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.258 -0.171 25324 4705 1 7 . 1 1 74 74 GLU C C 74 174.415 174.415 174.999 -0.584 25324 4706 1 7 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.763 -0.426 25324 4707 1 7 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.484 1.673 25324 4708 1 7 . 1 1 74 74 GLU H H 74 9.011 9.011 8.951 0.060 25324 4709 1 7 . 1 1 75 75 ASN N N 75 116.136 116.136 119.797 -3.661 25324 4710 1 7 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.926 0.213 25324 4711 1 7 . 1 1 75 75 ASN C C 75 172.703 172.703 173.406 -0.703 25324 4712 1 7 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.818 0.007 25324 4713 1 7 . 1 1 75 75 ASN CB C 75 45.896 45.896 43.896 2.000 25324 4714 1 7 . 1 1 75 75 ASN H H 75 9.424 9.424 9.299 0.125 25324 4715 1 7 . 1 1 76 76 GLN N N 76 120.762 120.762 118.180 2.582 25324 4716 1 7 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.285 -0.245 25324 4717 1 7 . 1 1 76 76 GLN C C 76 173.113 173.113 173.837 -0.724 25324 4718 1 7 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.129 0.094 25324 4719 1 7 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.894 -0.546 25324 4720 1 7 . 1 1 76 76 GLN H H 76 7.106 7.106 8.513 -1.407 25324 4721 1 7 . 1 1 77 77 TRP N N 77 125.598 125.598 122.834 2.764 25324 4722 1 7 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.163 -0.011 25324 4723 1 7 . 1 1 77 77 TRP C C 77 175.502 175.502 175.865 -0.363 25324 4724 1 7 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.447 -0.683 25324 4725 1 7 . 1 1 77 77 TRP CB C 77 29.999 29.999 31.337 -1.339 25324 4726 1 7 . 1 1 77 77 TRP H H 77 8.181 8.181 7.903 0.278 25324 4727 1 7 . 1 1 78 78 GLY N N 78 107.901 107.901 108.494 -0.593 25324 4728 1 7 . 1 1 78 78 GLY C C 78 174.611 174.611 174.119 0.492 25324 4729 1 7 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.678 0.224 25324 4730 1 7 . 1 1 78 78 GLY H H 78 8.778 8.778 8.827 -0.049 25324 4731 1 7 . 1 1 79 79 GLY N N 79 109.844 109.844 107.690 2.154 25324 4732 1 7 . 1 1 79 79 GLY C C 79 173.782 173.782 173.478 0.304 25324 4733 1 7 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.555 -0.762 25324 4734 1 7 . 1 1 79 79 GLY H H 79 8.198 8.198 7.389 0.809 25324 4735 1 7 . 1 1 80 80 ASP N N 80 115.837 115.837 118.619 -2.782 25324 4736 1 7 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.671 -0.430 25324 4737 1 7 . 1 1 80 80 ASP C C 80 177.285 177.285 176.907 0.378 25324 4738 1 7 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.818 0.365 25324 4739 1 7 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.070 -0.547 25324 4740 1 7 . 1 1 80 80 ASP H H 80 8.132 8.132 8.559 -0.427 25324 4741 1 7 . 1 1 81 81 SER N N 81 112.690 112.690 113.331 -0.641 25324 4742 1 7 . 1 1 81 81 SER HA H 81 4.513 4.513 4.382 0.131 25324 4743 1 7 . 1 1 81 81 SER C C 81 173.684 173.684 174.142 -0.458 25324 4744 1 7 . 1 1 81 81 SER CA C 81 57.232 57.232 57.783 -0.551 25324 4745 1 7 . 1 1 81 81 SER CB C 81 63.170 63.170 62.964 0.206 25324 4746 1 7 . 1 1 81 81 SER H H 81 8.179 8.179 7.906 0.273 25324 4747 1 7 . 1 1 82 82 ALA N N 82 126.310 126.310 126.555 -0.245 25324 4748 1 7 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.468 -0.065 25324 4749 1 7 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.858 0.608 25324 4750 1 7 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.355 -0.157 25324 4751 1 7 . 1 1 82 82 ALA H H 82 7.274 7.274 7.173 0.101 25324 4752 1 7 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.220 0.153 25324 4753 1 7 . 1 1 83 83 PRO C C 83 175.378 175.378 174.972 0.406 25324 4754 1 7 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.261 0.066 25324 4755 1 7 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.520 -0.356 25324 4756 1 7 . 1 1 84 84 TRP N N 84 120.106 120.106 117.321 2.785 25324 4757 1 7 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.587 -0.316 25324 4758 1 7 . 1 1 84 84 TRP C C 84 176.358 176.358 176.055 0.303 25324 4759 1 7 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.520 0.426 25324 4760 1 7 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.868 -1.152 25324 4761 1 7 . 1 1 84 84 TRP H H 84 8.329 8.329 7.943 0.386 25324 4762 1 7 . 1 1 85 85 HIS N N 85 118.543 118.543 121.733 -3.190 25324 4763 1 7 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.968 -0.050 25324 4764 1 7 . 1 1 85 85 HIS C C 85 174.950 174.950 175.276 -0.326 25324 4765 1 7 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.886 -1.417 25324 4766 1 7 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.150 -1.476 25324 4767 1 7 . 1 1 85 85 HIS H H 85 9.204 9.204 9.043 0.161 25324 4768 1 7 . 1 1 86 86 SER N N 86 117.803 117.803 118.057 -0.254 25324 4769 1 7 . 1 1 86 86 SER HA H 86 4.412 4.412 4.190 0.222 25324 4770 1 7 . 1 1 86 86 SER C C 86 175.691 175.691 174.558 1.133 25324 4771 1 7 . 1 1 86 86 SER CA C 86 60.257 60.257 60.164 0.093 25324 4772 1 7 . 1 1 86 86 SER CB C 86 63.015 63.015 63.536 -0.521 25324 4773 1 7 . 1 1 86 86 SER H H 86 9.168 9.168 8.992 0.176 25324 4774 1 7 . 1 1 87 87 GLY N N 87 115.773 115.773 113.473 2.300 25324 4775 1 7 . 1 1 87 87 GLY C C 87 174.288 174.288 173.739 0.549 25324 4776 1 7 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.044 -0.343 25324 4777 1 7 . 1 1 87 87 GLY H H 87 9.284 9.284 9.129 0.155 25324 4778 1 7 . 1 1 88 88 GLY N N 88 109.162 109.162 107.244 1.918 25324 4779 1 7 . 1 1 88 88 GLY C C 88 171.120 171.120 171.830 -0.710 25324 4780 1 7 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.031 -0.437 25324 4781 1 7 . 1 1 88 88 GLY H H 88 8.054 8.054 7.919 0.135 25324 4782 1 7 . 1 1 89 89 ASN N N 89 117.048 117.048 120.051 -3.003 25324 4783 1 7 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.730 0.308 25324 4784 1 7 . 1 1 89 89 ASN C C 89 175.287 175.287 174.947 0.340 25324 4785 1 7 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.441 -0.576 25324 4786 1 7 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.099 -0.494 25324 4787 1 7 . 1 1 89 89 ASN H H 89 8.516 8.516 8.730 -0.214 25324 4788 1 7 . 1 1 90 90 TRP N N 90 125.844 125.844 126.404 -0.560 25324 4789 1 7 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.071 0.182 25324 4790 1 7 . 1 1 90 90 TRP C C 90 175.278 175.278 175.522 -0.244 25324 4791 1 7 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.231 0.037 25324 4792 1 7 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.394 0.564 25324 4793 1 7 . 1 1 90 90 TRP H H 90 9.282 9.282 9.181 0.101 25324 4794 1 7 . 1 1 91 91 ILE N N 91 123.134 123.134 121.501 1.633 25324 4795 1 7 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.132 0.314 25324 4796 1 7 . 1 1 91 91 ILE C C 91 175.489 175.489 175.443 0.046 25324 4797 1 7 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.521 1.305 25324 4798 1 7 . 1 1 91 91 ILE CB C 91 39.676 39.676 37.748 1.928 25324 4799 1 7 . 1 1 91 91 ILE H H 91 9.318 9.318 8.570 0.748 25324 4800 1 7 . 1 1 92 92 LEU N N 92 123.452 123.452 129.741 -6.289 25324 4801 1 7 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.724 0.218 25324 4802 1 7 . 1 1 92 92 LEU C C 92 173.620 173.620 174.521 -0.901 25324 4803 1 7 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.506 -1.250 25324 4804 1 7 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.737 1.771 25324 4805 1 7 . 1 1 92 92 LEU H H 92 8.463 8.463 8.809 -0.346 25324 4806 1 7 . 1 1 93 93 GLY N N 93 103.987 103.987 108.343 -4.356 25324 4807 1 7 . 1 1 93 93 GLY C C 93 172.284 172.284 173.950 -1.666 25324 4808 1 7 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.314 -1.814 25324 4809 1 7 . 1 1 93 93 GLY H H 93 2.937 2.937 6.723 -3.786 25324 4810 1 7 . 1 1 94 94 SER N N 94 110.274 110.274 118.239 -7.965 25324 4811 1 7 . 1 1 94 94 SER HA H 94 4.711 4.711 4.864 -0.153 25324 4812 1 7 . 1 1 94 94 SER C C 94 174.784 174.784 175.609 -0.825 25324 4813 1 7 . 1 1 94 94 SER CA C 94 56.555 56.555 59.090 -2.535 25324 4814 1 7 . 1 1 94 94 SER CB C 94 65.051 65.051 64.736 0.315 25324 4815 1 7 . 1 1 94 94 SER H H 94 7.919 7.919 9.804 -1.885 25324 4816 1 7 . 1 1 95 95 ARG N N 95 123.020 123.020 122.375 0.645 25324 4817 1 7 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.464 0.208 25324 4818 1 7 . 1 1 95 95 ARG C C 95 176.120 176.120 177.690 -1.570 25324 4819 1 7 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.334 0.040 25324 4820 1 7 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.297 0.551 25324 4821 1 7 . 1 1 95 95 ARG H H 95 9.148 9.148 7.592 1.556 25324 4822 1 7 . 1 1 96 96 GLU N N 96 120.357 120.357 124.495 -4.138 25324 4823 1 7 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.009 0.273 25324 4824 1 7 . 1 1 96 96 GLU C C 96 176.278 176.278 176.343 -0.065 25324 4825 1 7 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.978 -2.449 25324 4826 1 7 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.659 0.494 25324 4827 1 7 . 1 1 96 96 GLU H H 96 8.610 8.610 8.894 -0.284 25324 4828 1 7 . 1 1 97 97 ASN N N 97 117.678 117.678 114.317 3.361 25324 4829 1 7 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.750 -0.138 25324 4830 1 7 . 1 1 97 97 ASN C C 97 173.949 173.949 174.273 -0.324 25324 4831 1 7 . 1 1 97 97 ASN CA C 97 53.015 53.015 51.848 1.167 25324 4832 1 7 . 1 1 97 97 ASN CB C 97 38.166 38.166 37.979 0.187 25324 4833 1 7 . 1 1 97 97 ASN H H 97 8.533 8.533 8.074 0.459 25324 4834 1 7 . 1 1 98 98 GLN N N 98 118.592 118.592 119.963 -1.371 25324 4835 1 7 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.476 -0.116 25324 4836 1 7 . 1 1 98 98 GLN C C 98 173.116 173.116 174.153 -1.037 25324 4837 1 7 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.435 0.193 25324 4838 1 7 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.882 -1.013 25324 4839 1 7 . 1 1 98 98 GLN H H 98 7.663 7.663 7.421 0.242 25324 4840 1 7 . 1 1 99 99 ASN N N 99 122.855 122.855 121.443 1.412 25324 4841 1 7 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.044 0.091 25324 4842 1 7 . 1 1 99 99 ASN C C 99 175.287 175.287 175.189 0.098 25324 4843 1 7 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.637 0.353 25324 4844 1 7 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.133 0.358 25324 4845 1 7 . 1 1 99 99 ASN H H 99 8.759 8.759 8.673 0.086 25324 4846 1 7 . 1 1 100 100 VAL N N 100 121.385 121.385 120.081 1.304 25324 4847 1 7 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.936 -0.188 25324 4848 1 7 . 1 1 100 100 VAL C C 100 174.956 174.956 176.408 -1.452 25324 4849 1 7 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.082 0.761 25324 4850 1 7 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.177 1.266 25324 4851 1 7 . 1 1 100 100 VAL H H 100 8.717 8.717 7.985 0.732 25324 4852 1 7 . 1 1 101 101 VAL N N 101 112.736 112.736 120.529 -7.793 25324 4853 1 7 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.429 0.216 25324 4854 1 7 . 1 1 101 101 VAL C C 101 175.577 175.577 174.619 0.958 25324 4855 1 7 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.647 -1.684 25324 4856 1 7 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.564 -0.523 25324 4857 1 7 . 1 1 101 101 VAL H H 101 8.802 8.802 8.788 0.014 25324 4858 1 7 . 1 1 102 102 ALA N N 102 122.104 122.104 120.701 1.403 25324 4859 1 7 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.251 -0.444 25324 4860 1 7 . 1 1 102 102 ALA C C 102 176.046 176.046 175.016 1.030 25324 4861 1 7 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.824 2.430 25324 4862 1 7 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.136 -0.510 25324 4863 1 7 . 1 1 102 102 ALA H H 102 7.677 7.677 7.716 -0.039 25324 4864 1 7 . 1 1 103 103 ILE N N 103 118.218 118.218 121.754 -3.536 25324 4865 1 7 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.288 -0.261 25324 4866 1 7 . 1 1 103 103 ILE C C 103 173.118 173.118 173.870 -0.752 25324 4867 1 7 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.593 1.634 25324 4868 1 7 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.454 1.017 25324 4869 1 7 . 1 1 103 103 ILE H H 103 8.102 8.102 8.510 -0.408 25324 4870 1 7 . 1 1 104 104 ASN N N 104 125.938 125.938 126.908 -0.970 25324 4871 1 7 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.220 0.466 25324 4872 1 7 . 1 1 104 104 ASN C C 104 174.870 174.870 173.542 1.328 25324 4873 1 7 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.069 0.485 25324 4874 1 7 . 1 1 104 104 ASN CB C 104 38.852 38.852 39.970 -1.118 25324 4875 1 7 . 1 1 104 104 ASN H H 104 8.668 8.668 8.874 -0.206 25324 4876 1 7 . 1 1 105 105 VAL N N 105 114.631 114.631 119.954 -5.323 25324 4877 1 7 . 1 1 105 105 VAL HA H 105 5.205 5.205 4.912 0.293 25324 4878 1 7 . 1 1 105 105 VAL C C 105 174.788 174.788 173.461 1.327 25324 4879 1 7 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.246 -2.267 25324 4880 1 7 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.291 0.749 25324 4881 1 7 . 1 1 105 105 VAL H H 105 8.933 8.933 8.701 0.232 25324 4882 1 7 . 1 1 106 106 GLU N N 106 118.347 118.347 127.049 -8.702 25324 4883 1 7 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.014 0.066 25324 4884 1 7 . 1 1 106 106 GLU C C 106 174.777 174.777 174.757 0.020 25324 4885 1 7 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.229 -0.262 25324 4886 1 7 . 1 1 106 106 GLU CB C 106 33.643 33.643 33.407 0.236 25324 4887 1 7 . 1 1 106 106 GLU H H 106 8.814 8.814 8.564 0.250 25324 4888 1 7 . 1 1 107 107 SER N N 107 115.335 115.335 122.077 -6.742 25324 4889 1 7 . 1 1 107 107 SER HA H 107 5.266 5.266 4.827 0.439 25324 4890 1 7 . 1 1 107 107 SER C C 107 175.787 175.787 173.210 2.577 25324 4891 1 7 . 1 1 107 107 SER CA C 107 55.888 55.888 57.590 -1.702 25324 4892 1 7 . 1 1 107 107 SER CB C 107 65.921 65.921 64.855 1.066 25324 4893 1 7 . 1 1 107 107 SER H H 107 8.576 8.576 8.661 -0.085 25324 4894 1 7 . 1 1 108 108 GLY N N 108 117.567 117.567 112.696 4.871 25324 4895 1 7 . 1 1 108 108 GLY C C 108 173.959 173.959 174.685 -0.726 25324 4896 1 7 . 1 1 108 108 GLY CA C 108 44.677 44.677 44.594 0.083 25324 4897 1 7 . 1 1 108 108 GLY H H 108 9.532 9.532 8.655 0.877 25324 4898 1 7 . 1 1 109 109 ASP N N 109 122.108 122.108 120.042 2.066 25324 4899 1 7 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.672 0.129 25324 4900 1 7 . 1 1 109 109 ASP C C 109 176.203 176.203 175.664 0.539 25324 4901 1 7 . 1 1 109 109 ASP CA C 109 52.134 52.134 53.133 -0.999 25324 4902 1 7 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.672 -2.330 25324 4903 1 7 . 1 1 109 109 ASP H H 109 8.605 8.605 7.570 1.035 25324 4904 1 7 . 1 1 110 110 ASP N N 110 116.197 116.197 119.332 -3.135 25324 4905 1 7 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.570 -0.348 25324 4906 1 7 . 1 1 110 110 ASP C C 110 175.951 175.951 176.686 -0.735 25324 4907 1 7 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.766 1.433 25324 4908 1 7 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.601 -1.971 25324 4909 1 7 . 1 1 110 110 ASP H H 110 9.087 9.087 8.496 0.591 25324 4910 1 7 . 1 1 111 111 GLY N N 111 103.841 103.841 107.715 -3.874 25324 4911 1 7 . 1 1 111 111 GLY C C 111 173.924 173.924 174.637 -0.713 25324 4912 1 7 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.745 -0.582 25324 4913 1 7 . 1 1 111 111 GLY H H 111 8.930 8.930 8.427 0.503 25324 4914 1 7 . 1 1 112 112 GLN N N 112 121.626 121.626 119.806 1.820 25324 4915 1 7 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.161 -0.091 25324 4916 1 7 . 1 1 112 112 GLN C C 112 176.431 176.431 175.157 1.274 25324 4917 1 7 . 1 1 112 112 GLN CA C 112 58.273 58.273 57.684 0.589 25324 4918 1 7 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.204 -1.511 25324 4919 1 7 . 1 1 112 112 GLN H H 112 7.351 7.351 8.426 -1.075 25324 4920 1 7 . 1 1 113 113 THR N N 113 112.322 112.322 109.490 2.832 25324 4921 1 7 . 1 1 113 113 THR HA H 113 5.331 5.331 5.369 -0.038 25324 4922 1 7 . 1 1 113 113 THR C C 113 174.452 174.452 173.166 1.286 25324 4923 1 7 . 1 1 113 113 THR CA C 113 59.739 59.739 59.662 0.077 25324 4924 1 7 . 1 1 113 113 THR CB C 113 71.773 71.773 71.297 0.476 25324 4925 1 7 . 1 1 113 113 THR H H 113 10.053 10.053 8.761 1.292 25324 4926 1 7 . 1 1 114 114 LEU N N 114 122.083 122.083 124.364 -2.281 25324 4927 1 7 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.660 -0.079 25324 4928 1 7 . 1 1 114 114 LEU C C 114 175.113 175.113 175.373 -0.260 25324 4929 1 7 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.065 -0.160 25324 4930 1 7 . 1 1 114 114 LEU CB C 114 47.033 47.033 42.568 4.465 25324 4931 1 7 . 1 1 114 114 LEU H H 114 8.978 8.978 8.624 0.354 25324 4932 1 7 . 1 1 115 115 ASN N N 115 118.846 118.846 122.184 -3.338 25324 4933 1 7 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.765 0.005 25324 4934 1 7 . 1 1 115 115 ASN C C 115 174.788 174.788 175.283 -0.495 25324 4935 1 7 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.596 0.746 25324 4936 1 7 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.557 0.857 25324 4937 1 7 . 1 1 115 115 ASN H H 115 8.837 8.837 8.739 0.098 25324 4938 1 7 . 1 1 116 116 GLY N N 116 109.661 109.661 108.772 0.889 25324 4939 1 7 . 1 1 116 116 GLY C C 116 172.452 172.452 172.695 -0.243 25324 4940 1 7 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.173 0.298 25324 4941 1 7 . 1 1 116 116 GLY H H 116 8.625 8.625 8.925 -0.300 25324 4942 1 7 . 1 1 117 117 THR N N 117 120.009 120.009 114.305 5.704 25324 4943 1 7 . 1 1 117 117 THR HA H 117 5.556 5.556 5.468 0.088 25324 4944 1 7 . 1 1 117 117 THR C C 117 171.619 171.619 173.190 -1.571 25324 4945 1 7 . 1 1 117 117 THR CA C 117 59.373 59.373 60.450 -1.077 25324 4946 1 7 . 1 1 117 117 THR CB C 117 72.777 72.777 72.773 0.004 25324 4947 1 7 . 1 1 117 117 THR H H 117 8.911 8.911 8.953 -0.042 25324 4948 1 7 . 1 1 118 118 MET N N 118 115.550 115.550 117.221 -1.671 25324 4949 1 7 . 1 1 118 118 MET HA H 118 4.889 4.889 5.126 -0.237 25324 4950 1 7 . 1 1 118 118 MET C C 118 172.707 172.707 173.830 -1.123 25324 4951 1 7 . 1 1 118 118 MET CA C 118 54.714 54.714 55.018 -0.304 25324 4952 1 7 . 1 1 118 118 MET CB C 118 33.663 33.663 37.081 -3.418 25324 4953 1 7 . 1 1 118 118 MET H H 118 9.159 9.159 9.281 -0.122 25324 4954 1 7 . 1 1 119 119 THR N N 119 113.716 113.716 116.671 -2.955 25324 4955 1 7 . 1 1 119 119 THR HA H 119 4.682 4.682 4.835 -0.153 25324 4956 1 7 . 1 1 119 119 THR C C 119 173.952 173.952 173.440 0.512 25324 4957 1 7 . 1 1 119 119 THR CA C 119 61.395 61.395 61.462 -0.067 25324 4958 1 7 . 1 1 119 119 THR CB C 119 71.746 71.746 71.641 0.105 25324 4959 1 7 . 1 1 119 119 THR H H 119 8.685 8.685 8.713 -0.028 25324 4960 1 7 . 1 1 120 120 TYR N N 120 129.153 129.153 125.367 3.786 25324 4961 1 7 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.825 -0.025 25324 4962 1 7 . 1 1 120 120 TYR C C 120 175.214 175.214 177.304 -2.090 25324 4963 1 7 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.224 0.653 25324 4964 1 7 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.941 0.561 25324 4965 1 7 . 1 1 120 120 TYR H H 120 10.107 10.107 8.267 1.840 25324 4966 1 7 . 1 1 121 121 ALA N N 121 119.947 119.947 124.363 -4.416 25324 4967 1 7 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.184 -0.180 25324 4968 1 7 . 1 1 121 121 ALA C C 121 178.456 178.456 177.118 1.338 25324 4969 1 7 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.142 0.814 25324 4970 1 7 . 1 1 121 121 ALA CB C 121 18.710 18.710 16.923 1.787 25324 4971 1 7 . 1 1 121 121 ALA H H 121 8.704 8.704 8.858 -0.154 25324 4972 1 7 . 1 1 122 122 GLY N N 122 111.186 111.186 107.358 3.828 25324 4973 1 7 . 1 1 122 122 GLY C C 122 173.949 173.949 175.563 -1.614 25324 4974 1 7 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.166 -0.164 25324 4975 1 7 . 1 1 122 122 GLY H H 122 8.792 8.792 8.398 0.394 25324 4976 1 7 . 1 1 123 123 GLU N N 123 120.099 120.099 120.649 -0.550 25324 4977 1 7 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.278 0.427 25324 4978 1 7 . 1 1 123 123 GLU C C 123 175.912 175.912 177.501 -1.589 25324 4979 1 7 . 1 1 123 123 GLU CA C 123 54.414 54.414 57.279 -2.865 25324 4980 1 7 . 1 1 123 123 GLU CB C 123 32.784 32.784 30.210 2.574 25324 4981 1 7 . 1 1 123 123 GLU H H 123 8.072 8.072 8.516 -0.444 25324 4982 1 7 . 1 1 124 124 GLY N N 124 105.303 105.303 108.371 -3.068 25324 4983 1 7 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.118 -0.316 25324 4984 1 7 . 1 1 124 124 GLY H H 124 7.939 7.939 7.589 0.350 25324 4985 1 7 . 1 1 125 125 PRO HA H 125 4.935 4.935 5.069 -0.134 25324 4986 1 7 . 1 1 125 125 PRO C C 125 177.788 177.788 176.531 1.257 25324 4987 1 7 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.083 0.048 25324 4988 1 7 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.894 -0.035 25324 4989 1 7 . 1 1 126 126 ILE N N 126 117.387 117.387 118.891 -1.504 25324 4990 1 7 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.711 0.188 25324 4991 1 7 . 1 1 126 126 ILE C C 126 175.625 175.625 174.988 0.637 25324 4992 1 7 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.161 0.292 25324 4993 1 7 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.639 0.909 25324 4994 1 7 . 1 1 126 126 ILE H H 126 9.599 9.599 8.990 0.609 25324 4995 1 7 . 1 1 127 127 GLY N N 127 106.753 106.753 108.218 -1.465 25324 4996 1 7 . 1 1 127 127 GLY C C 127 173.627 173.627 172.817 0.810 25324 4997 1 7 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.634 1.649 25324 4998 1 7 . 1 1 127 127 GLY H H 127 8.840 8.840 8.500 0.340 25324 4999 1 7 . 1 1 128 128 PHE N N 128 124.826 124.826 126.040 -1.214 25324 5000 1 7 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.251 -0.307 25324 5001 1 7 . 1 1 128 128 PHE C C 128 173.087 173.087 173.252 -0.165 25324 5002 1 7 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.727 0.282 25324 5003 1 7 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.453 -0.293 25324 5004 1 7 . 1 1 128 128 PHE H H 128 8.924 8.924 9.088 -0.164 25324 5005 1 7 . 1 1 129 129 LYS N N 129 131.518 131.518 127.883 3.635 25324 5006 1 7 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.929 -0.046 25324 5007 1 7 . 1 1 129 129 LYS C C 129 173.863 173.863 173.831 0.032 25324 5008 1 7 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.521 1.214 25324 5009 1 7 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.842 -1.121 25324 5010 1 7 . 1 1 129 129 LYS H H 129 8.201 8.201 8.192 0.009 25324 5011 1 7 . 1 1 130 130 GLY N N 130 114.030 114.030 113.215 0.815 25324 5012 1 7 . 1 1 130 130 GLY C C 130 171.951 171.951 172.534 -0.583 25324 5013 1 7 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.744 0.043 25324 5014 1 7 . 1 1 130 130 GLY H H 130 9.325 9.325 8.627 0.698 25324 5015 1 7 . 1 1 131 131 THR N N 131 120.583 120.583 120.594 -0.011 25324 5016 1 7 . 1 1 131 131 THR HA H 131 4.939 4.939 5.116 -0.177 25324 5017 1 7 . 1 1 131 131 THR C C 131 173.118 173.118 173.922 -0.804 25324 5018 1 7 . 1 1 131 131 THR CA C 131 61.266 61.266 61.169 0.097 25324 5019 1 7 . 1 1 131 131 THR CB C 131 70.392 70.392 72.082 -1.690 25324 5020 1 7 . 1 1 131 131 THR H H 131 8.916 8.916 8.819 0.097 25324 5021 1 7 . 1 1 132 132 LEU N N 132 130.774 130.774 129.143 1.631 25324 5022 1 7 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.748 -0.248 25324 5023 1 7 . 1 1 132 132 LEU C C 132 176.574 176.574 175.682 0.892 25324 5024 1 7 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.988 0.199 25324 5025 1 7 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.843 0.604 25324 5026 1 7 . 1 1 132 132 LEU H H 132 8.527 8.527 8.837 -0.310 25324 5027 1 8 . 1 1 3 3 LEU N N 3 123.202 123.202 121.533 1.669 25324 5028 1 8 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.761 0.396 25324 5029 1 8 . 1 1 3 3 LEU C C 3 175.786 175.786 174.772 1.014 25324 5030 1 8 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.485 -0.201 25324 5031 1 8 . 1 1 3 3 LEU CB C 3 43.330 43.330 42.900 0.430 25324 5032 1 8 . 1 1 3 3 LEU H H 3 8.711 8.711 8.210 0.501 25324 5033 1 8 . 1 1 4 4 TYR N N 4 120.906 120.906 125.058 -4.152 25324 5034 1 8 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.167 -0.143 25324 5035 1 8 . 1 1 4 4 TYR C C 4 175.953 175.953 175.134 0.819 25324 5036 1 8 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.483 -0.106 25324 5037 1 8 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.336 -0.681 25324 5038 1 8 . 1 1 4 4 TYR H H 4 9.142 9.142 9.446 -0.304 25324 5039 1 8 . 1 1 5 5 ASN N N 5 120.496 120.496 120.204 0.292 25324 5040 1 8 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.980 0.136 25324 5041 1 8 . 1 1 5 5 ASN C C 5 174.953 174.953 173.561 1.392 25324 5042 1 8 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.168 -0.221 25324 5043 1 8 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.937 -2.046 25324 5044 1 8 . 1 1 5 5 ASN H H 5 8.787 8.787 8.936 -0.149 25324 5045 1 8 . 1 1 6 6 VAL N N 6 127.428 127.428 124.215 3.213 25324 5046 1 8 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.258 0.104 25324 5047 1 8 . 1 1 6 6 VAL C C 6 174.955 174.955 174.358 0.597 25324 5048 1 8 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.931 0.502 25324 5049 1 8 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.145 0.186 25324 5050 1 8 . 1 1 6 6 VAL H H 6 8.806 8.806 8.375 0.431 25324 5051 1 8 . 1 1 7 7 GLU N N 7 124.355 124.355 126.721 -2.366 25324 5052 1 8 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.853 0.129 25324 5053 1 8 . 1 1 7 7 GLU C C 7 174.551 174.551 174.780 -0.229 25324 5054 1 8 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.717 -0.928 25324 5055 1 8 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.900 1.667 25324 5056 1 8 . 1 1 7 7 GLU H H 7 8.800 8.800 8.607 0.193 25324 5057 1 8 . 1 1 8 8 ASN N N 8 116.231 116.231 122.111 -5.880 25324 5058 1 8 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.932 0.109 25324 5059 1 8 . 1 1 8 8 ASN C C 8 172.709 172.709 173.909 -1.200 25324 5060 1 8 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.514 -0.897 25324 5061 1 8 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.762 2.823 25324 5062 1 8 . 1 1 8 8 ASN H H 8 9.320 9.320 9.271 0.049 25324 5063 1 8 . 1 1 9 9 GLN N N 9 120.762 120.762 123.425 -2.663 25324 5064 1 8 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.353 -0.179 25324 5065 1 8 . 1 1 9 9 GLN C C 9 173.454 173.454 173.782 -0.328 25324 5066 1 8 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.299 -0.339 25324 5067 1 8 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.732 -1.041 25324 5068 1 8 . 1 1 9 9 GLN H H 9 6.887 6.887 8.401 -1.514 25324 5069 1 8 . 1 1 10 10 TRP N N 10 127.775 127.775 123.563 4.212 25324 5070 1 8 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.045 -0.057 25324 5071 1 8 . 1 1 10 10 TRP C C 10 175.281 175.281 175.916 -0.635 25324 5072 1 8 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.552 -0.259 25324 5073 1 8 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.515 -1.773 25324 5074 1 8 . 1 1 10 10 TRP H H 10 8.518 8.518 7.785 0.733 25324 5075 1 8 . 1 1 11 11 GLY N N 11 107.838 107.838 111.056 -3.218 25324 5076 1 8 . 1 1 11 11 GLY C C 11 174.733 174.733 174.180 0.553 25324 5077 1 8 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.627 0.208 25324 5078 1 8 . 1 1 11 11 GLY H H 11 8.461 8.461 8.676 -0.215 25324 5079 1 8 . 1 1 12 12 GLY N N 12 109.696 109.696 107.683 2.013 25324 5080 1 8 . 1 1 12 12 GLY C C 12 174.133 174.133 174.159 -0.026 25324 5081 1 8 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.756 -0.967 25324 5082 1 8 . 1 1 12 12 GLY H H 12 8.138 8.138 7.461 0.677 25324 5083 1 8 . 1 1 13 13 SER N N 13 111.308 111.308 115.141 -3.833 25324 5084 1 8 . 1 1 13 13 SER HA H 13 4.092 4.092 4.136 -0.044 25324 5085 1 8 . 1 1 13 13 SER C C 13 175.622 175.622 175.634 -0.012 25324 5086 1 8 . 1 1 13 13 SER CA C 13 60.494 60.494 60.291 0.203 25324 5087 1 8 . 1 1 13 13 SER CB C 13 63.028 63.028 63.579 -0.551 25324 5088 1 8 . 1 1 13 13 SER H H 13 8.215 8.215 8.589 -0.374 25324 5089 1 8 . 1 1 14 14 SER N N 14 115.290 115.290 115.309 -0.019 25324 5090 1 8 . 1 1 14 14 SER HA H 14 4.566 4.566 4.305 0.261 25324 5091 1 8 . 1 1 14 14 SER C C 14 173.532 173.532 174.135 -0.603 25324 5092 1 8 . 1 1 14 14 SER CA C 14 57.317 57.317 58.724 -1.407 25324 5093 1 8 . 1 1 14 14 SER CB C 14 63.230 63.230 63.205 0.025 25324 5094 1 8 . 1 1 14 14 SER H H 14 8.213 8.213 7.830 0.383 25324 5095 1 8 . 1 1 15 15 ALA N N 15 126.470 126.470 125.548 0.922 25324 5096 1 8 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.570 -0.167 25324 5097 1 8 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.366 1.098 25324 5098 1 8 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.659 -0.430 25324 5099 1 8 . 1 1 15 15 ALA H H 15 7.308 7.308 7.489 -0.181 25324 5100 1 8 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.314 0.095 25324 5101 1 8 . 1 1 16 16 PRO C C 16 175.627 175.627 175.077 0.550 25324 5102 1 8 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.044 0.348 25324 5103 1 8 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.809 -0.672 25324 5104 1 8 . 1 1 17 17 TRP N N 17 120.228 120.228 117.961 2.267 25324 5105 1 8 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.423 -0.105 25324 5106 1 8 . 1 1 17 17 TRP C C 17 175.951 175.951 175.982 -0.031 25324 5107 1 8 . 1 1 17 17 TRP CA C 17 56.915 56.915 57.020 -0.105 25324 5108 1 8 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.637 -1.228 25324 5109 1 8 . 1 1 17 17 TRP H H 17 8.380 8.380 8.100 0.280 25324 5110 1 8 . 1 1 18 18 ASN N N 18 120.663 120.663 122.824 -2.161 25324 5111 1 8 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.057 0.029 25324 5112 1 8 . 1 1 18 18 ASN C C 18 174.793 174.793 174.482 0.311 25324 5113 1 8 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.658 -1.057 25324 5114 1 8 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.920 1.728 25324 5115 1 8 . 1 1 18 18 ASN H H 18 9.094 9.094 8.838 0.256 25324 5116 1 8 . 1 1 19 19 GLU N N 19 122.202 122.202 124.508 -2.306 25324 5117 1 8 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.693 -0.554 25324 5118 1 8 . 1 1 19 19 GLU C C 19 176.869 176.869 176.602 0.267 25324 5119 1 8 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.258 2.341 25324 5120 1 8 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.619 -0.237 25324 5121 1 8 . 1 1 19 19 GLU H H 19 9.013 9.013 8.978 0.035 25324 5122 1 8 . 1 1 20 20 GLY N N 20 112.893 112.893 111.917 0.976 25324 5123 1 8 . 1 1 20 20 GLY C C 20 174.878 174.878 173.230 1.648 25324 5124 1 8 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.768 0.227 25324 5125 1 8 . 1 1 20 20 GLY H H 20 8.926 8.926 8.381 0.545 25324 5126 1 8 . 1 1 21 21 GLY N N 21 110.354 110.354 107.713 2.641 25324 5127 1 8 . 1 1 21 21 GLY C C 21 171.623 171.623 171.665 -0.042 25324 5128 1 8 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.232 -0.834 25324 5129 1 8 . 1 1 21 21 GLY H H 21 8.258 8.258 7.581 0.677 25324 5130 1 8 . 1 1 22 22 GLN N N 22 117.541 117.541 117.518 0.023 25324 5131 1 8 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.729 0.948 25324 5132 1 8 . 1 1 22 22 GLN C C 22 175.957 175.957 174.074 1.883 25324 5133 1 8 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.700 0.244 25324 5134 1 8 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.470 -1.385 25324 5135 1 8 . 1 1 22 22 GLN H H 22 8.564 8.564 8.487 0.077 25324 5136 1 8 . 1 1 23 23 TRP N N 23 127.208 127.208 120.324 6.884 25324 5137 1 8 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.108 0.091 25324 5138 1 8 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.684 -0.153 25324 5139 1 8 . 1 1 23 23 TRP CB C 23 31.683 31.683 33.338 -1.655 25324 5140 1 8 . 1 1 23 23 TRP H H 23 9.347 9.347 9.142 0.205 25324 5141 1 8 . 1 1 24 24 GLU N N 24 123.504 123.504 121.017 2.487 25324 5142 1 8 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.277 0.231 25324 5143 1 8 . 1 1 24 24 GLU C C 24 174.222 174.222 175.267 -1.045 25324 5144 1 8 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.196 0.395 25324 5145 1 8 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.556 -1.941 25324 5146 1 8 . 1 1 24 24 GLU H H 24 9.296 9.296 8.655 0.641 25324 5147 1 8 . 1 1 25 25 ILE N N 25 123.447 123.447 126.295 -2.848 25324 5148 1 8 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.330 0.106 25324 5149 1 8 . 1 1 25 25 ILE C C 25 175.790 175.790 174.403 1.387 25324 5150 1 8 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.816 -0.189 25324 5151 1 8 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.580 0.372 25324 5152 1 8 . 1 1 25 25 ILE H H 25 8.635 8.635 8.446 0.189 25324 5153 1 8 . 1 1 26 26 GLY N N 26 111.544 111.544 113.714 -2.170 25324 5154 1 8 . 1 1 26 26 GLY C C 26 172.122 172.122 175.027 -2.905 25324 5155 1 8 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.576 -0.498 25324 5156 1 8 . 1 1 26 26 GLY H H 26 3.381 3.381 6.954 -3.573 25324 5157 1 8 . 1 1 27 27 SER N N 27 112.279 112.279 113.926 -1.647 25324 5158 1 8 . 1 1 27 27 SER HA H 27 4.876 4.876 4.244 0.632 25324 5159 1 8 . 1 1 27 27 SER C C 27 174.113 174.113 175.085 -0.972 25324 5160 1 8 . 1 1 27 27 SER CA C 27 56.954 56.954 59.942 -2.988 25324 5161 1 8 . 1 1 27 27 SER CB C 27 64.554 64.554 63.953 0.601 25324 5162 1 8 . 1 1 27 27 SER H H 27 8.212 8.212 8.555 -0.343 25324 5163 1 8 . 1 1 28 28 ARG N N 28 120.872 120.872 122.803 -1.931 25324 5164 1 8 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.570 0.193 25324 5165 1 8 . 1 1 28 28 ARG C C 28 176.119 176.119 176.369 -0.250 25324 5166 1 8 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.607 -0.490 25324 5167 1 8 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.512 1.318 25324 5168 1 8 . 1 1 28 28 ARG H H 28 7.849 7.849 8.367 -0.518 25324 5169 1 8 . 1 1 29 29 SER N N 29 118.985 118.985 119.981 -0.996 25324 5170 1 8 . 1 1 29 29 SER HA H 29 4.192 4.192 4.346 -0.154 25324 5171 1 8 . 1 1 29 29 SER C C 29 174.622 174.622 174.440 0.182 25324 5172 1 8 . 1 1 29 29 SER CA C 29 60.072 60.072 59.816 0.257 25324 5173 1 8 . 1 1 29 29 SER CB C 29 62.876 62.876 63.357 -0.481 25324 5174 1 8 . 1 1 29 29 SER H H 29 8.892 8.892 9.030 -0.138 25324 5175 1 8 . 1 1 30 30 ASP N N 30 117.632 117.632 119.371 -1.739 25324 5176 1 8 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.646 -0.028 25324 5177 1 8 . 1 1 30 30 ASP C C 30 175.101 175.101 176.004 -0.903 25324 5178 1 8 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.055 -2.003 25324 5179 1 8 . 1 1 30 30 ASP CB C 30 40.523 40.523 40.813 -0.291 25324 5180 1 8 . 1 1 30 30 ASP H H 30 8.441 8.441 8.091 0.350 25324 5181 1 8 . 1 1 31 31 GLN N N 31 118.273 118.273 118.242 0.031 25324 5182 1 8 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.515 -0.030 25324 5183 1 8 . 1 1 31 31 GLN C C 31 173.453 173.453 174.372 -0.919 25324 5184 1 8 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.764 0.104 25324 5185 1 8 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.234 3.015 25324 5186 1 8 . 1 1 31 31 GLN H H 31 7.029 7.029 7.530 -0.501 25324 5187 1 8 . 1 1 32 32 ASN N N 32 120.865 120.865 122.310 -1.445 25324 5188 1 8 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.853 0.267 25324 5189 1 8 . 1 1 32 32 ASN C C 32 175.198 175.198 174.927 0.271 25324 5190 1 8 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.971 -1.102 25324 5191 1 8 . 1 1 32 32 ASN CB C 32 39.630 39.630 39.924 -0.294 25324 5192 1 8 . 1 1 32 32 ASN H H 32 8.713 8.713 8.650 0.063 25324 5193 1 8 . 1 1 33 33 VAL N N 33 122.111 122.111 122.958 -0.847 25324 5194 1 8 . 1 1 33 33 VAL HA H 33 3.705 3.705 3.995 -0.290 25324 5195 1 8 . 1 1 33 33 VAL C C 33 174.950 174.950 176.159 -1.209 25324 5196 1 8 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.822 1.025 25324 5197 1 8 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.379 -0.029 25324 5198 1 8 . 1 1 33 33 VAL H H 33 8.542 8.542 8.532 0.010 25324 5199 1 8 . 1 1 34 34 VAL N N 34 113.282 113.282 119.502 -6.220 25324 5200 1 8 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.724 -0.079 25324 5201 1 8 . 1 1 34 34 VAL C C 34 175.574 175.574 175.168 0.406 25324 5202 1 8 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.392 -1.418 25324 5203 1 8 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.768 -0.739 25324 5204 1 8 . 1 1 34 34 VAL H H 34 8.744 8.744 8.842 -0.098 25324 5205 1 8 . 1 1 35 35 ALA N N 35 122.102 122.102 122.318 -0.216 25324 5206 1 8 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.194 -0.391 25324 5207 1 8 . 1 1 35 35 ALA C C 35 175.947 175.947 174.940 1.007 25324 5208 1 8 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.010 2.240 25324 5209 1 8 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.515 -0.887 25324 5210 1 8 . 1 1 35 35 ALA H H 35 7.677 7.677 7.876 -0.199 25324 5211 1 8 . 1 1 36 36 ILE N N 36 118.005 118.005 121.910 -3.905 25324 5212 1 8 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.459 -0.431 25324 5213 1 8 . 1 1 36 36 ILE C C 36 173.116 173.116 173.998 -0.882 25324 5214 1 8 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.085 1.097 25324 5215 1 8 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.428 1.057 25324 5216 1 8 . 1 1 36 36 ILE H H 36 8.126 8.126 8.861 -0.735 25324 5217 1 8 . 1 1 37 37 ASN N N 37 125.632 125.632 126.730 -1.098 25324 5218 1 8 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.877 -0.196 25324 5219 1 8 . 1 1 37 37 ASN C C 37 174.854 174.854 173.892 0.962 25324 5220 1 8 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.172 0.358 25324 5221 1 8 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.365 -2.512 25324 5222 1 8 . 1 1 37 37 ASN H H 37 8.577 8.577 9.015 -0.438 25324 5223 1 8 . 1 1 38 38 VAL N N 38 114.223 114.223 119.105 -4.882 25324 5224 1 8 . 1 1 38 38 VAL HA H 38 5.203 5.203 5.074 0.129 25324 5225 1 8 . 1 1 38 38 VAL C C 38 174.854 174.854 173.572 1.282 25324 5226 1 8 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.998 -2.018 25324 5227 1 8 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.966 0.078 25324 5228 1 8 . 1 1 38 38 VAL H H 38 8.874 8.874 8.905 -0.031 25324 5229 1 8 . 1 1 39 39 GLU N N 39 118.277 118.277 121.578 -3.301 25324 5230 1 8 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.323 -0.241 25324 5231 1 8 . 1 1 39 39 GLU C C 39 174.548 174.548 175.184 -0.636 25324 5232 1 8 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.297 0.695 25324 5233 1 8 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.339 -0.761 25324 5234 1 8 . 1 1 39 39 GLU H H 39 8.761 8.761 9.098 -0.337 25324 5235 1 8 . 1 1 40 40 SER N N 40 114.960 114.960 119.233 -4.273 25324 5236 1 8 . 1 1 40 40 SER HA H 40 5.265 5.265 5.078 0.187 25324 5237 1 8 . 1 1 40 40 SER C C 40 175.783 175.783 175.476 0.307 25324 5238 1 8 . 1 1 40 40 SER CA C 40 55.880 55.880 57.720 -1.840 25324 5239 1 8 . 1 1 40 40 SER CB C 40 65.911 65.911 64.057 1.854 25324 5240 1 8 . 1 1 40 40 SER H H 40 8.500 8.500 8.579 -0.079 25324 5241 1 8 . 1 1 41 41 GLY N N 41 117.567 117.567 108.842 8.725 25324 5242 1 8 . 1 1 41 41 GLY C C 41 174.119 174.119 174.123 -0.004 25324 5243 1 8 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.214 -0.526 25324 5244 1 8 . 1 1 41 41 GLY H H 41 9.533 9.533 8.824 0.709 25324 5245 1 8 . 1 1 42 42 ASP N N 42 122.141 122.141 120.544 1.597 25324 5246 1 8 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.805 -0.005 25324 5247 1 8 . 1 1 42 42 ASP C C 42 176.121 176.121 175.257 0.864 25324 5248 1 8 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.165 -1.019 25324 5249 1 8 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.397 -3.043 25324 5250 1 8 . 1 1 42 42 ASP H H 42 8.644 8.644 7.680 0.964 25324 5251 1 8 . 1 1 43 43 ASP N N 43 116.025 116.025 121.358 -5.333 25324 5252 1 8 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.580 -0.351 25324 5253 1 8 . 1 1 43 43 ASP C C 43 176.018 176.018 176.560 -0.542 25324 5254 1 8 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.498 0.751 25324 5255 1 8 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.741 -0.182 25324 5256 1 8 . 1 1 43 43 ASP H H 43 9.111 9.111 8.616 0.495 25324 5257 1 8 . 1 1 44 44 GLY N N 44 104.263 104.263 107.761 -3.498 25324 5258 1 8 . 1 1 44 44 GLY C C 44 173.922 173.922 175.365 -1.443 25324 5259 1 8 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.624 -0.323 25324 5260 1 8 . 1 1 44 44 GLY H H 44 9.063 9.063 7.877 1.186 25324 5261 1 8 . 1 1 45 45 GLN N N 45 121.691 121.691 119.241 2.450 25324 5262 1 8 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.177 -0.091 25324 5263 1 8 . 1 1 45 45 GLN C C 45 176.284 176.284 175.336 0.948 25324 5264 1 8 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.070 0.048 25324 5265 1 8 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.054 -1.380 25324 5266 1 8 . 1 1 45 45 GLN H H 45 7.356 7.356 8.326 -0.970 25324 5267 1 8 . 1 1 46 46 THR N N 46 111.843 111.843 112.656 -0.813 25324 5268 1 8 . 1 1 46 46 THR HA H 46 5.355 5.355 5.305 0.050 25324 5269 1 8 . 1 1 46 46 THR C C 46 174.451 174.451 172.597 1.854 25324 5270 1 8 . 1 1 46 46 THR CA C 46 59.644 59.644 59.867 -0.223 25324 5271 1 8 . 1 1 46 46 THR CB C 46 72.714 72.714 69.929 2.785 25324 5272 1 8 . 1 1 46 46 THR H H 46 10.123 10.123 7.563 2.560 25324 5273 1 8 . 1 1 47 47 LEU N N 47 119.302 119.302 128.370 -9.068 25324 5274 1 8 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.756 0.051 25324 5275 1 8 . 1 1 47 47 LEU C C 47 175.487 175.487 174.853 0.634 25324 5276 1 8 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.523 -0.453 25324 5277 1 8 . 1 1 47 47 LEU CB C 47 48.003 48.003 43.469 4.534 25324 5278 1 8 . 1 1 47 47 LEU H H 47 8.364 8.364 9.004 -0.640 25324 5279 1 8 . 1 1 48 48 ASN N N 48 116.844 116.844 120.612 -3.768 25324 5280 1 8 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.751 -0.022 25324 5281 1 8 . 1 1 48 48 ASN C C 48 174.460 174.460 174.823 -0.363 25324 5282 1 8 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.635 1.104 25324 5283 1 8 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.951 0.462 25324 5284 1 8 . 1 1 48 48 ASN H H 48 8.748 8.748 8.491 0.257 25324 5285 1 8 . 1 1 49 49 GLY N N 49 109.417 109.417 108.424 0.993 25324 5286 1 8 . 1 1 49 49 GLY C C 49 172.126 172.126 172.323 -0.197 25324 5287 1 8 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.170 0.321 25324 5288 1 8 . 1 1 49 49 GLY H H 49 8.744 8.744 8.856 -0.112 25324 5289 1 8 . 1 1 50 50 THR N N 50 119.162 119.162 117.363 1.799 25324 5290 1 8 . 1 1 50 50 THR HA H 50 5.556 5.556 5.499 0.057 25324 5291 1 8 . 1 1 50 50 THR C C 50 171.790 171.790 173.234 -1.444 25324 5292 1 8 . 1 1 50 50 THR CA C 50 59.371 59.371 61.929 -2.558 25324 5293 1 8 . 1 1 50 50 THR CB C 50 72.799 72.799 71.600 1.199 25324 5294 1 8 . 1 1 50 50 THR H H 50 8.799 8.799 8.869 -0.070 25324 5295 1 8 . 1 1 51 51 MET N N 51 115.232 115.232 125.528 -10.296 25324 5296 1 8 . 1 1 51 51 MET HA H 51 4.886 4.886 4.954 -0.068 25324 5297 1 8 . 1 1 51 51 MET C C 51 172.708 172.708 174.607 -1.899 25324 5298 1 8 . 1 1 51 51 MET CA C 51 54.722 54.722 54.611 0.111 25324 5299 1 8 . 1 1 51 51 MET CB C 51 34.557 34.557 36.803 -2.246 25324 5300 1 8 . 1 1 51 51 MET H H 51 9.062 9.062 9.198 -0.136 25324 5301 1 8 . 1 1 52 52 THR N N 52 113.697 113.697 117.643 -3.946 25324 5302 1 8 . 1 1 52 52 THR HA H 52 4.682 4.682 4.814 -0.132 25324 5303 1 8 . 1 1 52 52 THR C C 52 173.952 173.952 173.603 0.349 25324 5304 1 8 . 1 1 52 52 THR CA C 52 61.395 61.395 61.201 0.194 25324 5305 1 8 . 1 1 52 52 THR CB C 52 71.734 71.734 70.865 0.869 25324 5306 1 8 . 1 1 52 52 THR H H 52 8.685 8.685 8.592 0.093 25324 5307 1 8 . 1 1 53 53 TYR N N 53 129.086 129.086 125.188 3.898 25324 5308 1 8 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.826 -0.026 25324 5309 1 8 . 1 1 53 53 TYR C C 53 175.214 175.214 176.445 -1.231 25324 5310 1 8 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.565 1.316 25324 5311 1 8 . 1 1 53 53 TYR CB C 53 40.512 40.512 40.060 0.452 25324 5312 1 8 . 1 1 53 53 TYR H H 53 10.112 10.112 8.552 1.560 25324 5313 1 8 . 1 1 54 54 ALA N N 54 119.947 119.947 123.735 -3.788 25324 5314 1 8 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.225 -0.223 25324 5315 1 8 . 1 1 54 54 ALA C C 54 178.285 178.285 177.800 0.485 25324 5316 1 8 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.363 0.608 25324 5317 1 8 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.721 0.996 25324 5318 1 8 . 1 1 54 54 ALA H H 54 8.704 8.704 8.365 0.339 25324 5319 1 8 . 1 1 55 55 GLY N N 55 110.940 110.940 112.155 -1.215 25324 5320 1 8 . 1 1 55 55 GLY C C 55 173.903 173.903 174.535 -0.632 25324 5321 1 8 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.164 -0.148 25324 5322 1 8 . 1 1 55 55 GLY H H 55 8.745 8.745 8.375 0.370 25324 5323 1 8 . 1 1 56 56 GLU N N 56 120.073 120.073 121.204 -1.131 25324 5324 1 8 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.737 -0.028 25324 5325 1 8 . 1 1 56 56 GLU C C 56 175.906 175.906 176.605 -0.699 25324 5326 1 8 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.193 -0.770 25324 5327 1 8 . 1 1 56 56 GLU CB C 56 32.824 32.824 31.627 1.197 25324 5328 1 8 . 1 1 56 56 GLU H H 56 8.039 8.039 7.865 0.174 25324 5329 1 8 . 1 1 57 57 GLY N N 57 105.298 105.298 107.759 -2.461 25324 5330 1 8 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.533 0.269 25324 5331 1 8 . 1 1 57 57 GLY H H 57 7.937 7.937 8.312 -0.375 25324 5332 1 8 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.891 0.043 25324 5333 1 8 . 1 1 58 58 PRO C C 58 177.785 177.785 176.422 1.363 25324 5334 1 8 . 1 1 58 58 PRO CA C 58 63.132 63.132 62.931 0.201 25324 5335 1 8 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.475 -0.635 25324 5336 1 8 . 1 1 59 59 ILE N N 59 117.386 117.386 116.852 0.534 25324 5337 1 8 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.667 0.321 25324 5338 1 8 . 1 1 59 59 ILE C C 59 175.688 175.688 174.938 0.750 25324 5339 1 8 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.182 0.360 25324 5340 1 8 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.274 1.014 25324 5341 1 8 . 1 1 59 59 ILE H H 59 9.600 9.600 8.850 0.750 25324 5342 1 8 . 1 1 60 60 GLY N N 60 107.164 107.164 107.694 -0.530 25324 5343 1 8 . 1 1 60 60 GLY C C 60 173.787 173.787 172.421 1.366 25324 5344 1 8 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.306 1.929 25324 5345 1 8 . 1 1 60 60 GLY H H 60 8.957 8.957 8.802 0.155 25324 5346 1 8 . 1 1 61 61 PHE N N 61 124.597 124.597 125.930 -1.333 25324 5347 1 8 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.606 -0.383 25324 5348 1 8 . 1 1 61 61 PHE C C 61 173.126 173.126 173.225 -0.099 25324 5349 1 8 . 1 1 61 61 PHE CA C 61 56.861 56.861 55.873 0.988 25324 5350 1 8 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.413 -0.196 25324 5351 1 8 . 1 1 61 61 PHE H H 61 8.788 8.788 9.153 -0.365 25324 5352 1 8 . 1 1 62 62 ARG N N 62 129.706 129.706 127.510 2.196 25324 5353 1 8 . 1 1 62 62 ARG HA H 62 5.132 5.132 4.865 0.267 25324 5354 1 8 . 1 1 62 62 ARG C C 62 172.456 172.456 173.090 -0.634 25324 5355 1 8 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.667 1.287 25324 5356 1 8 . 1 1 62 62 ARG CB C 62 32.870 32.870 33.971 -1.101 25324 5357 1 8 . 1 1 62 62 ARG H H 62 8.405 8.405 8.771 -0.366 25324 5358 1 8 . 1 1 63 63 ALA N N 63 122.744 122.744 129.696 -6.952 25324 5359 1 8 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.351 -0.006 25324 5360 1 8 . 1 1 63 63 ALA C C 63 176.120 176.120 175.625 0.495 25324 5361 1 8 . 1 1 63 63 ALA CA C 63 49.919 49.919 49.873 0.046 25324 5362 1 8 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.601 2.172 25324 5363 1 8 . 1 1 63 63 ALA H H 63 8.628 8.628 8.758 -0.131 25324 5364 1 8 . 1 1 64 64 THR N N 64 116.855 116.855 120.185 -3.330 25324 5365 1 8 . 1 1 64 64 THR HA H 64 4.848 4.848 5.003 -0.155 25324 5366 1 8 . 1 1 64 64 THR C C 64 172.957 172.957 173.514 -0.557 25324 5367 1 8 . 1 1 64 64 THR CA C 64 61.211 61.211 61.429 -0.218 25324 5368 1 8 . 1 1 64 64 THR CB C 64 71.064 71.064 71.051 0.013 25324 5369 1 8 . 1 1 64 64 THR H H 64 8.315 8.315 8.687 -0.372 25324 5370 1 8 . 1 1 65 65 LEU N N 65 129.360 129.360 129.758 -0.398 25324 5371 1 8 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.930 -0.568 25324 5372 1 8 . 1 1 65 65 LEU C C 65 176.459 176.459 176.101 0.358 25324 5373 1 8 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.589 1.098 25324 5374 1 8 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.557 -0.846 25324 5375 1 8 . 1 1 65 65 LEU H H 65 8.877 8.877 9.141 -0.264 25324 5376 1 8 . 1 1 66 66 LEU N N 66 128.683 128.683 127.491 1.192 25324 5377 1 8 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.358 0.018 25324 5378 1 8 . 1 1 66 66 LEU C C 66 177.621 177.621 177.367 0.254 25324 5379 1 8 . 1 1 66 66 LEU CA C 66 54.700 54.700 54.840 -0.140 25324 5380 1 8 . 1 1 66 66 LEU CB C 66 42.302 42.302 41.832 0.470 25324 5381 1 8 . 1 1 66 66 LEU H H 66 9.320 9.320 9.038 0.282 25324 5382 1 8 . 1 1 67 67 GLY N N 67 105.361 105.361 107.016 -1.655 25324 5383 1 8 . 1 1 67 67 GLY C C 67 173.618 173.618 173.973 -0.355 25324 5384 1 8 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.166 -1.800 25324 5385 1 8 . 1 1 67 67 GLY H H 67 6.639 6.639 8.166 -1.527 25324 5386 1 8 . 1 1 68 68 ASN N N 68 121.848 121.848 117.691 4.157 25324 5387 1 8 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.799 -0.468 25324 5388 1 8 . 1 1 68 68 ASN C C 68 174.316 174.316 175.292 -0.976 25324 5389 1 8 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.103 3.449 25324 5390 1 8 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.578 -2.413 25324 5391 1 8 . 1 1 68 68 ASN H H 68 9.236 9.236 7.903 1.333 25324 5392 1 8 . 1 1 69 69 ASN N N 69 109.509 109.509 114.485 -4.976 25324 5393 1 8 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.214 -0.134 25324 5394 1 8 . 1 1 69 69 ASN C C 69 171.456 171.456 173.652 -2.196 25324 5395 1 8 . 1 1 69 69 ASN CA C 69 55.750 55.750 55.283 0.467 25324 5396 1 8 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.523 -0.217 25324 5397 1 8 . 1 1 69 69 ASN H H 69 8.651 8.651 8.629 0.022 25324 5398 1 8 . 1 1 70 70 SER N N 70 113.479 113.479 115.405 -1.926 25324 5399 1 8 . 1 1 70 70 SER HA H 70 5.437 5.437 5.118 0.319 25324 5400 1 8 . 1 1 70 70 SER C C 70 173.750 173.750 173.326 0.424 25324 5401 1 8 . 1 1 70 70 SER CA C 70 57.139 57.139 58.807 -1.668 25324 5402 1 8 . 1 1 70 70 SER CB C 70 63.818 63.818 64.276 -0.458 25324 5403 1 8 . 1 1 70 70 SER H H 70 7.693 7.693 7.308 0.385 25324 5404 1 8 . 1 1 71 71 TYR N N 71 123.132 123.132 123.834 -0.702 25324 5405 1 8 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.210 -0.067 25324 5406 1 8 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.453 0.195 25324 5407 1 8 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.101 0.344 25324 5408 1 8 . 1 1 71 71 TYR H H 71 9.326 9.326 9.541 -0.215 25324 5409 1 8 . 1 1 72 72 GLU N N 72 122.396 122.396 123.460 -1.064 25324 5410 1 8 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.804 0.002 25324 5411 1 8 . 1 1 72 72 GLU C C 72 175.698 175.698 175.435 0.263 25324 5412 1 8 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.518 -0.351 25324 5413 1 8 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.523 -1.339 25324 5414 1 8 . 1 1 72 72 GLU H H 72 8.624 8.624 9.163 -0.539 25324 5415 1 8 . 1 1 73 73 VAL N N 73 128.513 128.513 128.262 0.251 25324 5416 1 8 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.729 -0.530 25324 5417 1 8 . 1 1 73 73 VAL C C 73 175.369 175.369 174.901 0.468 25324 5418 1 8 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.279 0.201 25324 5419 1 8 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.572 0.761 25324 5420 1 8 . 1 1 73 73 VAL H H 73 8.564 8.564 9.233 -0.669 25324 5421 1 8 . 1 1 74 74 GLU N N 74 124.842 124.842 127.678 -2.836 25324 5422 1 8 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.111 -0.024 25324 5423 1 8 . 1 1 74 74 GLU C C 74 174.415 174.415 175.229 -0.814 25324 5424 1 8 . 1 1 74 74 GLU CA C 74 54.337 54.337 55.079 -0.742 25324 5425 1 8 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.027 2.130 25324 5426 1 8 . 1 1 74 74 GLU H H 74 9.011 9.011 9.150 -0.139 25324 5427 1 8 . 1 1 75 75 ASN N N 75 116.136 116.136 122.889 -6.753 25324 5428 1 8 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.715 0.424 25324 5429 1 8 . 1 1 75 75 ASN C C 75 172.703 172.703 173.727 -1.024 25324 5430 1 8 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.862 -0.037 25324 5431 1 8 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.480 3.416 25324 5432 1 8 . 1 1 75 75 ASN H H 75 9.424 9.424 9.290 0.134 25324 5433 1 8 . 1 1 76 76 GLN N N 76 120.762 120.762 120.418 0.344 25324 5434 1 8 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.380 -0.340 25324 5435 1 8 . 1 1 76 76 GLN C C 76 173.113 173.113 174.256 -1.143 25324 5436 1 8 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.316 -0.093 25324 5437 1 8 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.060 -0.712 25324 5438 1 8 . 1 1 76 76 GLN H H 76 7.106 7.106 8.927 -1.821 25324 5439 1 8 . 1 1 77 77 TRP N N 77 125.598 125.598 124.579 1.019 25324 5440 1 8 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.128 0.024 25324 5441 1 8 . 1 1 77 77 TRP C C 77 175.502 175.502 176.272 -0.770 25324 5442 1 8 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.553 -0.789 25324 5443 1 8 . 1 1 77 77 TRP CB C 77 29.999 29.999 29.842 0.157 25324 5444 1 8 . 1 1 77 77 TRP H H 77 8.181 8.181 8.082 0.099 25324 5445 1 8 . 1 1 78 78 GLY N N 78 107.901 107.901 109.037 -1.136 25324 5446 1 8 . 1 1 78 78 GLY C C 78 174.611 174.611 174.781 -0.170 25324 5447 1 8 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.482 0.420 25324 5448 1 8 . 1 1 78 78 GLY H H 78 8.778 8.778 8.387 0.391 25324 5449 1 8 . 1 1 79 79 GLY N N 79 109.844 109.844 109.106 0.738 25324 5450 1 8 . 1 1 79 79 GLY C C 79 173.782 173.782 173.565 0.217 25324 5451 1 8 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.424 -0.631 25324 5452 1 8 . 1 1 79 79 GLY H H 79 8.198 8.198 7.424 0.774 25324 5453 1 8 . 1 1 80 80 ASP N N 80 115.837 115.837 120.604 -4.767 25324 5454 1 8 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.410 -0.169 25324 5455 1 8 . 1 1 80 80 ASP C C 80 177.285 177.285 176.487 0.798 25324 5456 1 8 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.879 0.304 25324 5457 1 8 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.123 -0.600 25324 5458 1 8 . 1 1 80 80 ASP H H 80 8.132 8.132 8.523 -0.391 25324 5459 1 8 . 1 1 81 81 SER N N 81 112.690 112.690 114.480 -1.790 25324 5460 1 8 . 1 1 81 81 SER HA H 81 4.513 4.513 4.453 0.060 25324 5461 1 8 . 1 1 81 81 SER C C 81 173.684 173.684 172.659 1.025 25324 5462 1 8 . 1 1 81 81 SER CA C 81 57.232 57.232 58.115 -0.884 25324 5463 1 8 . 1 1 81 81 SER CB C 81 63.170 63.170 64.300 -1.130 25324 5464 1 8 . 1 1 81 81 SER H H 81 8.179 8.179 7.948 0.231 25324 5465 1 8 . 1 1 82 82 ALA N N 82 126.310 126.310 120.964 5.346 25324 5466 1 8 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.162 0.241 25324 5467 1 8 . 1 1 82 82 ALA CA C 82 50.466 50.466 51.508 -1.042 25324 5468 1 8 . 1 1 82 82 ALA CB C 82 18.198 18.198 17.552 0.645 25324 5469 1 8 . 1 1 82 82 ALA H H 82 7.274 7.274 7.933 -0.659 25324 5470 1 8 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.444 -0.071 25324 5471 1 8 . 1 1 83 83 PRO C C 83 175.378 175.378 175.648 -0.270 25324 5472 1 8 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.031 0.296 25324 5473 1 8 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.458 -0.294 25324 5474 1 8 . 1 1 84 84 TRP N N 84 120.106 120.106 117.959 2.147 25324 5475 1 8 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.369 -0.098 25324 5476 1 8 . 1 1 84 84 TRP C C 84 176.358 176.358 176.128 0.230 25324 5477 1 8 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.999 -0.053 25324 5478 1 8 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.776 -1.060 25324 5479 1 8 . 1 1 84 84 TRP H H 84 8.329 8.329 8.085 0.244 25324 5480 1 8 . 1 1 85 85 HIS N N 85 118.543 118.543 120.344 -1.801 25324 5481 1 8 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.915 0.003 25324 5482 1 8 . 1 1 85 85 HIS C C 85 174.950 174.950 174.861 0.089 25324 5483 1 8 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.146 -1.677 25324 5484 1 8 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.347 -1.675 25324 5485 1 8 . 1 1 85 85 HIS H H 85 9.204 9.204 9.116 0.088 25324 5486 1 8 . 1 1 86 86 SER N N 86 117.803 117.803 118.228 -0.425 25324 5487 1 8 . 1 1 86 86 SER HA H 86 4.412 4.412 4.293 0.119 25324 5488 1 8 . 1 1 86 86 SER C C 86 175.691 175.691 175.021 0.670 25324 5489 1 8 . 1 1 86 86 SER CA C 86 60.257 60.257 60.495 -0.238 25324 5490 1 8 . 1 1 86 86 SER CB C 86 63.015 63.015 63.919 -0.904 25324 5491 1 8 . 1 1 86 86 SER H H 86 9.168 9.168 9.102 0.066 25324 5492 1 8 . 1 1 87 87 GLY N N 87 115.773 115.773 111.889 3.884 25324 5493 1 8 . 1 1 87 87 GLY C C 87 174.288 174.288 173.757 0.531 25324 5494 1 8 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.980 -0.279 25324 5495 1 8 . 1 1 87 87 GLY H H 87 9.284 9.284 9.269 0.015 25324 5496 1 8 . 1 1 88 88 GLY N N 88 109.162 109.162 108.609 0.553 25324 5497 1 8 . 1 1 88 88 GLY C C 88 171.120 171.120 171.679 -0.559 25324 5498 1 8 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.297 -0.703 25324 5499 1 8 . 1 1 88 88 GLY H H 88 8.054 8.054 8.057 -0.003 25324 5500 1 8 . 1 1 89 89 ASN N N 89 117.048 117.048 119.678 -2.630 25324 5501 1 8 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.806 0.232 25324 5502 1 8 . 1 1 89 89 ASN C C 89 175.287 175.287 175.019 0.268 25324 5503 1 8 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.252 -1.387 25324 5504 1 8 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.851 -1.246 25324 5505 1 8 . 1 1 89 89 ASN H H 89 8.516 8.516 8.746 -0.230 25324 5506 1 8 . 1 1 90 90 TRP N N 90 125.844 125.844 124.617 1.227 25324 5507 1 8 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.066 0.187 25324 5508 1 8 . 1 1 90 90 TRP C C 90 175.278 175.278 174.949 0.329 25324 5509 1 8 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.588 -0.320 25324 5510 1 8 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.914 0.044 25324 5511 1 8 . 1 1 90 90 TRP H H 90 9.282 9.282 9.386 -0.104 25324 5512 1 8 . 1 1 91 91 ILE N N 91 123.134 123.134 120.817 2.317 25324 5513 1 8 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.031 0.415 25324 5514 1 8 . 1 1 91 91 ILE C C 91 175.489 175.489 175.324 0.165 25324 5515 1 8 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.768 1.058 25324 5516 1 8 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.064 1.612 25324 5517 1 8 . 1 1 91 91 ILE H H 91 9.318 9.318 8.572 0.746 25324 5518 1 8 . 1 1 92 92 LEU N N 92 123.452 123.452 128.963 -5.511 25324 5519 1 8 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.654 0.288 25324 5520 1 8 . 1 1 92 92 LEU C C 92 173.620 173.620 174.148 -0.528 25324 5521 1 8 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.559 -1.304 25324 5522 1 8 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.546 1.962 25324 5523 1 8 . 1 1 92 92 LEU H H 92 8.463 8.463 8.986 -0.523 25324 5524 1 8 . 1 1 93 93 GLY N N 93 103.987 103.987 107.690 -3.703 25324 5525 1 8 . 1 1 93 93 GLY C C 93 172.284 172.284 174.065 -1.781 25324 5526 1 8 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.442 -1.942 25324 5527 1 8 . 1 1 93 93 GLY H H 93 2.937 2.937 6.901 -3.964 25324 5528 1 8 . 1 1 94 94 SER N N 94 110.274 110.274 118.546 -8.272 25324 5529 1 8 . 1 1 94 94 SER HA H 94 4.711 4.711 4.734 -0.023 25324 5530 1 8 . 1 1 94 94 SER C C 94 174.784 174.784 175.110 -0.326 25324 5531 1 8 . 1 1 94 94 SER CA C 94 56.555 56.555 59.371 -2.816 25324 5532 1 8 . 1 1 94 94 SER CB C 94 65.051 65.051 65.050 0.001 25324 5533 1 8 . 1 1 94 94 SER H H 94 7.919 7.919 9.505 -1.586 25324 5534 1 8 . 1 1 95 95 ARG N N 95 123.020 123.020 121.280 1.740 25324 5535 1 8 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.505 0.167 25324 5536 1 8 . 1 1 95 95 ARG C C 95 176.120 176.120 176.895 -0.775 25324 5537 1 8 . 1 1 95 95 ARG CA C 95 55.374 55.374 54.863 0.511 25324 5538 1 8 . 1 1 95 95 ARG CB C 95 31.848 31.848 32.661 -0.813 25324 5539 1 8 . 1 1 95 95 ARG H H 95 9.148 9.148 7.757 1.391 25324 5540 1 8 . 1 1 96 96 GLU N N 96 120.357 120.357 121.283 -0.926 25324 5541 1 8 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.007 0.275 25324 5542 1 8 . 1 1 96 96 GLU C C 96 176.278 176.278 176.464 -0.186 25324 5543 1 8 . 1 1 96 96 GLU CA C 96 56.530 56.530 59.188 -2.658 25324 5544 1 8 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.761 0.392 25324 5545 1 8 . 1 1 96 96 GLU H H 96 8.610 8.610 8.826 -0.216 25324 5546 1 8 . 1 1 97 97 ASN N N 97 117.678 117.678 116.729 0.949 25324 5547 1 8 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.953 -0.341 25324 5548 1 8 . 1 1 97 97 ASN C C 97 173.949 173.949 174.689 -0.740 25324 5549 1 8 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.932 0.083 25324 5550 1 8 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.189 -0.023 25324 5551 1 8 . 1 1 97 97 ASN H H 97 8.533 8.533 8.377 0.156 25324 5552 1 8 . 1 1 98 98 GLN N N 98 118.592 118.592 120.093 -1.501 25324 5553 1 8 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.308 0.052 25324 5554 1 8 . 1 1 98 98 GLN C C 98 173.116 173.116 175.065 -1.949 25324 5555 1 8 . 1 1 98 98 GLN CA C 98 55.628 55.628 56.628 -1.000 25324 5556 1 8 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.439 0.430 25324 5557 1 8 . 1 1 98 98 GLN H H 98 7.663 7.663 7.851 -0.188 25324 5558 1 8 . 1 1 99 99 ASN N N 99 122.855 122.855 115.758 7.097 25324 5559 1 8 . 1 1 99 99 ASN HA H 99 5.135 5.135 4.508 0.627 25324 5560 1 8 . 1 1 99 99 ASN C C 99 175.287 175.287 174.246 1.041 25324 5561 1 8 . 1 1 99 99 ASN CA C 99 52.990 52.990 54.267 -1.277 25324 5562 1 8 . 1 1 99 99 ASN CB C 99 40.491 40.491 38.131 2.360 25324 5563 1 8 . 1 1 99 99 ASN H H 99 8.759 8.759 8.303 0.456 25324 5564 1 8 . 1 1 100 100 VAL N N 100 121.385 121.385 121.157 0.228 25324 5565 1 8 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.926 -0.178 25324 5566 1 8 . 1 1 100 100 VAL C C 100 174.956 174.956 176.352 -1.396 25324 5567 1 8 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.486 0.357 25324 5568 1 8 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.281 1.162 25324 5569 1 8 . 1 1 100 100 VAL H H 100 8.717 8.717 8.117 0.600 25324 5570 1 8 . 1 1 101 101 VAL N N 101 112.736 112.736 122.172 -9.436 25324 5571 1 8 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.427 0.218 25324 5572 1 8 . 1 1 101 101 VAL C C 101 175.577 175.577 174.561 1.016 25324 5573 1 8 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.950 -1.987 25324 5574 1 8 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.589 -0.548 25324 5575 1 8 . 1 1 101 101 VAL H H 101 8.802 8.802 8.747 0.055 25324 5576 1 8 . 1 1 102 102 ALA N N 102 122.104 122.104 120.570 1.534 25324 5577 1 8 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.060 -0.253 25324 5578 1 8 . 1 1 102 102 ALA C C 102 176.046 176.046 174.916 1.130 25324 5579 1 8 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.980 2.274 25324 5580 1 8 . 1 1 102 102 ALA CB C 102 21.625 21.625 21.981 -0.356 25324 5581 1 8 . 1 1 102 102 ALA H H 102 7.677 7.677 7.753 -0.076 25324 5582 1 8 . 1 1 103 103 ILE N N 103 118.218 118.218 121.996 -3.778 25324 5583 1 8 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.333 -0.306 25324 5584 1 8 . 1 1 103 103 ILE C C 103 173.118 173.118 173.887 -0.769 25324 5585 1 8 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.515 1.712 25324 5586 1 8 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.620 0.851 25324 5587 1 8 . 1 1 103 103 ILE H H 103 8.102 8.102 8.505 -0.403 25324 5588 1 8 . 1 1 104 104 ASN N N 104 125.938 125.938 126.812 -0.874 25324 5589 1 8 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.414 0.272 25324 5590 1 8 . 1 1 104 104 ASN C C 104 174.870 174.870 173.596 1.274 25324 5591 1 8 . 1 1 104 104 ASN CA C 104 52.553 52.553 51.981 0.572 25324 5592 1 8 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.221 -1.369 25324 5593 1 8 . 1 1 104 104 ASN H H 104 8.668 8.668 9.020 -0.352 25324 5594 1 8 . 1 1 105 105 VAL N N 105 114.631 114.631 119.918 -5.287 25324 5595 1 8 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.062 0.143 25324 5596 1 8 . 1 1 105 105 VAL C C 105 174.788 174.788 173.442 1.346 25324 5597 1 8 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.151 -2.172 25324 5598 1 8 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.671 0.369 25324 5599 1 8 . 1 1 105 105 VAL H H 105 8.933 8.933 8.906 0.027 25324 5600 1 8 . 1 1 106 106 GLU N N 106 118.347 118.347 125.329 -6.982 25324 5601 1 8 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.249 -0.169 25324 5602 1 8 . 1 1 106 106 GLU C C 106 174.777 174.777 174.787 -0.010 25324 5603 1 8 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.885 0.082 25324 5604 1 8 . 1 1 106 106 GLU CB C 106 33.643 33.643 33.656 -0.013 25324 5605 1 8 . 1 1 106 106 GLU H H 106 8.814 8.814 8.941 -0.127 25324 5606 1 8 . 1 1 107 107 SER N N 107 115.335 115.335 121.672 -6.337 25324 5607 1 8 . 1 1 107 107 SER HA H 107 5.266 5.266 4.839 0.427 25324 5608 1 8 . 1 1 107 107 SER C C 107 175.787 175.787 173.099 2.688 25324 5609 1 8 . 1 1 107 107 SER CA C 107 55.888 55.888 57.389 -1.501 25324 5610 1 8 . 1 1 107 107 SER CB C 107 65.921 65.921 66.054 -0.133 25324 5611 1 8 . 1 1 107 107 SER H H 107 8.576 8.576 8.821 -0.245 25324 5612 1 8 . 1 1 108 108 GLY N N 108 117.567 117.567 108.146 9.421 25324 5613 1 8 . 1 1 108 108 GLY C C 108 173.959 173.959 174.317 -0.358 25324 5614 1 8 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.370 -0.693 25324 5615 1 8 . 1 1 108 108 GLY H H 108 9.532 9.532 8.753 0.779 25324 5616 1 8 . 1 1 109 109 ASP N N 109 122.108 122.108 120.266 1.842 25324 5617 1 8 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.652 0.149 25324 5618 1 8 . 1 1 109 109 ASP C C 109 176.203 176.203 175.901 0.302 25324 5619 1 8 . 1 1 109 109 ASP CA C 109 52.134 52.134 53.035 -0.901 25324 5620 1 8 . 1 1 109 109 ASP CB C 109 39.342 39.342 40.957 -1.615 25324 5621 1 8 . 1 1 109 109 ASP H H 109 8.605 8.605 8.064 0.541 25324 5622 1 8 . 1 1 110 110 ASP N N 110 116.197 116.197 118.661 -2.464 25324 5623 1 8 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.381 -0.159 25324 5624 1 8 . 1 1 110 110 ASP C C 110 175.951 175.951 175.608 0.343 25324 5625 1 8 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.467 -0.269 25324 5626 1 8 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.195 -1.565 25324 5627 1 8 . 1 1 110 110 ASP H H 110 9.087 9.087 8.472 0.615 25324 5628 1 8 . 1 1 111 111 GLY N N 111 103.841 103.841 103.680 0.161 25324 5629 1 8 . 1 1 111 111 GLY C C 111 173.924 173.924 174.962 -1.038 25324 5630 1 8 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.478 -0.315 25324 5631 1 8 . 1 1 111 111 GLY H H 111 8.930 8.930 8.427 0.503 25324 5632 1 8 . 1 1 112 112 GLN N N 112 121.626 121.626 117.942 3.684 25324 5633 1 8 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.142 -0.072 25324 5634 1 8 . 1 1 112 112 GLN C C 112 176.431 176.431 175.459 0.972 25324 5635 1 8 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.129 0.144 25324 5636 1 8 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.421 -1.728 25324 5637 1 8 . 1 1 112 112 GLN H H 112 7.351 7.351 8.173 -0.822 25324 5638 1 8 . 1 1 113 113 THR N N 113 112.322 112.322 111.293 1.029 25324 5639 1 8 . 1 1 113 113 THR HA H 113 5.331 5.331 5.312 0.019 25324 5640 1 8 . 1 1 113 113 THR C C 113 174.452 174.452 173.931 0.521 25324 5641 1 8 . 1 1 113 113 THR CA C 113 59.739 59.739 60.300 -0.561 25324 5642 1 8 . 1 1 113 113 THR CB C 113 71.773 71.773 70.050 1.723 25324 5643 1 8 . 1 1 113 113 THR H H 113 10.053 10.053 8.452 1.601 25324 5644 1 8 . 1 1 114 114 LEU N N 114 122.083 122.083 128.236 -6.153 25324 5645 1 8 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.527 0.054 25324 5646 1 8 . 1 1 114 114 LEU C C 114 175.113 175.113 175.511 -0.398 25324 5647 1 8 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.444 -1.539 25324 5648 1 8 . 1 1 114 114 LEU CB C 114 47.033 47.033 41.874 5.159 25324 5649 1 8 . 1 1 114 114 LEU H H 114 8.978 8.978 8.943 0.035 25324 5650 1 8 . 1 1 115 115 ASN N N 115 118.846 118.846 122.284 -3.438 25324 5651 1 8 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.796 -0.026 25324 5652 1 8 . 1 1 115 115 ASN C C 115 174.788 174.788 175.267 -0.479 25324 5653 1 8 . 1 1 115 115 ASN CA C 115 52.342 52.342 52.222 0.120 25324 5654 1 8 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.213 1.201 25324 5655 1 8 . 1 1 115 115 ASN H H 115 8.837 8.837 7.884 0.953 25324 5656 1 8 . 1 1 116 116 GLY N N 116 109.661 109.661 109.122 0.539 25324 5657 1 8 . 1 1 116 116 GLY C C 116 172.452 172.452 172.488 -0.036 25324 5658 1 8 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.197 0.274 25324 5659 1 8 . 1 1 116 116 GLY H H 116 8.625 8.625 8.963 -0.338 25324 5660 1 8 . 1 1 117 117 THR N N 117 120.009 120.009 113.377 6.632 25324 5661 1 8 . 1 1 117 117 THR HA H 117 5.556 5.556 5.612 -0.056 25324 5662 1 8 . 1 1 117 117 THR C C 117 171.619 171.619 173.238 -1.619 25324 5663 1 8 . 1 1 117 117 THR CA C 117 59.373 59.373 60.227 -0.854 25324 5664 1 8 . 1 1 117 117 THR CB C 117 72.777 72.777 72.622 0.155 25324 5665 1 8 . 1 1 117 117 THR H H 117 8.911 8.911 9.075 -0.164 25324 5666 1 8 . 1 1 118 118 MET N N 118 115.550 115.550 117.146 -1.596 25324 5667 1 8 . 1 1 118 118 MET HA H 118 4.889 4.889 5.307 -0.418 25324 5668 1 8 . 1 1 118 118 MET C C 118 172.707 172.707 173.860 -1.153 25324 5669 1 8 . 1 1 118 118 MET CA C 118 54.714 54.714 54.761 -0.047 25324 5670 1 8 . 1 1 118 118 MET CB C 118 33.663 33.663 37.378 -3.715 25324 5671 1 8 . 1 1 118 118 MET H H 118 9.159 9.159 9.465 -0.306 25324 5672 1 8 . 1 1 119 119 THR N N 119 113.716 113.716 115.040 -1.324 25324 5673 1 8 . 1 1 119 119 THR HA H 119 4.682 4.682 4.843 -0.161 25324 5674 1 8 . 1 1 119 119 THR C C 119 173.952 173.952 173.198 0.754 25324 5675 1 8 . 1 1 119 119 THR CA C 119 61.395 61.395 61.805 -0.410 25324 5676 1 8 . 1 1 119 119 THR CB C 119 71.746 71.746 71.948 -0.202 25324 5677 1 8 . 1 1 119 119 THR H H 119 8.685 8.685 8.780 -0.095 25324 5678 1 8 . 1 1 120 120 TYR N N 120 129.153 129.153 125.899 3.254 25324 5679 1 8 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.950 -0.150 25324 5680 1 8 . 1 1 120 120 TYR C C 120 175.214 175.214 175.755 -0.541 25324 5681 1 8 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.667 1.210 25324 5682 1 8 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.871 -0.369 25324 5683 1 8 . 1 1 120 120 TYR H H 120 10.107 10.107 8.931 1.176 25324 5684 1 8 . 1 1 121 121 ALA N N 121 119.947 119.947 124.183 -4.236 25324 5685 1 8 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.311 -0.307 25324 5686 1 8 . 1 1 121 121 ALA C C 121 178.456 178.456 177.887 0.569 25324 5687 1 8 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.707 0.249 25324 5688 1 8 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.903 -0.193 25324 5689 1 8 . 1 1 121 121 ALA H H 121 8.704 8.704 8.325 0.379 25324 5690 1 8 . 1 1 122 122 GLY N N 122 111.186 111.186 110.498 0.688 25324 5691 1 8 . 1 1 122 122 GLY C C 122 173.949 173.949 173.976 -0.027 25324 5692 1 8 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.485 -0.483 25324 5693 1 8 . 1 1 122 122 GLY H H 122 8.792 8.792 8.662 0.130 25324 5694 1 8 . 1 1 123 123 GLU N N 123 120.099 120.099 119.372 0.727 25324 5695 1 8 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.566 0.140 25324 5696 1 8 . 1 1 123 123 GLU C C 123 175.912 175.912 175.839 0.073 25324 5697 1 8 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.746 -0.332 25324 5698 1 8 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.546 0.238 25324 5699 1 8 . 1 1 123 123 GLU H H 123 8.072 8.072 7.811 0.261 25324 5700 1 8 . 1 1 124 124 GLY N N 124 105.303 105.303 110.042 -4.739 25324 5701 1 8 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.973 -0.171 25324 5702 1 8 . 1 1 124 124 GLY H H 124 7.939 7.939 8.411 -0.472 25324 5703 1 8 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.848 0.087 25324 5704 1 8 . 1 1 125 125 PRO C C 125 177.788 177.788 176.385 1.403 25324 5705 1 8 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.118 0.013 25324 5706 1 8 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.404 -0.545 25324 5707 1 8 . 1 1 126 126 ILE N N 126 117.387 117.387 116.933 0.454 25324 5708 1 8 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.739 0.160 25324 5709 1 8 . 1 1 126 126 ILE C C 126 175.625 175.625 175.034 0.591 25324 5710 1 8 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.185 0.268 25324 5711 1 8 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.727 0.821 25324 5712 1 8 . 1 1 126 126 ILE H H 126 9.599 9.599 8.925 0.674 25324 5713 1 8 . 1 1 127 127 GLY N N 127 106.753 106.753 108.923 -2.170 25324 5714 1 8 . 1 1 127 127 GLY C C 127 173.627 173.627 172.960 0.667 25324 5715 1 8 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.609 1.674 25324 5716 1 8 . 1 1 127 127 GLY H H 127 8.840 8.840 8.724 0.116 25324 5717 1 8 . 1 1 128 128 PHE N N 128 124.826 124.826 125.922 -1.096 25324 5718 1 8 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.189 -0.245 25324 5719 1 8 . 1 1 128 128 PHE C C 128 173.087 173.087 173.286 -0.199 25324 5720 1 8 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.941 0.068 25324 5721 1 8 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.535 -0.375 25324 5722 1 8 . 1 1 128 128 PHE H H 128 8.924 8.924 9.234 -0.310 25324 5723 1 8 . 1 1 129 129 LYS N N 129 131.518 131.518 128.325 3.193 25324 5724 1 8 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.798 0.085 25324 5725 1 8 . 1 1 129 129 LYS C C 129 173.863 173.863 174.323 -0.460 25324 5726 1 8 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.447 1.288 25324 5727 1 8 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.072 -0.351 25324 5728 1 8 . 1 1 129 129 LYS H H 129 8.201 8.201 8.286 -0.085 25324 5729 1 8 . 1 1 130 130 GLY N N 130 114.030 114.030 113.919 0.111 25324 5730 1 8 . 1 1 130 130 GLY C C 130 171.951 171.951 172.792 -0.841 25324 5731 1 8 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.756 0.031 25324 5732 1 8 . 1 1 130 130 GLY H H 130 9.325 9.325 8.894 0.431 25324 5733 1 8 . 1 1 131 131 THR N N 131 120.583 120.583 122.322 -1.739 25324 5734 1 8 . 1 1 131 131 THR HA H 131 4.939 4.939 5.020 -0.081 25324 5735 1 8 . 1 1 131 131 THR C C 131 173.118 173.118 173.658 -0.540 25324 5736 1 8 . 1 1 131 131 THR CA C 131 61.266 61.266 61.238 0.028 25324 5737 1 8 . 1 1 131 131 THR CB C 131 70.392 70.392 71.580 -1.188 25324 5738 1 8 . 1 1 131 131 THR H H 131 8.916 8.916 8.924 -0.008 25324 5739 1 8 . 1 1 132 132 LEU N N 132 130.774 130.774 128.999 1.775 25324 5740 1 8 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.490 0.010 25324 5741 1 8 . 1 1 132 132 LEU C C 132 176.574 176.574 175.501 1.073 25324 5742 1 8 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.007 1.181 25324 5743 1 8 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.853 0.594 25324 5744 1 8 . 1 1 132 132 LEU H H 132 8.527 8.527 8.688 -0.161 25324 5745 1 9 . 1 1 3 3 LEU N N 3 123.202 123.202 120.279 2.923 25324 5746 1 9 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.963 0.194 25324 5747 1 9 . 1 1 3 3 LEU C C 3 175.786 175.786 174.356 1.430 25324 5748 1 9 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.759 -0.475 25324 5749 1 9 . 1 1 3 3 LEU CB C 3 43.330 43.330 44.394 -1.064 25324 5750 1 9 . 1 1 3 3 LEU H H 3 8.711 8.711 8.209 0.502 25324 5751 1 9 . 1 1 4 4 TYR N N 4 120.906 120.906 124.268 -3.362 25324 5752 1 9 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.172 -0.148 25324 5753 1 9 . 1 1 4 4 TYR C C 4 175.953 175.953 175.108 0.845 25324 5754 1 9 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.286 0.091 25324 5755 1 9 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.353 -0.698 25324 5756 1 9 . 1 1 4 4 TYR H H 4 9.142 9.142 9.374 -0.232 25324 5757 1 9 . 1 1 5 5 ASN N N 5 120.496 120.496 120.399 0.097 25324 5758 1 9 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.967 0.149 25324 5759 1 9 . 1 1 5 5 ASN C C 5 174.953 174.953 174.041 0.912 25324 5760 1 9 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.489 -0.542 25324 5761 1 9 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.590 -1.699 25324 5762 1 9 . 1 1 5 5 ASN H H 5 8.787 8.787 8.926 -0.139 25324 5763 1 9 . 1 1 6 6 VAL N N 6 127.428 127.428 123.839 3.589 25324 5764 1 9 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.176 0.186 25324 5765 1 9 . 1 1 6 6 VAL C C 6 174.955 174.955 174.571 0.384 25324 5766 1 9 . 1 1 6 6 VAL CA C 6 61.433 61.433 62.039 -0.606 25324 5767 1 9 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.181 1.150 25324 5768 1 9 . 1 1 6 6 VAL H H 6 8.806 8.806 8.099 0.707 25324 5769 1 9 . 1 1 7 7 GLU N N 7 124.355 124.355 128.256 -3.901 25324 5770 1 9 . 1 1 7 7 GLU HA H 7 4.982 4.982 5.067 -0.085 25324 5771 1 9 . 1 1 7 7 GLU C C 7 174.551 174.551 175.145 -0.594 25324 5772 1 9 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.899 -1.110 25324 5773 1 9 . 1 1 7 7 GLU CB C 7 34.567 34.567 31.878 2.688 25324 5774 1 9 . 1 1 7 7 GLU H H 7 8.800 8.800 9.032 -0.232 25324 5775 1 9 . 1 1 8 8 ASN N N 8 116.231 116.231 123.641 -7.410 25324 5776 1 9 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.845 0.196 25324 5777 1 9 . 1 1 8 8 ASN C C 8 172.709 172.709 173.488 -0.779 25324 5778 1 9 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.346 -0.729 25324 5779 1 9 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.660 2.925 25324 5780 1 9 . 1 1 8 8 ASN H H 8 9.320 9.320 9.349 -0.029 25324 5781 1 9 . 1 1 9 9 GLN N N 9 120.762 120.762 123.670 -2.908 25324 5782 1 9 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.189 -0.015 25324 5783 1 9 . 1 1 9 9 GLN C C 9 173.454 173.454 173.553 -0.099 25324 5784 1 9 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.151 -0.191 25324 5785 1 9 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.629 -0.938 25324 5786 1 9 . 1 1 9 9 GLN H H 9 6.887 6.887 8.462 -1.575 25324 5787 1 9 . 1 1 10 10 TRP N N 10 127.775 127.775 124.692 3.083 25324 5788 1 9 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.057 -0.069 25324 5789 1 9 . 1 1 10 10 TRP C C 10 175.281 175.281 175.605 -0.324 25324 5790 1 9 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.759 -0.466 25324 5791 1 9 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.871 -1.129 25324 5792 1 9 . 1 1 10 10 TRP H H 10 8.518 8.518 8.043 0.475 25324 5793 1 9 . 1 1 11 11 GLY N N 11 107.838 107.838 109.515 -1.677 25324 5794 1 9 . 1 1 11 11 GLY C C 11 174.733 174.733 174.616 0.117 25324 5795 1 9 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.775 0.061 25324 5796 1 9 . 1 1 11 11 GLY H H 11 8.461 8.461 8.773 -0.312 25324 5797 1 9 . 1 1 12 12 GLY N N 12 109.696 109.696 107.414 2.282 25324 5798 1 9 . 1 1 12 12 GLY C C 12 174.133 174.133 174.307 -0.174 25324 5799 1 9 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.375 -0.586 25324 5800 1 9 . 1 1 12 12 GLY H H 12 8.138 8.138 7.397 0.741 25324 5801 1 9 . 1 1 13 13 SER N N 13 111.308 111.308 115.320 -4.012 25324 5802 1 9 . 1 1 13 13 SER HA H 13 4.092 4.092 4.293 -0.201 25324 5803 1 9 . 1 1 13 13 SER C C 13 175.622 175.622 175.207 0.415 25324 5804 1 9 . 1 1 13 13 SER CA C 13 60.494 60.494 59.873 0.621 25324 5805 1 9 . 1 1 13 13 SER CB C 13 63.028 63.028 63.406 -0.378 25324 5806 1 9 . 1 1 13 13 SER H H 13 8.215 8.215 8.643 -0.428 25324 5807 1 9 . 1 1 14 14 SER N N 14 115.290 115.290 115.189 0.101 25324 5808 1 9 . 1 1 14 14 SER HA H 14 4.566 4.566 4.432 0.134 25324 5809 1 9 . 1 1 14 14 SER C C 14 173.532 173.532 173.891 -0.359 25324 5810 1 9 . 1 1 14 14 SER CA C 14 57.317 57.317 58.992 -1.675 25324 5811 1 9 . 1 1 14 14 SER CB C 14 63.230 63.230 63.275 -0.045 25324 5812 1 9 . 1 1 14 14 SER H H 14 8.213 8.213 8.117 0.096 25324 5813 1 9 . 1 1 15 15 ALA N N 15 126.470 126.470 125.683 0.787 25324 5814 1 9 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.582 -0.179 25324 5815 1 9 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.641 0.823 25324 5816 1 9 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.559 -0.330 25324 5817 1 9 . 1 1 15 15 ALA H H 15 7.308 7.308 7.501 -0.193 25324 5818 1 9 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.376 0.033 25324 5819 1 9 . 1 1 16 16 PRO C C 16 175.627 175.627 175.472 0.155 25324 5820 1 9 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.321 0.071 25324 5821 1 9 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.681 -0.544 25324 5822 1 9 . 1 1 17 17 TRP N N 17 120.228 120.228 119.614 0.614 25324 5823 1 9 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.546 -0.228 25324 5824 1 9 . 1 1 17 17 TRP C C 17 175.951 175.951 176.176 -0.225 25324 5825 1 9 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.936 -0.021 25324 5826 1 9 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.579 -1.171 25324 5827 1 9 . 1 1 17 17 TRP H H 17 8.380 8.380 8.222 0.158 25324 5828 1 9 . 1 1 18 18 ASN N N 18 120.663 120.663 121.595 -0.932 25324 5829 1 9 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.064 0.022 25324 5830 1 9 . 1 1 18 18 ASN C C 18 174.793 174.793 173.851 0.942 25324 5831 1 9 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.426 -0.825 25324 5832 1 9 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.473 1.175 25324 5833 1 9 . 1 1 18 18 ASN H H 18 9.094 9.094 8.844 0.250 25324 5834 1 9 . 1 1 19 19 GLU N N 19 122.202 122.202 121.894 0.308 25324 5835 1 9 . 1 1 19 19 GLU HA H 19 4.139 4.139 5.422 -1.283 25324 5836 1 9 . 1 1 19 19 GLU C C 19 176.869 176.869 176.249 0.620 25324 5837 1 9 . 1 1 19 19 GLU CA C 19 58.600 58.600 55.075 3.525 25324 5838 1 9 . 1 1 19 19 GLU CB C 19 29.382 29.382 31.104 -1.722 25324 5839 1 9 . 1 1 19 19 GLU H H 19 9.013 9.013 8.691 0.322 25324 5840 1 9 . 1 1 20 20 GLY N N 20 112.893 112.893 112.267 0.626 25324 5841 1 9 . 1 1 20 20 GLY C C 20 174.878 174.878 173.107 1.771 25324 5842 1 9 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.959 0.036 25324 5843 1 9 . 1 1 20 20 GLY H H 20 8.926 8.926 8.740 0.186 25324 5844 1 9 . 1 1 21 21 GLY N N 21 110.354 110.354 107.079 3.275 25324 5845 1 9 . 1 1 21 21 GLY C C 21 171.623 171.623 171.826 -0.203 25324 5846 1 9 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.479 -1.081 25324 5847 1 9 . 1 1 21 21 GLY H H 21 8.258 8.258 7.881 0.377 25324 5848 1 9 . 1 1 22 22 GLN N N 22 117.541 117.541 117.510 0.031 25324 5849 1 9 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.113 0.564 25324 5850 1 9 . 1 1 22 22 GLN C C 22 175.957 175.957 174.439 1.518 25324 5851 1 9 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.675 0.269 25324 5852 1 9 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.214 -1.129 25324 5853 1 9 . 1 1 22 22 GLN H H 22 8.564 8.564 8.577 -0.013 25324 5854 1 9 . 1 1 23 23 TRP N N 23 127.208 127.208 123.386 3.822 25324 5855 1 9 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.012 0.187 25324 5856 1 9 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.288 0.243 25324 5857 1 9 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.144 -0.461 25324 5858 1 9 . 1 1 23 23 TRP H H 23 9.347 9.347 9.032 0.315 25324 5859 1 9 . 1 1 24 24 GLU N N 24 123.504 123.504 121.652 1.852 25324 5860 1 9 . 1 1 24 24 GLU HA H 24 5.508 5.508 4.881 0.627 25324 5861 1 9 . 1 1 24 24 GLU C C 24 174.222 174.222 174.923 -0.701 25324 5862 1 9 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.066 0.525 25324 5863 1 9 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.545 -0.930 25324 5864 1 9 . 1 1 24 24 GLU H H 24 9.296 9.296 8.585 0.711 25324 5865 1 9 . 1 1 25 25 ILE N N 25 123.447 123.447 126.177 -2.730 25324 5866 1 9 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.489 -0.053 25324 5867 1 9 . 1 1 25 25 ILE C C 25 175.790 175.790 174.833 0.957 25324 5868 1 9 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.127 -0.500 25324 5869 1 9 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.648 0.304 25324 5870 1 9 . 1 1 25 25 ILE H H 25 8.635 8.635 8.235 0.400 25324 5871 1 9 . 1 1 26 26 GLY N N 26 111.544 111.544 113.638 -2.094 25324 5872 1 9 . 1 1 26 26 GLY C C 26 172.122 172.122 174.613 -2.491 25324 5873 1 9 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.708 -0.630 25324 5874 1 9 . 1 1 26 26 GLY H H 26 3.381 3.381 6.896 -3.515 25324 5875 1 9 . 1 1 27 27 SER N N 27 112.279 112.279 116.773 -4.494 25324 5876 1 9 . 1 1 27 27 SER HA H 27 4.876 4.876 4.524 0.352 25324 5877 1 9 . 1 1 27 27 SER C C 27 174.113 174.113 174.636 -0.523 25324 5878 1 9 . 1 1 27 27 SER CA C 27 56.954 56.954 58.843 -1.889 25324 5879 1 9 . 1 1 27 27 SER CB C 27 64.554 64.554 64.227 0.327 25324 5880 1 9 . 1 1 27 27 SER H H 27 8.212 8.212 8.901 -0.689 25324 5881 1 9 . 1 1 28 28 ARG N N 28 120.872 120.872 122.031 -1.159 25324 5882 1 9 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.736 0.027 25324 5883 1 9 . 1 1 28 28 ARG C C 28 176.119 176.119 175.430 0.689 25324 5884 1 9 . 1 1 28 28 ARG CA C 28 55.117 55.117 54.750 0.367 25324 5885 1 9 . 1 1 28 28 ARG CB C 28 31.830 31.830 31.806 0.024 25324 5886 1 9 . 1 1 28 28 ARG H H 28 7.849 7.849 8.170 -0.321 25324 5887 1 9 . 1 1 29 29 SER N N 29 118.985 118.985 118.566 0.419 25324 5888 1 9 . 1 1 29 29 SER HA H 29 4.192 4.192 4.302 -0.110 25324 5889 1 9 . 1 1 29 29 SER C C 29 174.622 174.622 175.083 -0.461 25324 5890 1 9 . 1 1 29 29 SER CA C 29 60.072 60.072 60.547 -0.475 25324 5891 1 9 . 1 1 29 29 SER CB C 29 62.876 62.876 63.402 -0.526 25324 5892 1 9 . 1 1 29 29 SER H H 29 8.892 8.892 8.835 0.057 25324 5893 1 9 . 1 1 30 30 ASP N N 30 117.632 117.632 119.989 -2.357 25324 5894 1 9 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.632 -0.014 25324 5895 1 9 . 1 1 30 30 ASP C C 30 175.101 175.101 176.564 -1.463 25324 5896 1 9 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.461 -2.409 25324 5897 1 9 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.018 -0.495 25324 5898 1 9 . 1 1 30 30 ASP H H 30 8.441 8.441 8.298 0.143 25324 5899 1 9 . 1 1 31 31 GLN N N 31 118.273 118.273 118.416 -0.143 25324 5900 1 9 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.507 -0.022 25324 5901 1 9 . 1 1 31 31 GLN C C 31 173.453 173.453 174.498 -1.045 25324 5902 1 9 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.660 0.208 25324 5903 1 9 . 1 1 31 31 GLN CB C 31 33.249 33.249 29.177 4.072 25324 5904 1 9 . 1 1 31 31 GLN H H 31 7.029 7.029 7.987 -0.958 25324 5905 1 9 . 1 1 32 32 ASN N N 32 120.865 120.865 120.798 0.067 25324 5906 1 9 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.990 0.130 25324 5907 1 9 . 1 1 32 32 ASN C C 32 175.198 175.198 174.515 0.683 25324 5908 1 9 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.559 -0.690 25324 5909 1 9 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.318 -0.688 25324 5910 1 9 . 1 1 32 32 ASN H H 32 8.713 8.713 8.734 -0.021 25324 5911 1 9 . 1 1 33 33 VAL N N 33 122.111 122.111 121.052 1.059 25324 5912 1 9 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.168 -0.463 25324 5913 1 9 . 1 1 33 33 VAL C C 33 174.950 174.950 175.962 -1.012 25324 5914 1 9 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.715 1.132 25324 5915 1 9 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.668 0.682 25324 5916 1 9 . 1 1 33 33 VAL H H 33 8.542 8.542 8.763 -0.221 25324 5917 1 9 . 1 1 34 34 VAL N N 34 113.282 113.282 119.543 -6.261 25324 5918 1 9 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.400 0.245 25324 5919 1 9 . 1 1 34 34 VAL C C 34 175.574 175.574 174.225 1.349 25324 5920 1 9 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.121 -1.147 25324 5921 1 9 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.888 0.141 25324 5922 1 9 . 1 1 34 34 VAL H H 34 8.744 8.744 9.000 -0.256 25324 5923 1 9 . 1 1 35 35 ALA N N 35 122.102 122.102 120.517 1.585 25324 5924 1 9 . 1 1 35 35 ALA HA H 35 4.803 4.803 4.975 -0.172 25324 5925 1 9 . 1 1 35 35 ALA C C 35 175.947 175.947 175.063 0.884 25324 5926 1 9 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.296 1.954 25324 5927 1 9 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.165 -0.537 25324 5928 1 9 . 1 1 35 35 ALA H H 35 7.677 7.677 7.721 -0.044 25324 5929 1 9 . 1 1 36 36 ILE N N 36 118.005 118.005 121.595 -3.590 25324 5930 1 9 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.269 -0.241 25324 5931 1 9 . 1 1 36 36 ILE C C 36 173.116 173.116 173.801 -0.685 25324 5932 1 9 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.252 0.930 25324 5933 1 9 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.307 1.178 25324 5934 1 9 . 1 1 36 36 ILE H H 36 8.126 8.126 8.930 -0.804 25324 5935 1 9 . 1 1 37 37 ASN N N 37 125.632 125.632 126.579 -0.947 25324 5936 1 9 . 1 1 37 37 ASN HA H 37 5.681 5.681 6.085 -0.404 25324 5937 1 9 . 1 1 37 37 ASN C C 37 174.854 174.854 173.839 1.015 25324 5938 1 9 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.177 0.353 25324 5939 1 9 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.745 -2.892 25324 5940 1 9 . 1 1 37 37 ASN H H 37 8.577 8.577 8.828 -0.251 25324 5941 1 9 . 1 1 38 38 VAL N N 38 114.223 114.223 118.712 -4.489 25324 5942 1 9 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.902 0.301 25324 5943 1 9 . 1 1 38 38 VAL C C 38 174.854 174.854 173.465 1.389 25324 5944 1 9 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.147 -2.167 25324 5945 1 9 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.810 0.234 25324 5946 1 9 . 1 1 38 38 VAL H H 38 8.874 8.874 8.823 0.051 25324 5947 1 9 . 1 1 39 39 GLU N N 39 118.277 118.277 122.020 -3.743 25324 5948 1 9 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.253 -0.171 25324 5949 1 9 . 1 1 39 39 GLU C C 39 174.548 174.548 175.515 -0.967 25324 5950 1 9 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.874 1.119 25324 5951 1 9 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.278 -0.700 25324 5952 1 9 . 1 1 39 39 GLU H H 39 8.761 8.761 9.284 -0.523 25324 5953 1 9 . 1 1 40 40 SER N N 40 114.960 114.960 120.585 -5.625 25324 5954 1 9 . 1 1 40 40 SER HA H 40 5.265 5.265 4.959 0.306 25324 5955 1 9 . 1 1 40 40 SER C C 40 175.783 175.783 175.442 0.341 25324 5956 1 9 . 1 1 40 40 SER CA C 40 55.880 55.880 57.932 -2.052 25324 5957 1 9 . 1 1 40 40 SER CB C 40 65.911 65.911 63.901 2.010 25324 5958 1 9 . 1 1 40 40 SER H H 40 8.500 8.500 8.695 -0.195 25324 5959 1 9 . 1 1 41 41 GLY N N 41 117.567 117.567 109.696 7.871 25324 5960 1 9 . 1 1 41 41 GLY C C 41 174.119 174.119 174.136 -0.017 25324 5961 1 9 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.253 -0.565 25324 5962 1 9 . 1 1 41 41 GLY H H 41 9.533 9.533 9.026 0.507 25324 5963 1 9 . 1 1 42 42 ASP N N 42 122.141 122.141 119.495 2.646 25324 5964 1 9 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.906 -0.106 25324 5965 1 9 . 1 1 42 42 ASP C C 42 176.121 176.121 175.884 0.237 25324 5966 1 9 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.322 -1.176 25324 5967 1 9 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.834 -3.481 25324 5968 1 9 . 1 1 42 42 ASP H H 42 8.644 8.644 7.570 1.074 25324 5969 1 9 . 1 1 43 43 ASP N N 43 116.025 116.025 121.432 -5.407 25324 5970 1 9 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.533 -0.304 25324 5971 1 9 . 1 1 43 43 ASP C C 43 176.018 176.018 176.542 -0.524 25324 5972 1 9 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.797 0.452 25324 5973 1 9 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.331 -0.772 25324 5974 1 9 . 1 1 43 43 ASP H H 43 9.111 9.111 8.742 0.369 25324 5975 1 9 . 1 1 44 44 GLY N N 44 104.263 104.263 106.973 -2.710 25324 5976 1 9 . 1 1 44 44 GLY C C 44 173.922 173.922 174.919 -0.997 25324 5977 1 9 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.508 -0.207 25324 5978 1 9 . 1 1 44 44 GLY H H 44 9.063 9.063 8.018 1.045 25324 5979 1 9 . 1 1 45 45 GLN N N 45 121.691 121.691 117.894 3.797 25324 5980 1 9 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.165 -0.079 25324 5981 1 9 . 1 1 45 45 GLN C C 45 176.284 176.284 175.601 0.683 25324 5982 1 9 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.837 0.281 25324 5983 1 9 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.025 -1.351 25324 5984 1 9 . 1 1 45 45 GLN H H 45 7.356 7.356 8.094 -0.738 25324 5985 1 9 . 1 1 46 46 THR N N 46 111.843 111.843 113.223 -1.380 25324 5986 1 9 . 1 1 46 46 THR HA H 46 5.355 5.355 5.434 -0.079 25324 5987 1 9 . 1 1 46 46 THR C C 46 174.451 174.451 172.706 1.745 25324 5988 1 9 . 1 1 46 46 THR CA C 46 59.644 59.644 60.518 -0.874 25324 5989 1 9 . 1 1 46 46 THR CB C 46 72.714 72.714 69.511 3.203 25324 5990 1 9 . 1 1 46 46 THR H H 46 10.123 10.123 7.755 2.368 25324 5991 1 9 . 1 1 47 47 LEU N N 47 119.302 119.302 129.086 -9.784 25324 5992 1 9 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.541 0.266 25324 5993 1 9 . 1 1 47 47 LEU C C 47 175.487 175.487 175.118 0.369 25324 5994 1 9 . 1 1 47 47 LEU CA C 47 53.070 53.070 54.055 -0.985 25324 5995 1 9 . 1 1 47 47 LEU CB C 47 48.003 48.003 43.039 4.964 25324 5996 1 9 . 1 1 47 47 LEU H H 47 8.364 8.364 8.682 -0.318 25324 5997 1 9 . 1 1 48 48 ASN N N 48 116.844 116.844 120.555 -3.711 25324 5998 1 9 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.044 -0.315 25324 5999 1 9 . 1 1 48 48 ASN C C 48 174.460 174.460 174.837 -0.377 25324 6000 1 9 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.934 0.804 25324 6001 1 9 . 1 1 48 48 ASN CB C 48 43.413 43.413 43.237 0.176 25324 6002 1 9 . 1 1 48 48 ASN H H 48 8.748 8.748 8.701 0.047 25324 6003 1 9 . 1 1 49 49 GLY N N 49 109.417 109.417 109.084 0.333 25324 6004 1 9 . 1 1 49 49 GLY C C 49 172.126 172.126 172.348 -0.222 25324 6005 1 9 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.224 0.267 25324 6006 1 9 . 1 1 49 49 GLY H H 49 8.744 8.744 9.120 -0.376 25324 6007 1 9 . 1 1 50 50 THR N N 50 119.162 119.162 117.449 1.713 25324 6008 1 9 . 1 1 50 50 THR HA H 50 5.556 5.556 5.439 0.117 25324 6009 1 9 . 1 1 50 50 THR C C 50 171.790 171.790 172.600 -0.810 25324 6010 1 9 . 1 1 50 50 THR CA C 50 59.371 59.371 61.970 -2.599 25324 6011 1 9 . 1 1 50 50 THR CB C 50 72.799 72.799 71.584 1.215 25324 6012 1 9 . 1 1 50 50 THR H H 50 8.799 8.799 8.804 -0.005 25324 6013 1 9 . 1 1 51 51 MET N N 51 115.232 115.232 126.300 -11.068 25324 6014 1 9 . 1 1 51 51 MET HA H 51 4.886 4.886 4.978 -0.092 25324 6015 1 9 . 1 1 51 51 MET C C 51 172.708 172.708 173.830 -1.122 25324 6016 1 9 . 1 1 51 51 MET CA C 51 54.722 54.722 54.168 0.554 25324 6017 1 9 . 1 1 51 51 MET CB C 51 34.557 34.557 37.155 -2.598 25324 6018 1 9 . 1 1 51 51 MET H H 51 9.062 9.062 9.460 -0.398 25324 6019 1 9 . 1 1 52 52 THR N N 52 113.697 113.697 120.809 -7.112 25324 6020 1 9 . 1 1 52 52 THR HA H 52 4.682 4.682 4.840 -0.158 25324 6021 1 9 . 1 1 52 52 THR C C 52 173.952 173.952 173.474 0.478 25324 6022 1 9 . 1 1 52 52 THR CA C 52 61.395 61.395 61.304 0.091 25324 6023 1 9 . 1 1 52 52 THR CB C 52 71.734 71.734 71.239 0.495 25324 6024 1 9 . 1 1 52 52 THR H H 52 8.685 8.685 8.621 0.064 25324 6025 1 9 . 1 1 53 53 TYR N N 53 129.086 129.086 125.532 3.554 25324 6026 1 9 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.917 -0.117 25324 6027 1 9 . 1 1 53 53 TYR C C 53 175.214 175.214 176.407 -1.193 25324 6028 1 9 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.085 0.796 25324 6029 1 9 . 1 1 53 53 TYR CB C 53 40.512 40.512 40.148 0.364 25324 6030 1 9 . 1 1 53 53 TYR H H 53 10.112 10.112 8.652 1.460 25324 6031 1 9 . 1 1 54 54 ALA N N 54 119.947 119.947 123.673 -3.726 25324 6032 1 9 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.255 -0.253 25324 6033 1 9 . 1 1 54 54 ALA C C 54 178.285 178.285 177.735 0.550 25324 6034 1 9 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.420 0.551 25324 6035 1 9 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.001 0.716 25324 6036 1 9 . 1 1 54 54 ALA H H 54 8.704 8.704 8.670 0.034 25324 6037 1 9 . 1 1 55 55 GLY N N 55 110.940 110.940 111.420 -0.480 25324 6038 1 9 . 1 1 55 55 GLY C C 55 173.903 173.903 174.462 -0.559 25324 6039 1 9 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.307 -0.291 25324 6040 1 9 . 1 1 55 55 GLY H H 55 8.745 8.745 8.467 0.278 25324 6041 1 9 . 1 1 56 56 GLU N N 56 120.073 120.073 120.936 -0.863 25324 6042 1 9 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.752 -0.043 25324 6043 1 9 . 1 1 56 56 GLU C C 56 175.906 175.906 176.598 -0.692 25324 6044 1 9 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.009 -0.586 25324 6045 1 9 . 1 1 56 56 GLU CB C 56 32.824 32.824 31.702 1.122 25324 6046 1 9 . 1 1 56 56 GLU H H 56 8.039 8.039 7.965 0.074 25324 6047 1 9 . 1 1 57 57 GLY N N 57 105.298 105.298 107.779 -2.481 25324 6048 1 9 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.539 0.263 25324 6049 1 9 . 1 1 57 57 GLY H H 57 7.937 7.937 8.309 -0.372 25324 6050 1 9 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.627 0.307 25324 6051 1 9 . 1 1 58 58 PRO C C 58 177.785 177.785 176.415 1.370 25324 6052 1 9 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.092 0.040 25324 6053 1 9 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.378 -0.538 25324 6054 1 9 . 1 1 59 59 ILE N N 59 117.386 117.386 116.975 0.411 25324 6055 1 9 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.688 0.300 25324 6056 1 9 . 1 1 59 59 ILE C C 59 175.688 175.688 174.993 0.695 25324 6057 1 9 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.215 0.327 25324 6058 1 9 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.304 0.984 25324 6059 1 9 . 1 1 59 59 ILE H H 59 9.600 9.600 8.909 0.691 25324 6060 1 9 . 1 1 60 60 GLY N N 60 107.164 107.164 107.802 -0.638 25324 6061 1 9 . 1 1 60 60 GLY C C 60 173.787 173.787 172.489 1.298 25324 6062 1 9 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.411 1.824 25324 6063 1 9 . 1 1 60 60 GLY H H 60 8.957 8.957 8.533 0.424 25324 6064 1 9 . 1 1 61 61 PHE N N 61 124.597 124.597 126.090 -1.493 25324 6065 1 9 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.099 0.124 25324 6066 1 9 . 1 1 61 61 PHE C C 61 173.126 173.126 173.301 -0.175 25324 6067 1 9 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.809 0.052 25324 6068 1 9 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.328 -0.112 25324 6069 1 9 . 1 1 61 61 PHE H H 61 8.788 8.788 9.310 -0.522 25324 6070 1 9 . 1 1 62 62 ARG N N 62 129.706 129.706 127.431 2.275 25324 6071 1 9 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.520 -0.388 25324 6072 1 9 . 1 1 62 62 ARG C C 62 172.456 172.456 173.020 -0.564 25324 6073 1 9 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.094 0.860 25324 6074 1 9 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.623 -1.753 25324 6075 1 9 . 1 1 62 62 ARG H H 62 8.405 8.405 8.410 -0.005 25324 6076 1 9 . 1 1 63 63 ALA N N 63 122.744 122.744 128.802 -6.058 25324 6077 1 9 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.428 -0.083 25324 6078 1 9 . 1 1 63 63 ALA C C 63 176.120 176.120 175.733 0.387 25324 6079 1 9 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.014 -0.095 25324 6080 1 9 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.902 1.871 25324 6081 1 9 . 1 1 63 63 ALA H H 63 8.628 8.628 8.822 -0.194 25324 6082 1 9 . 1 1 64 64 THR N N 64 116.855 116.855 118.158 -1.303 25324 6083 1 9 . 1 1 64 64 THR HA H 64 4.848 4.848 5.266 -0.418 25324 6084 1 9 . 1 1 64 64 THR C C 64 172.957 172.957 173.740 -0.783 25324 6085 1 9 . 1 1 64 64 THR CA C 64 61.211 61.211 61.096 0.115 25324 6086 1 9 . 1 1 64 64 THR CB C 64 71.064 71.064 71.631 -0.567 25324 6087 1 9 . 1 1 64 64 THR H H 64 8.315 8.315 8.545 -0.230 25324 6088 1 9 . 1 1 65 65 LEU N N 65 129.360 129.360 129.884 -0.524 25324 6089 1 9 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.971 -0.609 25324 6090 1 9 . 1 1 65 65 LEU C C 65 176.459 176.459 176.480 -0.021 25324 6091 1 9 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.992 0.695 25324 6092 1 9 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.523 -0.812 25324 6093 1 9 . 1 1 65 65 LEU H H 65 8.877 8.877 9.019 -0.142 25324 6094 1 9 . 1 1 66 66 LEU N N 66 128.683 128.683 128.218 0.465 25324 6095 1 9 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.252 0.124 25324 6096 1 9 . 1 1 66 66 LEU C C 66 177.621 177.621 178.023 -0.402 25324 6097 1 9 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.563 -0.863 25324 6098 1 9 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.072 0.230 25324 6099 1 9 . 1 1 66 66 LEU H H 66 9.320 9.320 8.325 0.995 25324 6100 1 9 . 1 1 67 67 GLY N N 67 105.361 105.361 104.119 1.242 25324 6101 1 9 . 1 1 67 67 GLY C C 67 173.618 173.618 174.000 -0.382 25324 6102 1 9 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.849 -1.482 25324 6103 1 9 . 1 1 67 67 GLY H H 67 6.639 6.639 8.384 -1.745 25324 6104 1 9 . 1 1 68 68 ASN N N 68 121.848 121.848 118.951 2.897 25324 6105 1 9 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.818 -0.487 25324 6106 1 9 . 1 1 68 68 ASN C C 68 174.316 174.316 174.010 0.306 25324 6107 1 9 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.402 3.150 25324 6108 1 9 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.552 -1.387 25324 6109 1 9 . 1 1 68 68 ASN H H 68 9.236 9.236 7.681 1.555 25324 6110 1 9 . 1 1 69 69 ASN N N 69 109.509 109.509 115.552 -6.043 25324 6111 1 9 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.679 -0.599 25324 6112 1 9 . 1 1 69 69 ASN C C 69 171.456 171.456 174.436 -2.980 25324 6113 1 9 . 1 1 69 69 ASN CA C 69 55.750 55.750 53.528 2.222 25324 6114 1 9 . 1 1 69 69 ASN CB C 69 37.306 37.306 38.743 -1.437 25324 6115 1 9 . 1 1 69 69 ASN H H 69 8.651 8.651 8.497 0.154 25324 6116 1 9 . 1 1 70 70 SER N N 70 113.479 113.479 115.994 -2.515 25324 6117 1 9 . 1 1 70 70 SER HA H 70 5.437 5.437 5.358 0.079 25324 6118 1 9 . 1 1 70 70 SER C C 70 173.750 173.750 172.926 0.824 25324 6119 1 9 . 1 1 70 70 SER CA C 70 57.139 57.139 58.469 -1.331 25324 6120 1 9 . 1 1 70 70 SER CB C 70 63.818 63.818 65.640 -1.822 25324 6121 1 9 . 1 1 70 70 SER H H 70 7.693 7.693 7.420 0.273 25324 6122 1 9 . 1 1 71 71 TYR N N 71 123.132 123.132 121.268 1.864 25324 6123 1 9 . 1 1 71 71 TYR HA H 71 5.143 5.143 4.902 0.241 25324 6124 1 9 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.666 -0.018 25324 6125 1 9 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.495 -0.050 25324 6126 1 9 . 1 1 71 71 TYR H H 71 9.326 9.326 9.455 -0.129 25324 6127 1 9 . 1 1 72 72 GLU N N 72 122.396 122.396 123.006 -0.610 25324 6128 1 9 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.529 0.277 25324 6129 1 9 . 1 1 72 72 GLU C C 72 175.698 175.698 175.403 0.295 25324 6130 1 9 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.805 -0.638 25324 6131 1 9 . 1 1 72 72 GLU CB C 72 30.184 30.184 30.948 -0.764 25324 6132 1 9 . 1 1 72 72 GLU H H 72 8.624 8.624 9.050 -0.426 25324 6133 1 9 . 1 1 73 73 VAL N N 73 128.513 128.513 128.671 -0.158 25324 6134 1 9 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.134 0.065 25324 6135 1 9 . 1 1 73 73 VAL C C 73 175.369 175.369 174.612 0.757 25324 6136 1 9 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.948 -0.468 25324 6137 1 9 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.460 0.873 25324 6138 1 9 . 1 1 73 73 VAL H H 73 8.564 8.564 9.077 -0.513 25324 6139 1 9 . 1 1 74 74 GLU N N 74 124.842 124.842 126.931 -2.089 25324 6140 1 9 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.008 0.079 25324 6141 1 9 . 1 1 74 74 GLU C C 74 174.415 174.415 174.831 -0.416 25324 6142 1 9 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.815 -0.478 25324 6143 1 9 . 1 1 74 74 GLU CB C 74 35.157 35.157 32.721 2.436 25324 6144 1 9 . 1 1 74 74 GLU H H 74 9.011 9.011 8.952 0.059 25324 6145 1 9 . 1 1 75 75 ASN N N 75 116.136 116.136 122.900 -6.764 25324 6146 1 9 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.528 0.611 25324 6147 1 9 . 1 1 75 75 ASN C C 75 172.703 172.703 173.815 -1.112 25324 6148 1 9 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.660 -0.835 25324 6149 1 9 . 1 1 75 75 ASN CB C 75 45.896 45.896 41.996 3.900 25324 6150 1 9 . 1 1 75 75 ASN H H 75 9.424 9.424 9.006 0.418 25324 6151 1 9 . 1 1 76 76 GLN N N 76 120.762 120.762 122.908 -2.146 25324 6152 1 9 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.520 -0.480 25324 6153 1 9 . 1 1 76 76 GLN C C 76 173.113 173.113 174.001 -0.888 25324 6154 1 9 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.507 -0.284 25324 6155 1 9 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.116 -0.768 25324 6156 1 9 . 1 1 76 76 GLN H H 76 7.106 7.106 8.946 -1.840 25324 6157 1 9 . 1 1 77 77 TRP N N 77 125.598 125.598 124.755 0.843 25324 6158 1 9 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.113 0.039 25324 6159 1 9 . 1 1 77 77 TRP C C 77 175.502 175.502 174.541 0.961 25324 6160 1 9 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.696 -0.932 25324 6161 1 9 . 1 1 77 77 TRP CB C 77 29.999 29.999 31.387 -1.388 25324 6162 1 9 . 1 1 77 77 TRP H H 77 8.181 8.181 8.133 0.048 25324 6163 1 9 . 1 1 78 78 GLY N N 78 107.901 107.901 109.359 -1.458 25324 6164 1 9 . 1 1 78 78 GLY C C 78 174.611 174.611 173.886 0.725 25324 6165 1 9 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.033 -0.131 25324 6166 1 9 . 1 1 78 78 GLY H H 78 8.778 8.778 8.047 0.731 25324 6167 1 9 . 1 1 79 79 GLY N N 79 109.844 109.844 108.823 1.021 25324 6168 1 9 . 1 1 79 79 GLY C C 79 173.782 173.782 174.583 -0.801 25324 6169 1 9 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.514 -0.721 25324 6170 1 9 . 1 1 79 79 GLY H H 79 8.198 8.198 8.353 -0.155 25324 6171 1 9 . 1 1 80 80 ASP N N 80 115.837 115.837 118.682 -2.845 25324 6172 1 9 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.278 -0.037 25324 6173 1 9 . 1 1 80 80 ASP C C 80 177.285 177.285 176.126 1.159 25324 6174 1 9 . 1 1 80 80 ASP CA C 80 56.183 56.183 56.098 0.085 25324 6175 1 9 . 1 1 80 80 ASP CB C 80 40.523 40.523 39.273 1.250 25324 6176 1 9 . 1 1 80 80 ASP H H 80 8.132 8.132 8.163 -0.031 25324 6177 1 9 . 1 1 81 81 SER N N 81 112.690 112.690 117.105 -4.415 25324 6178 1 9 . 1 1 81 81 SER HA H 81 4.513 4.513 4.366 0.147 25324 6179 1 9 . 1 1 81 81 SER C C 81 173.684 173.684 174.154 -0.470 25324 6180 1 9 . 1 1 81 81 SER CA C 81 57.232 57.232 58.761 -1.529 25324 6181 1 9 . 1 1 81 81 SER CB C 81 63.170 63.170 63.816 -0.646 25324 6182 1 9 . 1 1 81 81 SER H H 81 8.179 8.179 8.061 0.118 25324 6183 1 9 . 1 1 82 82 ALA N N 82 126.310 126.310 125.070 1.240 25324 6184 1 9 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.347 0.056 25324 6185 1 9 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.786 -0.320 25324 6186 1 9 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.304 -0.106 25324 6187 1 9 . 1 1 82 82 ALA H H 82 7.274 7.274 7.530 -0.257 25324 6188 1 9 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.229 0.144 25324 6189 1 9 . 1 1 83 83 PRO C C 83 175.378 175.378 175.115 0.263 25324 6190 1 9 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.095 0.232 25324 6191 1 9 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.542 -0.378 25324 6192 1 9 . 1 1 84 84 TRP N N 84 120.106 120.106 116.486 3.620 25324 6193 1 9 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.361 -0.090 25324 6194 1 9 . 1 1 84 84 TRP C C 84 176.358 176.358 175.780 0.578 25324 6195 1 9 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.710 0.236 25324 6196 1 9 . 1 1 84 84 TRP CB C 84 29.716 29.716 31.348 -1.632 25324 6197 1 9 . 1 1 84 84 TRP H H 84 8.329 8.329 7.880 0.449 25324 6198 1 9 . 1 1 85 85 HIS N N 85 118.543 118.543 119.478 -0.935 25324 6199 1 9 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.919 -0.001 25324 6200 1 9 . 1 1 85 85 HIS C C 85 174.950 174.950 174.786 0.164 25324 6201 1 9 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.847 -1.378 25324 6202 1 9 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.461 -1.788 25324 6203 1 9 . 1 1 85 85 HIS H H 85 9.204 9.204 9.023 0.181 25324 6204 1 9 . 1 1 86 86 SER N N 86 117.803 117.803 116.821 0.982 25324 6205 1 9 . 1 1 86 86 SER HA H 86 4.412 4.412 4.258 0.154 25324 6206 1 9 . 1 1 86 86 SER C C 86 175.691 175.691 174.806 0.885 25324 6207 1 9 . 1 1 86 86 SER CA C 86 60.257 60.257 59.328 0.929 25324 6208 1 9 . 1 1 86 86 SER CB C 86 63.015 63.015 63.932 -0.917 25324 6209 1 9 . 1 1 86 86 SER H H 86 9.168 9.168 8.892 0.276 25324 6210 1 9 . 1 1 87 87 GLY N N 87 115.773 115.773 111.772 4.001 25324 6211 1 9 . 1 1 87 87 GLY C C 87 174.288 174.288 173.820 0.468 25324 6212 1 9 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.915 -0.214 25324 6213 1 9 . 1 1 87 87 GLY H H 87 9.284 9.284 9.115 0.169 25324 6214 1 9 . 1 1 88 88 GLY N N 88 109.162 109.162 108.478 0.684 25324 6215 1 9 . 1 1 88 88 GLY C C 88 171.120 171.120 171.637 -0.517 25324 6216 1 9 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.186 -0.592 25324 6217 1 9 . 1 1 88 88 GLY H H 88 8.054 8.054 8.107 -0.053 25324 6218 1 9 . 1 1 89 89 ASN N N 89 117.048 117.048 119.753 -2.705 25324 6219 1 9 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.822 0.216 25324 6220 1 9 . 1 1 89 89 ASN C C 89 175.287 175.287 174.989 0.298 25324 6221 1 9 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.071 -1.206 25324 6222 1 9 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.013 -1.408 25324 6223 1 9 . 1 1 89 89 ASN H H 89 8.516 8.516 8.674 -0.158 25324 6224 1 9 . 1 1 90 90 TRP N N 90 125.844 125.844 124.207 1.637 25324 6225 1 9 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.127 0.126 25324 6226 1 9 . 1 1 90 90 TRP C C 90 175.278 175.278 174.998 0.280 25324 6227 1 9 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.216 0.052 25324 6228 1 9 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.089 -0.131 25324 6229 1 9 . 1 1 90 90 TRP H H 90 9.282 9.282 9.123 0.159 25324 6230 1 9 . 1 1 91 91 ILE N N 91 123.134 123.134 120.741 2.393 25324 6231 1 9 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.894 0.552 25324 6232 1 9 . 1 1 91 91 ILE C C 91 175.489 175.489 175.329 0.160 25324 6233 1 9 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.845 -0.019 25324 6234 1 9 . 1 1 91 91 ILE CB C 91 39.676 39.676 39.039 0.636 25324 6235 1 9 . 1 1 91 91 ILE H H 91 9.318 9.318 8.566 0.752 25324 6236 1 9 . 1 1 92 92 LEU N N 92 123.452 123.452 128.888 -5.436 25324 6237 1 9 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.516 0.426 25324 6238 1 9 . 1 1 92 92 LEU C C 92 173.620 173.620 174.262 -0.642 25324 6239 1 9 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.546 -1.290 25324 6240 1 9 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.172 1.336 25324 6241 1 9 . 1 1 92 92 LEU H H 92 8.463 8.463 8.790 -0.327 25324 6242 1 9 . 1 1 93 93 GLY N N 93 103.987 103.987 107.942 -3.955 25324 6243 1 9 . 1 1 93 93 GLY C C 93 172.284 172.284 174.079 -1.795 25324 6244 1 9 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.570 -2.070 25324 6245 1 9 . 1 1 93 93 GLY H H 93 2.937 2.937 6.962 -4.025 25324 6246 1 9 . 1 1 94 94 SER N N 94 110.274 110.274 118.107 -7.833 25324 6247 1 9 . 1 1 94 94 SER HA H 94 4.711 4.711 4.804 -0.093 25324 6248 1 9 . 1 1 94 94 SER C C 94 174.784 174.784 175.482 -0.698 25324 6249 1 9 . 1 1 94 94 SER CA C 94 56.555 56.555 59.165 -2.610 25324 6250 1 9 . 1 1 94 94 SER CB C 94 65.051 65.051 64.877 0.174 25324 6251 1 9 . 1 1 94 94 SER H H 94 7.919 7.919 9.466 -1.547 25324 6252 1 9 . 1 1 95 95 ARG N N 95 123.020 123.020 122.168 0.852 25324 6253 1 9 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.481 0.191 25324 6254 1 9 . 1 1 95 95 ARG C C 95 176.120 176.120 177.561 -1.441 25324 6255 1 9 . 1 1 95 95 ARG CA C 95 55.374 55.374 54.995 0.379 25324 6256 1 9 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.797 0.051 25324 6257 1 9 . 1 1 95 95 ARG H H 95 9.148 9.148 7.600 1.548 25324 6258 1 9 . 1 1 96 96 GLU N N 96 120.357 120.357 124.763 -4.406 25324 6259 1 9 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.040 0.242 25324 6260 1 9 . 1 1 96 96 GLU C C 96 176.278 176.278 176.156 0.122 25324 6261 1 9 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.905 -2.375 25324 6262 1 9 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.621 0.532 25324 6263 1 9 . 1 1 96 96 GLU H H 96 8.610 8.610 8.867 -0.257 25324 6264 1 9 . 1 1 97 97 ASN N N 97 117.678 117.678 115.959 1.719 25324 6265 1 9 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.740 -0.128 25324 6266 1 9 . 1 1 97 97 ASN C C 97 173.949 173.949 174.168 -0.219 25324 6267 1 9 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.326 0.689 25324 6268 1 9 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.003 0.163 25324 6269 1 9 . 1 1 97 97 ASN H H 97 8.533 8.533 8.154 0.379 25324 6270 1 9 . 1 1 98 98 GLN N N 98 118.592 118.592 119.255 -0.663 25324 6271 1 9 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.502 -0.142 25324 6272 1 9 . 1 1 98 98 GLN C C 98 173.116 173.116 172.999 0.117 25324 6273 1 9 . 1 1 98 98 GLN CA C 98 55.628 55.628 56.153 -0.525 25324 6274 1 9 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.265 -0.396 25324 6275 1 9 . 1 1 98 98 GLN H H 98 7.663 7.663 7.332 0.331 25324 6276 1 9 . 1 1 99 99 ASN N N 99 122.855 122.855 121.661 1.194 25324 6277 1 9 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.253 -0.118 25324 6278 1 9 . 1 1 99 99 ASN C C 99 175.287 175.287 174.737 0.550 25324 6279 1 9 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.130 0.860 25324 6280 1 9 . 1 1 99 99 ASN CB C 99 40.491 40.491 41.594 -1.103 25324 6281 1 9 . 1 1 99 99 ASN H H 99 8.759 8.759 8.569 0.190 25324 6282 1 9 . 1 1 100 100 VAL N N 100 121.385 121.385 117.331 4.054 25324 6283 1 9 . 1 1 100 100 VAL HA H 100 3.748 3.748 4.154 -0.406 25324 6284 1 9 . 1 1 100 100 VAL C C 100 174.956 174.956 176.206 -1.250 25324 6285 1 9 . 1 1 100 100 VAL CA C 100 63.843 63.843 62.129 1.714 25324 6286 1 9 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.597 0.846 25324 6287 1 9 . 1 1 100 100 VAL H H 100 8.717 8.717 8.051 0.666 25324 6288 1 9 . 1 1 101 101 VAL N N 101 112.736 112.736 118.774 -6.038 25324 6289 1 9 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.501 0.144 25324 6290 1 9 . 1 1 101 101 VAL C C 101 175.577 175.577 174.631 0.946 25324 6291 1 9 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.791 -1.828 25324 6292 1 9 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.910 -0.869 25324 6293 1 9 . 1 1 101 101 VAL H H 101 8.802 8.802 8.954 -0.152 25324 6294 1 9 . 1 1 102 102 ALA N N 102 122.104 122.104 121.928 0.176 25324 6295 1 9 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.212 -0.405 25324 6296 1 9 . 1 1 102 102 ALA C C 102 176.046 176.046 174.855 1.191 25324 6297 1 9 . 1 1 102 102 ALA CA C 102 53.254 53.254 51.020 2.234 25324 6298 1 9 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.356 -0.731 25324 6299 1 9 . 1 1 102 102 ALA H H 102 7.677 7.677 7.724 -0.047 25324 6300 1 9 . 1 1 103 103 ILE N N 103 118.218 118.218 121.609 -3.391 25324 6301 1 9 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.366 -0.339 25324 6302 1 9 . 1 1 103 103 ILE C C 103 173.118 173.118 173.910 -0.792 25324 6303 1 9 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.681 1.546 25324 6304 1 9 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.673 0.798 25324 6305 1 9 . 1 1 103 103 ILE H H 103 8.102 8.102 8.617 -0.515 25324 6306 1 9 . 1 1 104 104 ASN N N 104 125.938 125.938 126.644 -0.706 25324 6307 1 9 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.432 0.254 25324 6308 1 9 . 1 1 104 104 ASN C C 104 174.870 174.870 173.748 1.122 25324 6309 1 9 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.566 -0.013 25324 6310 1 9 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.112 -1.260 25324 6311 1 9 . 1 1 104 104 ASN H H 104 8.668 8.668 9.091 -0.423 25324 6312 1 9 . 1 1 105 105 VAL N N 105 114.631 114.631 119.336 -4.705 25324 6313 1 9 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.241 -0.036 25324 6314 1 9 . 1 1 105 105 VAL C C 105 174.788 174.788 173.698 1.090 25324 6315 1 9 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.227 -2.248 25324 6316 1 9 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.978 0.062 25324 6317 1 9 . 1 1 105 105 VAL H H 105 8.933 8.933 8.813 0.120 25324 6318 1 9 . 1 1 106 106 GLU N N 106 118.347 118.347 121.437 -3.090 25324 6319 1 9 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.242 -0.163 25324 6320 1 9 . 1 1 106 106 GLU C C 106 174.777 174.777 175.086 -0.309 25324 6321 1 9 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.812 0.155 25324 6322 1 9 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.368 -0.725 25324 6323 1 9 . 1 1 106 106 GLU H H 106 8.814 8.814 8.723 0.091 25324 6324 1 9 . 1 1 107 107 SER N N 107 115.335 115.335 116.029 -0.694 25324 6325 1 9 . 1 1 107 107 SER HA H 107 5.266 5.266 5.022 0.244 25324 6326 1 9 . 1 1 107 107 SER C C 107 175.787 175.787 175.752 0.035 25324 6327 1 9 . 1 1 107 107 SER CA C 107 55.888 55.888 57.979 -2.091 25324 6328 1 9 . 1 1 107 107 SER CB C 107 65.921 65.921 64.996 0.925 25324 6329 1 9 . 1 1 107 107 SER H H 107 8.576 8.576 8.841 -0.265 25324 6330 1 9 . 1 1 108 108 GLY N N 108 117.567 117.567 109.126 8.441 25324 6331 1 9 . 1 1 108 108 GLY C C 108 173.959 173.959 174.139 -0.180 25324 6332 1 9 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.858 -1.181 25324 6333 1 9 . 1 1 108 108 GLY H H 108 9.532 9.532 8.649 0.882 25324 6334 1 9 . 1 1 109 109 ASP N N 109 122.108 122.108 120.418 1.690 25324 6335 1 9 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.862 -0.061 25324 6336 1 9 . 1 1 109 109 ASP C C 109 176.203 176.203 175.255 0.948 25324 6337 1 9 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.917 -0.783 25324 6338 1 9 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.991 -2.649 25324 6339 1 9 . 1 1 109 109 ASP H H 109 8.605 8.605 7.366 1.239 25324 6340 1 9 . 1 1 110 110 ASP N N 110 116.197 116.197 118.085 -1.888 25324 6341 1 9 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.519 -0.297 25324 6342 1 9 . 1 1 110 110 ASP C C 110 175.951 175.951 176.436 -0.485 25324 6343 1 9 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.663 1.536 25324 6344 1 9 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.184 -1.554 25324 6345 1 9 . 1 1 110 110 ASP H H 110 9.087 9.087 8.514 0.573 25324 6346 1 9 . 1 1 111 111 GLY N N 111 103.841 103.841 108.555 -4.714 25324 6347 1 9 . 1 1 111 111 GLY C C 111 173.924 173.924 175.125 -1.201 25324 6348 1 9 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.394 -0.231 25324 6349 1 9 . 1 1 111 111 GLY H H 111 8.930 8.930 7.881 1.049 25324 6350 1 9 . 1 1 112 112 GLN N N 112 121.626 121.626 120.609 1.017 25324 6351 1 9 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.044 0.026 25324 6352 1 9 . 1 1 112 112 GLN C C 112 176.431 176.431 174.756 1.675 25324 6353 1 9 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.709 -0.436 25324 6354 1 9 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.413 -1.720 25324 6355 1 9 . 1 1 112 112 GLN H H 112 7.351 7.351 8.340 -0.989 25324 6356 1 9 . 1 1 113 113 THR N N 113 112.322 112.322 109.174 3.148 25324 6357 1 9 . 1 1 113 113 THR HA H 113 5.331 5.331 5.518 -0.187 25324 6358 1 9 . 1 1 113 113 THR C C 113 174.452 174.452 173.529 0.923 25324 6359 1 9 . 1 1 113 113 THR CA C 113 59.739 59.739 59.875 -0.136 25324 6360 1 9 . 1 1 113 113 THR CB C 113 71.773 71.773 71.358 0.415 25324 6361 1 9 . 1 1 113 113 THR H H 113 10.053 10.053 7.474 2.579 25324 6362 1 9 . 1 1 114 114 LEU N N 114 122.083 122.083 126.355 -4.272 25324 6363 1 9 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.947 -0.366 25324 6364 1 9 . 1 1 114 114 LEU C C 114 175.113 175.113 175.448 -0.335 25324 6365 1 9 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.776 -0.872 25324 6366 1 9 . 1 1 114 114 LEU CB C 114 47.033 47.033 43.035 3.998 25324 6367 1 9 . 1 1 114 114 LEU H H 114 8.978 8.978 8.906 0.072 25324 6368 1 9 . 1 1 115 115 ASN N N 115 118.846 118.846 119.190 -0.344 25324 6369 1 9 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.834 -0.064 25324 6370 1 9 . 1 1 115 115 ASN C C 115 174.788 174.788 174.822 -0.034 25324 6371 1 9 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.148 1.194 25324 6372 1 9 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.275 1.139 25324 6373 1 9 . 1 1 115 115 ASN H H 115 8.837 8.837 8.957 -0.120 25324 6374 1 9 . 1 1 116 116 GLY N N 116 109.661 109.661 106.765 2.896 25324 6375 1 9 . 1 1 116 116 GLY C C 116 172.452 172.452 172.870 -0.418 25324 6376 1 9 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.104 0.367 25324 6377 1 9 . 1 1 116 116 GLY H H 116 8.625 8.625 8.662 -0.037 25324 6378 1 9 . 1 1 117 117 THR N N 117 120.009 120.009 115.221 4.788 25324 6379 1 9 . 1 1 117 117 THR HA H 117 5.556 5.556 5.579 -0.023 25324 6380 1 9 . 1 1 117 117 THR C C 117 171.619 171.619 173.272 -1.653 25324 6381 1 9 . 1 1 117 117 THR CA C 117 59.373 59.373 60.418 -1.045 25324 6382 1 9 . 1 1 117 117 THR CB C 117 72.777 72.777 72.715 0.062 25324 6383 1 9 . 1 1 117 117 THR H H 117 8.911 8.911 8.963 -0.052 25324 6384 1 9 . 1 1 118 118 MET N N 118 115.550 115.550 118.043 -2.493 25324 6385 1 9 . 1 1 118 118 MET HA H 118 4.889 4.889 5.254 -0.365 25324 6386 1 9 . 1 1 118 118 MET C C 118 172.707 172.707 173.963 -1.256 25324 6387 1 9 . 1 1 118 118 MET CA C 118 54.714 54.714 54.539 0.174 25324 6388 1 9 . 1 1 118 118 MET CB C 118 33.663 33.663 37.109 -3.446 25324 6389 1 9 . 1 1 118 118 MET H H 118 9.159 9.159 9.426 -0.267 25324 6390 1 9 . 1 1 119 119 THR N N 119 113.716 113.716 116.870 -3.154 25324 6391 1 9 . 1 1 119 119 THR HA H 119 4.682 4.682 4.856 -0.174 25324 6392 1 9 . 1 1 119 119 THR C C 119 173.952 173.952 173.246 0.706 25324 6393 1 9 . 1 1 119 119 THR CA C 119 61.395 61.395 61.643 -0.248 25324 6394 1 9 . 1 1 119 119 THR CB C 119 71.746 71.746 71.568 0.178 25324 6395 1 9 . 1 1 119 119 THR H H 119 8.685 8.685 8.862 -0.177 25324 6396 1 9 . 1 1 120 120 TYR N N 120 129.153 129.153 126.116 3.037 25324 6397 1 9 . 1 1 120 120 TYR HA H 120 4.800 4.800 5.145 -0.345 25324 6398 1 9 . 1 1 120 120 TYR C C 120 175.214 175.214 176.017 -0.803 25324 6399 1 9 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.355 1.522 25324 6400 1 9 . 1 1 120 120 TYR CB C 120 40.502 40.502 41.025 -0.523 25324 6401 1 9 . 1 1 120 120 TYR H H 120 10.107 10.107 8.887 1.220 25324 6402 1 9 . 1 1 121 121 ALA N N 121 119.947 119.947 124.247 -4.300 25324 6403 1 9 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.297 -0.293 25324 6404 1 9 . 1 1 121 121 ALA C C 121 178.456 178.456 177.883 0.573 25324 6405 1 9 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.788 0.169 25324 6406 1 9 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.808 -0.098 25324 6407 1 9 . 1 1 121 121 ALA H H 121 8.704 8.704 8.314 0.390 25324 6408 1 9 . 1 1 122 122 GLY N N 122 111.186 111.186 110.709 0.477 25324 6409 1 9 . 1 1 122 122 GLY C C 122 173.949 173.949 174.139 -0.190 25324 6410 1 9 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.542 -0.541 25324 6411 1 9 . 1 1 122 122 GLY H H 122 8.792 8.792 8.757 0.035 25324 6412 1 9 . 1 1 123 123 GLU N N 123 120.099 120.099 119.633 0.466 25324 6413 1 9 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.688 0.017 25324 6414 1 9 . 1 1 123 123 GLU C C 123 175.912 175.912 176.145 -0.233 25324 6415 1 9 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.747 -0.333 25324 6416 1 9 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.627 0.158 25324 6417 1 9 . 1 1 123 123 GLU H H 123 8.072 8.072 7.861 0.211 25324 6418 1 9 . 1 1 124 124 GLY N N 124 105.303 105.303 109.209 -3.906 25324 6419 1 9 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.545 0.257 25324 6420 1 9 . 1 1 124 124 GLY H H 124 7.939 7.939 8.378 -0.439 25324 6421 1 9 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.932 0.003 25324 6422 1 9 . 1 1 125 125 PRO C C 125 177.788 177.788 176.431 1.357 25324 6423 1 9 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.920 0.211 25324 6424 1 9 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.357 -0.498 25324 6425 1 9 . 1 1 126 126 ILE N N 126 117.387 117.387 117.367 0.020 25324 6426 1 9 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.664 0.235 25324 6427 1 9 . 1 1 126 126 ILE C C 126 175.625 175.625 175.064 0.561 25324 6428 1 9 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.186 0.267 25324 6429 1 9 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.116 1.432 25324 6430 1 9 . 1 1 126 126 ILE H H 126 9.599 9.599 8.939 0.660 25324 6431 1 9 . 1 1 127 127 GLY N N 127 106.753 106.753 107.859 -1.106 25324 6432 1 9 . 1 1 127 127 GLY C C 127 173.627 173.627 172.849 0.778 25324 6433 1 9 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.834 1.448 25324 6434 1 9 . 1 1 127 127 GLY H H 127 8.840 8.840 8.630 0.210 25324 6435 1 9 . 1 1 128 128 PHE N N 128 124.826 124.826 126.634 -1.808 25324 6436 1 9 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.486 -0.542 25324 6437 1 9 . 1 1 128 128 PHE C C 128 173.087 173.087 173.196 -0.109 25324 6438 1 9 . 1 1 128 128 PHE CA C 128 57.009 57.009 55.741 1.268 25324 6439 1 9 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.627 -0.467 25324 6440 1 9 . 1 1 128 128 PHE H H 128 8.924 8.924 8.934 -0.010 25324 6441 1 9 . 1 1 129 129 LYS N N 129 131.518 131.518 127.402 4.116 25324 6442 1 9 . 1 1 129 129 LYS HA H 129 4.883 4.883 5.103 -0.220 25324 6443 1 9 . 1 1 129 129 LYS C C 129 173.863 173.863 174.003 -0.140 25324 6444 1 9 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.277 1.458 25324 6445 1 9 . 1 1 129 129 LYS CB C 129 34.721 34.721 36.353 -1.632 25324 6446 1 9 . 1 1 129 129 LYS H H 129 8.201 8.201 8.818 -0.617 25324 6447 1 9 . 1 1 130 130 GLY N N 130 114.030 114.030 113.069 0.961 25324 6448 1 9 . 1 1 130 130 GLY C C 130 171.951 171.951 172.759 -0.808 25324 6449 1 9 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.869 -0.082 25324 6450 1 9 . 1 1 130 130 GLY H H 130 9.325 9.325 8.662 0.663 25324 6451 1 9 . 1 1 131 131 THR N N 131 120.583 120.583 121.764 -1.181 25324 6452 1 9 . 1 1 131 131 THR HA H 131 4.939 4.939 5.071 -0.132 25324 6453 1 9 . 1 1 131 131 THR C C 131 173.118 173.118 174.143 -1.025 25324 6454 1 9 . 1 1 131 131 THR CA C 131 61.266 61.266 61.210 0.056 25324 6455 1 9 . 1 1 131 131 THR CB C 131 70.392 70.392 71.896 -1.504 25324 6456 1 9 . 1 1 131 131 THR H H 131 8.916 8.916 8.188 0.728 25324 6457 1 9 . 1 1 132 132 LEU N N 132 130.774 130.774 128.579 2.195 25324 6458 1 9 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.999 -0.499 25324 6459 1 9 . 1 1 132 132 LEU C C 132 176.574 176.574 177.689 -1.115 25324 6460 1 9 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.599 0.588 25324 6461 1 9 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.052 0.395 25324 6462 1 9 . 1 1 132 132 LEU H H 132 8.527 8.527 8.569 -0.042 25324 6463 1 10 . 1 1 3 3 LEU N N 3 123.202 123.202 123.093 0.109 25324 6464 1 10 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.245 -0.088 25324 6465 1 10 . 1 1 3 3 LEU C C 3 175.786 175.786 175.300 0.486 25324 6466 1 10 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.679 0.605 25324 6467 1 10 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.690 -0.359 25324 6468 1 10 . 1 1 3 3 LEU H H 3 8.711 8.711 8.420 0.291 25324 6469 1 10 . 1 1 4 4 TYR N N 4 120.906 120.906 124.488 -3.582 25324 6470 1 10 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.068 -0.044 25324 6471 1 10 . 1 1 4 4 TYR C C 4 175.953 175.953 175.105 0.848 25324 6472 1 10 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.158 0.219 25324 6473 1 10 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.364 -0.709 25324 6474 1 10 . 1 1 4 4 TYR H H 4 9.142 9.142 9.576 -0.434 25324 6475 1 10 . 1 1 5 5 ASN N N 5 120.496 120.496 119.783 0.713 25324 6476 1 10 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.901 0.215 25324 6477 1 10 . 1 1 5 5 ASN C C 5 174.953 174.953 173.888 1.065 25324 6478 1 10 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.676 -0.729 25324 6479 1 10 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.100 -1.209 25324 6480 1 10 . 1 1 5 5 ASN H H 5 8.787 8.787 9.191 -0.404 25324 6481 1 10 . 1 1 6 6 VAL N N 6 127.428 127.428 123.582 3.846 25324 6482 1 10 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.412 -0.050 25324 6483 1 10 . 1 1 6 6 VAL C C 6 174.955 174.955 174.579 0.376 25324 6484 1 10 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.208 0.225 25324 6485 1 10 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.391 -0.060 25324 6486 1 10 . 1 1 6 6 VAL H H 6 8.806 8.806 8.703 0.103 25324 6487 1 10 . 1 1 7 7 GLU N N 7 124.355 124.355 126.746 -2.391 25324 6488 1 10 . 1 1 7 7 GLU HA H 7 4.982 4.982 5.005 -0.023 25324 6489 1 10 . 1 1 7 7 GLU C C 7 174.551 174.551 175.093 -0.542 25324 6490 1 10 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.572 -0.783 25324 6491 1 10 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.029 1.538 25324 6492 1 10 . 1 1 7 7 GLU H H 7 8.800 8.800 9.045 -0.245 25324 6493 1 10 . 1 1 8 8 ASN N N 8 116.231 116.231 121.276 -5.045 25324 6494 1 10 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.842 0.199 25324 6495 1 10 . 1 1 8 8 ASN C C 8 172.709 172.709 173.915 -1.206 25324 6496 1 10 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.337 -0.721 25324 6497 1 10 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.774 2.811 25324 6498 1 10 . 1 1 8 8 ASN H H 8 9.320 9.320 9.301 0.019 25324 6499 1 10 . 1 1 9 9 GLN N N 9 120.762 120.762 123.268 -2.506 25324 6500 1 10 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.475 -0.301 25324 6501 1 10 . 1 1 9 9 GLN C C 9 173.454 173.454 173.860 -0.406 25324 6502 1 10 . 1 1 9 9 GLN CA C 9 53.960 53.960 53.954 0.006 25324 6503 1 10 . 1 1 9 9 GLN CB C 9 30.691 30.691 30.978 -0.287 25324 6504 1 10 . 1 1 9 9 GLN H H 9 6.887 6.887 8.415 -1.528 25324 6505 1 10 . 1 1 10 10 TRP N N 10 127.775 127.775 124.437 3.338 25324 6506 1 10 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.055 -0.067 25324 6507 1 10 . 1 1 10 10 TRP C C 10 175.281 175.281 175.687 -0.406 25324 6508 1 10 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.337 -0.045 25324 6509 1 10 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.189 -1.447 25324 6510 1 10 . 1 1 10 10 TRP H H 10 8.518 8.518 7.961 0.557 25324 6511 1 10 . 1 1 11 11 GLY N N 11 107.838 107.838 110.677 -2.839 25324 6512 1 10 . 1 1 11 11 GLY C C 11 174.733 174.733 173.828 0.905 25324 6513 1 10 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.799 0.037 25324 6514 1 10 . 1 1 11 11 GLY H H 11 8.461 8.461 8.855 -0.394 25324 6515 1 10 . 1 1 12 12 GLY N N 12 109.696 109.696 106.993 2.703 25324 6516 1 10 . 1 1 12 12 GLY C C 12 174.133 174.133 175.263 -1.130 25324 6517 1 10 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.250 -0.461 25324 6518 1 10 . 1 1 12 12 GLY H H 12 8.138 8.138 7.404 0.734 25324 6519 1 10 . 1 1 13 13 SER N N 13 111.308 111.308 115.489 -4.181 25324 6520 1 10 . 1 1 13 13 SER HA H 13 4.092 4.092 4.075 0.017 25324 6521 1 10 . 1 1 13 13 SER C C 13 175.622 175.622 175.702 -0.080 25324 6522 1 10 . 1 1 13 13 SER CA C 13 60.494 60.494 60.752 -0.258 25324 6523 1 10 . 1 1 13 13 SER CB C 13 63.028 63.028 63.246 -0.218 25324 6524 1 10 . 1 1 13 13 SER H H 13 8.215 8.215 8.650 -0.435 25324 6525 1 10 . 1 1 14 14 SER N N 14 115.290 115.290 114.970 0.320 25324 6526 1 10 . 1 1 14 14 SER HA H 14 4.566 4.566 4.326 0.240 25324 6527 1 10 . 1 1 14 14 SER C C 14 173.532 173.532 174.323 -0.791 25324 6528 1 10 . 1 1 14 14 SER CA C 14 57.317 57.317 59.039 -1.722 25324 6529 1 10 . 1 1 14 14 SER CB C 14 63.230 63.230 63.282 -0.052 25324 6530 1 10 . 1 1 14 14 SER H H 14 8.213 8.213 7.967 0.246 25324 6531 1 10 . 1 1 15 15 ALA N N 15 126.470 126.470 125.505 0.965 25324 6532 1 10 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.489 -0.086 25324 6533 1 10 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.264 1.200 25324 6534 1 10 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.514 -0.285 25324 6535 1 10 . 1 1 15 15 ALA H H 15 7.308 7.308 7.474 -0.166 25324 6536 1 10 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.296 0.113 25324 6537 1 10 . 1 1 16 16 PRO C C 16 175.627 175.627 175.408 0.219 25324 6538 1 10 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.023 0.369 25324 6539 1 10 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.758 -0.621 25324 6540 1 10 . 1 1 17 17 TRP N N 17 120.228 120.228 118.564 1.664 25324 6541 1 10 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.678 -0.360 25324 6542 1 10 . 1 1 17 17 TRP C C 17 175.951 175.951 176.185 -0.234 25324 6543 1 10 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.958 -0.043 25324 6544 1 10 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.407 -0.998 25324 6545 1 10 . 1 1 17 17 TRP H H 17 8.380 8.380 8.180 0.200 25324 6546 1 10 . 1 1 18 18 ASN N N 18 120.663 120.663 123.135 -2.472 25324 6547 1 10 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.150 -0.064 25324 6548 1 10 . 1 1 18 18 ASN C C 18 174.793 174.793 174.451 0.342 25324 6549 1 10 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.605 -1.004 25324 6550 1 10 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.901 0.747 25324 6551 1 10 . 1 1 18 18 ASN H H 18 9.094 9.094 8.826 0.268 25324 6552 1 10 . 1 1 19 19 GLU N N 19 122.202 122.202 124.058 -1.856 25324 6553 1 10 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.593 -0.454 25324 6554 1 10 . 1 1 19 19 GLU C C 19 176.869 176.869 176.662 0.207 25324 6555 1 10 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.880 1.720 25324 6556 1 10 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.572 -0.190 25324 6557 1 10 . 1 1 19 19 GLU H H 19 9.013 9.013 9.008 0.005 25324 6558 1 10 . 1 1 20 20 GLY N N 20 112.893 112.893 111.581 1.312 25324 6559 1 10 . 1 1 20 20 GLY C C 20 174.878 174.878 173.239 1.639 25324 6560 1 10 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.740 0.255 25324 6561 1 10 . 1 1 20 20 GLY H H 20 8.926 8.926 8.769 0.157 25324 6562 1 10 . 1 1 21 21 GLY N N 21 110.354 110.354 108.131 2.223 25324 6563 1 10 . 1 1 21 21 GLY C C 21 171.623 171.623 171.683 -0.060 25324 6564 1 10 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.361 -0.963 25324 6565 1 10 . 1 1 21 21 GLY H H 21 8.258 8.258 7.476 0.782 25324 6566 1 10 . 1 1 22 22 GLN N N 22 117.541 117.541 117.874 -0.333 25324 6567 1 10 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.185 0.492 25324 6568 1 10 . 1 1 22 22 GLN C C 22 175.957 175.957 174.464 1.493 25324 6569 1 10 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.537 0.407 25324 6570 1 10 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.199 -1.114 25324 6571 1 10 . 1 1 22 22 GLN H H 22 8.564 8.564 8.529 0.035 25324 6572 1 10 . 1 1 23 23 TRP N N 23 127.208 127.208 123.003 4.205 25324 6573 1 10 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.045 0.154 25324 6574 1 10 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.638 -0.107 25324 6575 1 10 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.592 -0.909 25324 6576 1 10 . 1 1 23 23 TRP H H 23 9.347 9.347 8.972 0.375 25324 6577 1 10 . 1 1 24 24 GLU N N 24 123.504 123.504 121.189 2.315 25324 6578 1 10 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.499 0.009 25324 6579 1 10 . 1 1 24 24 GLU C C 24 174.222 174.222 175.304 -1.082 25324 6580 1 10 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.388 0.203 25324 6581 1 10 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.959 -2.344 25324 6582 1 10 . 1 1 24 24 GLU H H 24 9.296 9.296 8.729 0.567 25324 6583 1 10 . 1 1 25 25 ILE N N 25 123.447 123.447 126.305 -2.858 25324 6584 1 10 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.740 -0.304 25324 6585 1 10 . 1 1 25 25 ILE C C 25 175.790 175.790 174.569 1.221 25324 6586 1 10 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.005 -0.378 25324 6587 1 10 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.799 0.153 25324 6588 1 10 . 1 1 25 25 ILE H H 25 8.635 8.635 8.915 -0.280 25324 6589 1 10 . 1 1 26 26 GLY N N 26 111.544 111.544 113.534 -1.990 25324 6590 1 10 . 1 1 26 26 GLY C C 26 172.122 172.122 174.436 -2.314 25324 6591 1 10 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.451 -0.373 25324 6592 1 10 . 1 1 26 26 GLY H H 26 3.381 3.381 7.053 -3.672 25324 6593 1 10 . 1 1 27 27 SER N N 27 112.279 112.279 117.741 -5.462 25324 6594 1 10 . 1 1 27 27 SER HA H 27 4.876 4.876 4.571 0.305 25324 6595 1 10 . 1 1 27 27 SER C C 27 174.113 174.113 174.620 -0.507 25324 6596 1 10 . 1 1 27 27 SER CA C 27 56.954 56.954 58.614 -1.660 25324 6597 1 10 . 1 1 27 27 SER CB C 27 64.554 64.554 64.630 -0.076 25324 6598 1 10 . 1 1 27 27 SER H H 27 8.212 8.212 8.850 -0.638 25324 6599 1 10 . 1 1 28 28 ARG N N 28 120.872 120.872 122.255 -1.383 25324 6600 1 10 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.672 0.091 25324 6601 1 10 . 1 1 28 28 ARG C C 28 176.119 176.119 175.374 0.745 25324 6602 1 10 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.503 -0.386 25324 6603 1 10 . 1 1 28 28 ARG CB C 28 31.830 31.830 32.922 -1.092 25324 6604 1 10 . 1 1 28 28 ARG H H 28 7.849 7.849 8.069 -0.220 25324 6605 1 10 . 1 1 29 29 SER N N 29 118.985 118.985 118.944 0.041 25324 6606 1 10 . 1 1 29 29 SER HA H 29 4.192 4.192 4.301 -0.109 25324 6607 1 10 . 1 1 29 29 SER C C 29 174.622 174.622 174.891 -0.269 25324 6608 1 10 . 1 1 29 29 SER CA C 29 60.072 60.072 60.162 -0.090 25324 6609 1 10 . 1 1 29 29 SER CB C 29 62.876 62.876 63.356 -0.480 25324 6610 1 10 . 1 1 29 29 SER H H 29 8.892 8.892 8.749 0.143 25324 6611 1 10 . 1 1 30 30 ASP N N 30 117.632 117.632 120.094 -2.462 25324 6612 1 10 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.609 0.009 25324 6613 1 10 . 1 1 30 30 ASP C C 30 175.101 175.101 176.548 -1.447 25324 6614 1 10 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.357 -2.305 25324 6615 1 10 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.170 -0.647 25324 6616 1 10 . 1 1 30 30 ASP H H 30 8.441 8.441 8.236 0.205 25324 6617 1 10 . 1 1 31 31 GLN N N 31 118.273 118.273 118.432 -0.159 25324 6618 1 10 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.530 -0.045 25324 6619 1 10 . 1 1 31 31 GLN C C 31 173.453 173.453 174.360 -0.907 25324 6620 1 10 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.700 0.168 25324 6621 1 10 . 1 1 31 31 GLN CB C 31 33.249 33.249 29.840 3.409 25324 6622 1 10 . 1 1 31 31 GLN H H 31 7.029 7.029 7.983 -0.954 25324 6623 1 10 . 1 1 32 32 ASN N N 32 120.865 120.865 120.040 0.825 25324 6624 1 10 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.069 0.051 25324 6625 1 10 . 1 1 32 32 ASN C C 32 175.198 175.198 174.286 0.912 25324 6626 1 10 . 1 1 32 32 ASN CA C 32 51.869 51.869 51.771 0.098 25324 6627 1 10 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.596 -0.966 25324 6628 1 10 . 1 1 32 32 ASN H H 32 8.713 8.713 8.757 -0.044 25324 6629 1 10 . 1 1 33 33 VAL N N 33 122.111 122.111 119.666 2.445 25324 6630 1 10 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.386 -0.681 25324 6631 1 10 . 1 1 33 33 VAL C C 33 174.950 174.950 175.877 -0.927 25324 6632 1 10 . 1 1 33 33 VAL CA C 33 63.847 63.847 61.720 2.127 25324 6633 1 10 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.357 -0.007 25324 6634 1 10 . 1 1 33 33 VAL H H 33 8.542 8.542 8.792 -0.250 25324 6635 1 10 . 1 1 34 34 VAL N N 34 113.282 113.282 118.171 -4.889 25324 6636 1 10 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.753 -0.108 25324 6637 1 10 . 1 1 34 34 VAL C C 34 175.574 175.574 174.642 0.932 25324 6638 1 10 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.496 -1.522 25324 6639 1 10 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.790 -0.761 25324 6640 1 10 . 1 1 34 34 VAL H H 34 8.744 8.744 8.822 -0.078 25324 6641 1 10 . 1 1 35 35 ALA N N 35 122.102 122.102 121.583 0.519 25324 6642 1 10 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.256 -0.453 25324 6643 1 10 . 1 1 35 35 ALA C C 35 175.947 175.947 175.029 0.918 25324 6644 1 10 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.744 2.506 25324 6645 1 10 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.525 -0.897 25324 6646 1 10 . 1 1 35 35 ALA H H 35 7.677 7.677 7.820 -0.143 25324 6647 1 10 . 1 1 36 36 ILE N N 36 118.005 118.005 121.014 -3.009 25324 6648 1 10 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.266 -0.238 25324 6649 1 10 . 1 1 36 36 ILE C C 36 173.116 173.116 173.790 -0.674 25324 6650 1 10 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.100 1.081 25324 6651 1 10 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.730 0.755 25324 6652 1 10 . 1 1 36 36 ILE H H 36 8.126 8.126 8.609 -0.483 25324 6653 1 10 . 1 1 37 37 ASN N N 37 125.632 125.632 126.094 -0.462 25324 6654 1 10 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.962 -0.281 25324 6655 1 10 . 1 1 37 37 ASN C C 37 174.854 174.854 173.820 1.034 25324 6656 1 10 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.496 0.034 25324 6657 1 10 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.484 -2.631 25324 6658 1 10 . 1 1 37 37 ASN H H 37 8.577 8.577 8.895 -0.318 25324 6659 1 10 . 1 1 38 38 VAL N N 38 114.223 114.223 116.974 -2.751 25324 6660 1 10 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.961 0.242 25324 6661 1 10 . 1 1 38 38 VAL C C 38 174.854 174.854 173.344 1.510 25324 6662 1 10 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.587 -1.607 25324 6663 1 10 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.896 0.148 25324 6664 1 10 . 1 1 38 38 VAL H H 38 8.874 8.874 8.660 0.214 25324 6665 1 10 . 1 1 39 39 GLU N N 39 118.277 118.277 121.080 -2.803 25324 6666 1 10 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.306 -0.224 25324 6667 1 10 . 1 1 39 39 GLU C C 39 174.548 174.548 175.231 -0.683 25324 6668 1 10 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.033 0.960 25324 6669 1 10 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.597 -1.019 25324 6670 1 10 . 1 1 39 39 GLU H H 39 8.761 8.761 9.281 -0.520 25324 6671 1 10 . 1 1 40 40 SER N N 40 114.960 114.960 119.011 -4.051 25324 6672 1 10 . 1 1 40 40 SER HA H 40 5.265 5.265 5.223 0.042 25324 6673 1 10 . 1 1 40 40 SER C C 40 175.783 175.783 174.663 1.120 25324 6674 1 10 . 1 1 40 40 SER CA C 40 55.880 55.880 57.286 -1.406 25324 6675 1 10 . 1 1 40 40 SER CB C 40 65.911 65.911 63.972 1.939 25324 6676 1 10 . 1 1 40 40 SER H H 40 8.500 8.500 8.578 -0.078 25324 6677 1 10 . 1 1 41 41 GLY N N 41 117.567 117.567 109.630 7.937 25324 6678 1 10 . 1 1 41 41 GLY C C 41 174.119 174.119 174.074 0.045 25324 6679 1 10 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.470 -0.782 25324 6680 1 10 . 1 1 41 41 GLY H H 41 9.533 9.533 9.000 0.533 25324 6681 1 10 . 1 1 42 42 ASP N N 42 122.141 122.141 123.980 -1.839 25324 6682 1 10 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.771 0.029 25324 6683 1 10 . 1 1 42 42 ASP C C 42 176.121 176.121 175.547 0.574 25324 6684 1 10 . 1 1 42 42 ASP CA C 42 52.146 52.146 54.493 -2.347 25324 6685 1 10 . 1 1 42 42 ASP CB C 42 39.354 39.354 39.930 -0.576 25324 6686 1 10 . 1 1 42 42 ASP H H 42 8.644 8.644 8.068 0.576 25324 6687 1 10 . 1 1 43 43 ASP N N 43 116.025 116.025 121.906 -5.881 25324 6688 1 10 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.309 -0.080 25324 6689 1 10 . 1 1 43 43 ASP C C 43 176.018 176.018 176.042 -0.024 25324 6690 1 10 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.258 -0.009 25324 6691 1 10 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.455 -0.896 25324 6692 1 10 . 1 1 43 43 ASP H H 43 9.111 9.111 8.455 0.656 25324 6693 1 10 . 1 1 44 44 GLY N N 44 104.263 104.263 102.255 2.008 25324 6694 1 10 . 1 1 44 44 GLY C C 44 173.922 173.922 175.729 -1.807 25324 6695 1 10 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.487 -0.186 25324 6696 1 10 . 1 1 44 44 GLY H H 44 9.063 9.063 8.753 0.310 25324 6697 1 10 . 1 1 45 45 GLN N N 45 121.691 121.691 119.996 1.695 25324 6698 1 10 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.125 -0.039 25324 6699 1 10 . 1 1 45 45 GLN C C 45 176.284 176.284 175.510 0.774 25324 6700 1 10 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.554 -0.436 25324 6701 1 10 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.591 -1.917 25324 6702 1 10 . 1 1 45 45 GLN H H 45 7.356 7.356 8.349 -0.993 25324 6703 1 10 . 1 1 46 46 THR N N 46 111.843 111.843 115.698 -3.855 25324 6704 1 10 . 1 1 46 46 THR HA H 46 5.355 5.355 5.263 0.092 25324 6705 1 10 . 1 1 46 46 THR C C 46 174.451 174.451 173.003 1.448 25324 6706 1 10 . 1 1 46 46 THR CA C 46 59.644 59.644 62.236 -2.592 25324 6707 1 10 . 1 1 46 46 THR CB C 46 72.714 72.714 70.903 1.811 25324 6708 1 10 . 1 1 46 46 THR H H 46 10.123 10.123 7.475 2.648 25324 6709 1 10 . 1 1 47 47 LEU N N 47 119.302 119.302 127.495 -8.193 25324 6710 1 10 . 1 1 47 47 LEU HA H 47 4.807 4.807 5.088 -0.281 25324 6711 1 10 . 1 1 47 47 LEU C C 47 175.487 175.487 174.874 0.613 25324 6712 1 10 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.672 -0.602 25324 6713 1 10 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.823 3.180 25324 6714 1 10 . 1 1 47 47 LEU H H 47 8.364 8.364 8.994 -0.630 25324 6715 1 10 . 1 1 48 48 ASN N N 48 116.844 116.844 118.637 -1.793 25324 6716 1 10 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.127 -0.398 25324 6717 1 10 . 1 1 48 48 ASN C C 48 174.460 174.460 174.937 -0.477 25324 6718 1 10 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.166 1.573 25324 6719 1 10 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.274 1.139 25324 6720 1 10 . 1 1 48 48 ASN H H 48 8.748 8.748 9.099 -0.351 25324 6721 1 10 . 1 1 49 49 GLY N N 49 109.417 109.417 106.806 2.611 25324 6722 1 10 . 1 1 49 49 GLY C C 49 172.126 172.126 172.272 -0.146 25324 6723 1 10 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.294 0.197 25324 6724 1 10 . 1 1 49 49 GLY H H 49 8.744 8.744 8.889 -0.145 25324 6725 1 10 . 1 1 50 50 THR N N 50 119.162 119.162 113.928 5.234 25324 6726 1 10 . 1 1 50 50 THR HA H 50 5.556 5.556 5.709 -0.153 25324 6727 1 10 . 1 1 50 50 THR C C 50 171.790 171.790 173.027 -1.237 25324 6728 1 10 . 1 1 50 50 THR CA C 50 59.371 59.371 59.974 -0.603 25324 6729 1 10 . 1 1 50 50 THR CB C 50 72.799 72.799 72.400 0.399 25324 6730 1 10 . 1 1 50 50 THR H H 50 8.799 8.799 9.013 -0.214 25324 6731 1 10 . 1 1 51 51 MET N N 51 115.232 115.232 123.132 -7.900 25324 6732 1 10 . 1 1 51 51 MET HA H 51 4.886 4.886 4.895 -0.009 25324 6733 1 10 . 1 1 51 51 MET C C 51 172.708 172.708 173.752 -1.044 25324 6734 1 10 . 1 1 51 51 MET CA C 51 54.722 54.722 53.974 0.748 25324 6735 1 10 . 1 1 51 51 MET CB C 51 34.557 34.557 37.371 -2.814 25324 6736 1 10 . 1 1 51 51 MET H H 51 9.062 9.062 9.058 0.004 25324 6737 1 10 . 1 1 52 52 THR N N 52 113.697 113.697 121.910 -8.213 25324 6738 1 10 . 1 1 52 52 THR HA H 52 4.682 4.682 5.081 -0.399 25324 6739 1 10 . 1 1 52 52 THR C C 52 173.952 173.952 173.806 0.146 25324 6740 1 10 . 1 1 52 52 THR CA C 52 61.395 61.395 61.264 0.131 25324 6741 1 10 . 1 1 52 52 THR CB C 52 71.734 71.734 70.964 0.770 25324 6742 1 10 . 1 1 52 52 THR H H 52 8.685 8.685 8.838 -0.153 25324 6743 1 10 . 1 1 53 53 TYR N N 53 129.086 129.086 125.752 3.334 25324 6744 1 10 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.828 -0.028 25324 6745 1 10 . 1 1 53 53 TYR C C 53 175.214 175.214 176.193 -0.979 25324 6746 1 10 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.306 0.575 25324 6747 1 10 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.685 0.827 25324 6748 1 10 . 1 1 53 53 TYR H H 53 10.112 10.112 8.550 1.562 25324 6749 1 10 . 1 1 54 54 ALA N N 54 119.947 119.947 123.572 -3.625 25324 6750 1 10 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.272 -0.270 25324 6751 1 10 . 1 1 54 54 ALA C C 54 178.285 178.285 177.831 0.454 25324 6752 1 10 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.429 0.542 25324 6753 1 10 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.243 0.474 25324 6754 1 10 . 1 1 54 54 ALA H H 54 8.704 8.704 8.661 0.043 25324 6755 1 10 . 1 1 55 55 GLY N N 55 110.940 110.940 111.460 -0.520 25324 6756 1 10 . 1 1 55 55 GLY C C 55 173.903 173.903 174.262 -0.359 25324 6757 1 10 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.367 -0.351 25324 6758 1 10 . 1 1 55 55 GLY H H 55 8.745 8.745 8.604 0.141 25324 6759 1 10 . 1 1 56 56 GLU N N 56 120.073 120.073 120.030 0.043 25324 6760 1 10 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.819 -0.110 25324 6761 1 10 . 1 1 56 56 GLU C C 56 175.906 175.906 176.187 -0.281 25324 6762 1 10 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.940 -0.517 25324 6763 1 10 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.517 0.307 25324 6764 1 10 . 1 1 56 56 GLU H H 56 8.039 8.039 8.113 -0.074 25324 6765 1 10 . 1 1 57 57 GLY N N 57 105.298 105.298 107.594 -2.296 25324 6766 1 10 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.494 0.308 25324 6767 1 10 . 1 1 57 57 GLY H H 57 7.937 7.937 8.275 -0.338 25324 6768 1 10 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.798 0.136 25324 6769 1 10 . 1 1 58 58 PRO C C 58 177.785 177.785 176.420 1.365 25324 6770 1 10 . 1 1 58 58 PRO CA C 58 63.132 63.132 62.802 0.330 25324 6771 1 10 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.439 -0.599 25324 6772 1 10 . 1 1 59 59 ILE N N 59 117.386 117.386 116.860 0.526 25324 6773 1 10 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.743 0.245 25324 6774 1 10 . 1 1 59 59 ILE C C 59 175.688 175.688 174.805 0.883 25324 6775 1 10 . 1 1 59 59 ILE CA C 59 59.543 59.543 58.884 0.659 25324 6776 1 10 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.741 0.547 25324 6777 1 10 . 1 1 59 59 ILE H H 59 9.600 9.600 8.734 0.866 25324 6778 1 10 . 1 1 60 60 GLY N N 60 107.164 107.164 106.954 0.210 25324 6779 1 10 . 1 1 60 60 GLY C C 60 173.787 173.787 172.561 1.226 25324 6780 1 10 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.451 1.784 25324 6781 1 10 . 1 1 60 60 GLY H H 60 8.957 8.957 8.808 0.149 25324 6782 1 10 . 1 1 61 61 PHE N N 61 124.597 124.597 126.147 -1.550 25324 6783 1 10 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.187 0.036 25324 6784 1 10 . 1 1 61 61 PHE C C 61 173.126 173.126 173.385 -0.259 25324 6785 1 10 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.584 0.278 25324 6786 1 10 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.402 -0.185 25324 6787 1 10 . 1 1 61 61 PHE H H 61 8.788 8.788 9.266 -0.478 25324 6788 1 10 . 1 1 62 62 ARG N N 62 129.706 129.706 127.726 1.980 25324 6789 1 10 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.415 -0.283 25324 6790 1 10 . 1 1 62 62 ARG C C 62 172.456 172.456 173.084 -0.628 25324 6791 1 10 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.026 0.928 25324 6792 1 10 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.332 -1.462 25324 6793 1 10 . 1 1 62 62 ARG H H 62 8.405 8.405 8.360 0.045 25324 6794 1 10 . 1 1 63 63 ALA N N 63 122.744 122.744 128.886 -6.142 25324 6795 1 10 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.435 -0.090 25324 6796 1 10 . 1 1 63 63 ALA C C 63 176.120 176.120 175.637 0.483 25324 6797 1 10 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.040 -0.121 25324 6798 1 10 . 1 1 63 63 ALA CB C 63 24.773 24.773 23.088 1.685 25324 6799 1 10 . 1 1 63 63 ALA H H 63 8.628 8.628 8.948 -0.320 25324 6800 1 10 . 1 1 64 64 THR N N 64 116.855 116.855 117.365 -0.510 25324 6801 1 10 . 1 1 64 64 THR HA H 64 4.848 4.848 5.365 -0.517 25324 6802 1 10 . 1 1 64 64 THR C C 64 172.957 172.957 173.481 -0.524 25324 6803 1 10 . 1 1 64 64 THR CA C 64 61.211 61.211 61.016 0.195 25324 6804 1 10 . 1 1 64 64 THR CB C 64 71.064 71.064 71.935 -0.871 25324 6805 1 10 . 1 1 64 64 THR H H 64 8.315 8.315 8.579 -0.264 25324 6806 1 10 . 1 1 65 65 LEU N N 65 129.360 129.360 128.601 0.759 25324 6807 1 10 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.849 -0.487 25324 6808 1 10 . 1 1 65 65 LEU C C 65 176.459 176.459 176.500 -0.041 25324 6809 1 10 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.815 0.872 25324 6810 1 10 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.910 -0.199 25324 6811 1 10 . 1 1 65 65 LEU H H 65 8.877 8.877 8.643 0.234 25324 6812 1 10 . 1 1 66 66 LEU N N 66 128.683 128.683 127.729 0.954 25324 6813 1 10 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.134 0.242 25324 6814 1 10 . 1 1 66 66 LEU C C 66 177.621 177.621 177.750 -0.129 25324 6815 1 10 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.162 -1.462 25324 6816 1 10 . 1 1 66 66 LEU CB C 66 42.302 42.302 41.890 0.412 25324 6817 1 10 . 1 1 66 66 LEU H H 66 9.320 9.320 9.010 0.310 25324 6818 1 10 . 1 1 67 67 GLY N N 67 105.361 105.361 103.602 1.759 25324 6819 1 10 . 1 1 67 67 GLY C C 67 173.618 173.618 174.012 -0.394 25324 6820 1 10 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.917 -1.550 25324 6821 1 10 . 1 1 67 67 GLY H H 67 6.639 6.639 7.995 -1.356 25324 6822 1 10 . 1 1 68 68 ASN N N 68 121.848 121.848 120.069 1.779 25324 6823 1 10 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.894 -0.563 25324 6824 1 10 . 1 1 68 68 ASN C C 68 174.316 174.316 174.669 -0.353 25324 6825 1 10 . 1 1 68 68 ASN CA C 68 54.552 54.552 52.553 1.999 25324 6826 1 10 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.582 -2.417 25324 6827 1 10 . 1 1 68 68 ASN H H 68 9.236 9.236 7.955 1.281 25324 6828 1 10 . 1 1 69 69 ASN N N 69 109.509 109.509 116.540 -7.031 25324 6829 1 10 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.439 -0.359 25324 6830 1 10 . 1 1 69 69 ASN C C 69 171.456 171.456 173.651 -2.195 25324 6831 1 10 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.881 0.869 25324 6832 1 10 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.823 -0.517 25324 6833 1 10 . 1 1 69 69 ASN H H 69 8.651 8.651 8.507 0.144 25324 6834 1 10 . 1 1 70 70 SER N N 70 113.479 113.479 113.170 0.309 25324 6835 1 10 . 1 1 70 70 SER HA H 70 5.437 5.437 5.172 0.265 25324 6836 1 10 . 1 1 70 70 SER C C 70 173.750 173.750 173.599 0.151 25324 6837 1 10 . 1 1 70 70 SER CA C 70 57.139 57.139 58.564 -1.425 25324 6838 1 10 . 1 1 70 70 SER CB C 70 63.818 63.818 64.181 -0.364 25324 6839 1 10 . 1 1 70 70 SER H H 70 7.693 7.693 7.521 0.172 25324 6840 1 10 . 1 1 71 71 TYR N N 71 123.132 123.132 123.715 -0.583 25324 6841 1 10 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.161 -0.018 25324 6842 1 10 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.573 0.075 25324 6843 1 10 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.332 0.113 25324 6844 1 10 . 1 1 71 71 TYR H H 71 9.326 9.326 9.601 -0.275 25324 6845 1 10 . 1 1 72 72 GLU N N 72 122.396 122.396 123.299 -0.903 25324 6846 1 10 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.865 -0.059 25324 6847 1 10 . 1 1 72 72 GLU C C 72 175.698 175.698 175.248 0.450 25324 6848 1 10 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.172 -0.005 25324 6849 1 10 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.477 -1.293 25324 6850 1 10 . 1 1 72 72 GLU H H 72 8.624 8.624 9.079 -0.455 25324 6851 1 10 . 1 1 73 73 VAL N N 73 128.513 128.513 128.010 0.503 25324 6852 1 10 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.239 -0.040 25324 6853 1 10 . 1 1 73 73 VAL C C 73 175.369 175.369 174.421 0.948 25324 6854 1 10 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.023 0.457 25324 6855 1 10 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.090 0.243 25324 6856 1 10 . 1 1 73 73 VAL H H 73 8.564 8.564 9.013 -0.449 25324 6857 1 10 . 1 1 74 74 GLU N N 74 124.842 124.842 126.718 -1.876 25324 6858 1 10 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.019 0.068 25324 6859 1 10 . 1 1 74 74 GLU C C 74 174.415 174.415 174.816 -0.401 25324 6860 1 10 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.792 -0.455 25324 6861 1 10 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.026 2.131 25324 6862 1 10 . 1 1 74 74 GLU H H 74 9.011 9.011 8.938 0.073 25324 6863 1 10 . 1 1 75 75 ASN N N 75 116.136 116.136 122.682 -6.546 25324 6864 1 10 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.449 0.690 25324 6865 1 10 . 1 1 75 75 ASN C C 75 172.703 172.703 174.051 -1.348 25324 6866 1 10 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.872 -0.047 25324 6867 1 10 . 1 1 75 75 ASN CB C 75 45.896 45.896 41.570 4.326 25324 6868 1 10 . 1 1 75 75 ASN H H 75 9.424 9.424 8.906 0.518 25324 6869 1 10 . 1 1 76 76 GLN N N 76 120.762 120.762 122.161 -1.399 25324 6870 1 10 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.476 -0.436 25324 6871 1 10 . 1 1 76 76 GLN C C 76 173.113 173.113 173.973 -0.860 25324 6872 1 10 . 1 1 76 76 GLN CA C 76 54.223 54.223 53.949 0.274 25324 6873 1 10 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.652 -1.304 25324 6874 1 10 . 1 1 76 76 GLN H H 76 7.106 7.106 8.848 -1.742 25324 6875 1 10 . 1 1 77 77 TRP N N 77 125.598 125.598 124.893 0.705 25324 6876 1 10 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.056 0.096 25324 6877 1 10 . 1 1 77 77 TRP C C 77 175.502 175.502 175.616 -0.114 25324 6878 1 10 . 1 1 77 77 TRP CA C 77 55.764 55.764 55.391 0.373 25324 6879 1 10 . 1 1 77 77 TRP CB C 77 29.999 29.999 29.146 0.853 25324 6880 1 10 . 1 1 77 77 TRP H H 77 8.181 8.181 7.914 0.267 25324 6881 1 10 . 1 1 78 78 GLY N N 78 107.901 107.901 112.657 -4.756 25324 6882 1 10 . 1 1 78 78 GLY C C 78 174.611 174.611 173.207 1.404 25324 6883 1 10 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.511 0.391 25324 6884 1 10 . 1 1 78 78 GLY H H 78 8.778 8.778 7.638 1.140 25324 6885 1 10 . 1 1 79 79 GLY N N 79 109.844 109.844 106.879 2.965 25324 6886 1 10 . 1 1 79 79 GLY C C 79 173.782 173.782 175.093 -1.311 25324 6887 1 10 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.318 -0.525 25324 6888 1 10 . 1 1 79 79 GLY H H 79 8.198 8.198 8.164 0.034 25324 6889 1 10 . 1 1 80 80 ASP N N 80 115.837 115.837 118.091 -2.254 25324 6890 1 10 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.586 -0.345 25324 6891 1 10 . 1 1 80 80 ASP C C 80 177.285 177.285 176.660 0.625 25324 6892 1 10 . 1 1 80 80 ASP CA C 80 56.183 56.183 54.921 1.262 25324 6893 1 10 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.080 -0.557 25324 6894 1 10 . 1 1 80 80 ASP H H 80 8.132 8.132 8.364 -0.232 25324 6895 1 10 . 1 1 81 81 SER N N 81 112.690 112.690 113.348 -0.658 25324 6896 1 10 . 1 1 81 81 SER HA H 81 4.513 4.513 4.440 0.073 25324 6897 1 10 . 1 1 81 81 SER C C 81 173.684 173.684 174.152 -0.468 25324 6898 1 10 . 1 1 81 81 SER CA C 81 57.232 57.232 57.793 -0.561 25324 6899 1 10 . 1 1 81 81 SER CB C 81 63.170 63.170 63.480 -0.310 25324 6900 1 10 . 1 1 81 81 SER H H 81 8.179 8.179 7.800 0.379 25324 6901 1 10 . 1 1 82 82 ALA N N 82 126.310 126.310 125.884 0.426 25324 6902 1 10 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.398 0.005 25324 6903 1 10 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.289 0.177 25324 6904 1 10 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.189 0.009 25324 6905 1 10 . 1 1 82 82 ALA H H 82 7.274 7.274 7.025 0.249 25324 6906 1 10 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.200 0.173 25324 6907 1 10 . 1 1 83 83 PRO C C 83 175.378 175.378 175.138 0.240 25324 6908 1 10 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.372 -0.045 25324 6909 1 10 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.467 -0.303 25324 6910 1 10 . 1 1 84 84 TRP N N 84 120.106 120.106 119.076 1.030 25324 6911 1 10 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.482 -0.211 25324 6912 1 10 . 1 1 84 84 TRP C C 84 176.358 176.358 175.845 0.513 25324 6913 1 10 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.593 0.353 25324 6914 1 10 . 1 1 84 84 TRP CB C 84 29.716 29.716 31.049 -1.333 25324 6915 1 10 . 1 1 84 84 TRP H H 84 8.329 8.329 8.180 0.149 25324 6916 1 10 . 1 1 85 85 HIS N N 85 118.543 118.543 121.849 -3.306 25324 6917 1 10 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.956 -0.038 25324 6918 1 10 . 1 1 85 85 HIS C C 85 174.950 174.950 174.370 0.580 25324 6919 1 10 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.804 -1.335 25324 6920 1 10 . 1 1 85 85 HIS CB C 85 31.673 31.673 34.011 -2.338 25324 6921 1 10 . 1 1 85 85 HIS H H 85 9.204 9.204 8.835 0.369 25324 6922 1 10 . 1 1 86 86 SER N N 86 117.803 117.803 115.964 1.839 25324 6923 1 10 . 1 1 86 86 SER HA H 86 4.412 4.412 4.334 0.078 25324 6924 1 10 . 1 1 86 86 SER C C 86 175.691 175.691 175.014 0.677 25324 6925 1 10 . 1 1 86 86 SER CA C 86 60.257 60.257 58.772 1.485 25324 6926 1 10 . 1 1 86 86 SER CB C 86 63.015 63.015 64.279 -1.264 25324 6927 1 10 . 1 1 86 86 SER H H 86 9.168 9.168 8.656 0.512 25324 6928 1 10 . 1 1 87 87 GLY N N 87 115.773 115.773 110.520 5.253 25324 6929 1 10 . 1 1 87 87 GLY C C 87 174.288 174.288 173.901 0.387 25324 6930 1 10 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.870 -0.169 25324 6931 1 10 . 1 1 87 87 GLY H H 87 9.284 9.284 9.045 0.239 25324 6932 1 10 . 1 1 88 88 GLY N N 88 109.162 109.162 107.831 1.331 25324 6933 1 10 . 1 1 88 88 GLY C C 88 171.120 171.120 171.587 -0.467 25324 6934 1 10 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.176 -0.582 25324 6935 1 10 . 1 1 88 88 GLY H H 88 8.054 8.054 7.995 0.059 25324 6936 1 10 . 1 1 89 89 ASN N N 89 117.048 117.048 119.532 -2.484 25324 6937 1 10 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.691 0.347 25324 6938 1 10 . 1 1 89 89 ASN C C 89 175.287 175.287 174.831 0.456 25324 6939 1 10 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.220 -1.355 25324 6940 1 10 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.576 -0.971 25324 6941 1 10 . 1 1 89 89 ASN H H 89 8.516 8.516 8.736 -0.220 25324 6942 1 10 . 1 1 90 90 TRP N N 90 125.844 125.844 124.231 1.613 25324 6943 1 10 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.092 0.161 25324 6944 1 10 . 1 1 90 90 TRP C C 90 175.278 175.278 174.813 0.465 25324 6945 1 10 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.239 0.030 25324 6946 1 10 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.147 -0.189 25324 6947 1 10 . 1 1 90 90 TRP H H 90 9.282 9.282 9.493 -0.211 25324 6948 1 10 . 1 1 91 91 ILE N N 91 123.134 123.134 121.142 1.992 25324 6949 1 10 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.775 0.671 25324 6950 1 10 . 1 1 91 91 ILE C C 91 175.489 175.489 175.154 0.335 25324 6951 1 10 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.971 0.855 25324 6952 1 10 . 1 1 91 91 ILE CB C 91 39.676 39.676 37.579 2.097 25324 6953 1 10 . 1 1 91 91 ILE H H 91 9.318 9.318 8.761 0.557 25324 6954 1 10 . 1 1 92 92 LEU N N 92 123.452 123.452 128.948 -5.496 25324 6955 1 10 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.766 0.176 25324 6956 1 10 . 1 1 92 92 LEU C C 92 173.620 173.620 174.388 -0.768 25324 6957 1 10 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.667 -1.411 25324 6958 1 10 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.543 1.965 25324 6959 1 10 . 1 1 92 92 LEU H H 92 8.463 8.463 9.058 -0.595 25324 6960 1 10 . 1 1 93 93 GLY N N 93 103.987 103.987 108.019 -4.032 25324 6961 1 10 . 1 1 93 93 GLY C C 93 172.284 172.284 174.594 -2.310 25324 6962 1 10 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.650 -2.150 25324 6963 1 10 . 1 1 93 93 GLY H H 93 2.937 2.937 7.414 -4.477 25324 6964 1 10 . 1 1 94 94 SER N N 94 110.274 110.274 119.217 -8.943 25324 6965 1 10 . 1 1 94 94 SER HA H 94 4.711 4.711 4.755 -0.044 25324 6966 1 10 . 1 1 94 94 SER C C 94 174.784 174.784 175.819 -1.035 25324 6967 1 10 . 1 1 94 94 SER CA C 94 56.555 56.555 58.936 -2.381 25324 6968 1 10 . 1 1 94 94 SER CB C 94 65.051 65.051 64.690 0.361 25324 6969 1 10 . 1 1 94 94 SER H H 94 7.919 7.919 9.266 -1.347 25324 6970 1 10 . 1 1 95 95 ARG N N 95 123.020 123.020 120.978 2.042 25324 6971 1 10 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.355 0.317 25324 6972 1 10 . 1 1 95 95 ARG C C 95 176.120 176.120 176.014 0.106 25324 6973 1 10 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.904 -0.529 25324 6974 1 10 . 1 1 95 95 ARG CB C 95 31.848 31.848 29.277 2.571 25324 6975 1 10 . 1 1 95 95 ARG H H 95 9.148 9.148 8.196 0.952 25324 6976 1 10 . 1 1 96 96 GLU N N 96 120.357 120.357 119.096 1.261 25324 6977 1 10 . 1 1 96 96 GLU HA H 96 4.282 4.282 3.955 0.327 25324 6978 1 10 . 1 1 96 96 GLU C C 96 176.278 176.278 175.909 0.369 25324 6979 1 10 . 1 1 96 96 GLU CA C 96 56.530 56.530 59.106 -2.576 25324 6980 1 10 . 1 1 96 96 GLU CB C 96 30.153 30.153 28.021 2.132 25324 6981 1 10 . 1 1 96 96 GLU H H 96 8.610 8.610 8.266 0.344 25324 6982 1 10 . 1 1 97 97 ASN N N 97 117.678 117.678 119.158 -1.480 25324 6983 1 10 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.805 -0.193 25324 6984 1 10 . 1 1 97 97 ASN C C 97 173.949 173.949 174.235 -0.286 25324 6985 1 10 . 1 1 97 97 ASN CA C 97 53.015 53.015 53.631 -0.616 25324 6986 1 10 . 1 1 97 97 ASN CB C 97 38.166 38.166 39.144 -0.978 25324 6987 1 10 . 1 1 97 97 ASN H H 97 8.533 8.533 8.220 0.313 25324 6988 1 10 . 1 1 98 98 GLN N N 98 118.592 118.592 119.705 -1.113 25324 6989 1 10 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.504 -0.144 25324 6990 1 10 . 1 1 98 98 GLN C C 98 173.116 173.116 173.874 -0.758 25324 6991 1 10 . 1 1 98 98 GLN CA C 98 55.628 55.628 54.987 0.641 25324 6992 1 10 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.796 0.073 25324 6993 1 10 . 1 1 98 98 GLN H H 98 7.663 7.663 7.774 -0.112 25324 6994 1 10 . 1 1 99 99 ASN N N 99 122.855 122.855 122.667 0.188 25324 6995 1 10 . 1 1 99 99 ASN HA H 99 5.135 5.135 4.998 0.137 25324 6996 1 10 . 1 1 99 99 ASN C C 99 175.287 175.287 175.073 0.214 25324 6997 1 10 . 1 1 99 99 ASN CA C 99 52.990 52.990 53.096 -0.106 25324 6998 1 10 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.681 -0.190 25324 6999 1 10 . 1 1 99 99 ASN H H 99 8.759 8.759 8.672 0.087 25324 7000 1 10 . 1 1 100 100 VAL N N 100 121.385 121.385 119.998 1.387 25324 7001 1 10 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.583 0.165 25324 7002 1 10 . 1 1 100 100 VAL C C 100 174.956 174.956 176.250 -1.294 25324 7003 1 10 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.864 -0.021 25324 7004 1 10 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.396 1.046 25324 7005 1 10 . 1 1 100 100 VAL H H 100 8.717 8.717 7.897 0.820 25324 7006 1 10 . 1 1 101 101 VAL N N 101 112.736 112.736 121.277 -8.541 25324 7007 1 10 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.385 0.260 25324 7008 1 10 . 1 1 101 101 VAL C C 101 175.577 175.577 174.514 1.063 25324 7009 1 10 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.149 -1.186 25324 7010 1 10 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.449 -0.408 25324 7011 1 10 . 1 1 101 101 VAL H H 101 8.802 8.802 8.789 0.013 25324 7012 1 10 . 1 1 102 102 ALA N N 102 122.104 122.104 120.207 1.897 25324 7013 1 10 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.030 -0.223 25324 7014 1 10 . 1 1 102 102 ALA C C 102 176.046 176.046 174.879 1.167 25324 7015 1 10 . 1 1 102 102 ALA CA C 102 53.254 53.254 51.330 1.924 25324 7016 1 10 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.094 -0.469 25324 7017 1 10 . 1 1 102 102 ALA H H 102 7.677 7.677 7.655 0.022 25324 7018 1 10 . 1 1 103 103 ILE N N 103 118.218 118.218 120.947 -2.729 25324 7019 1 10 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.306 -0.279 25324 7020 1 10 . 1 1 103 103 ILE C C 103 173.118 173.118 173.816 -0.698 25324 7021 1 10 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.676 1.551 25324 7022 1 10 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.649 0.822 25324 7023 1 10 . 1 1 103 103 ILE H H 103 8.102 8.102 8.404 -0.302 25324 7024 1 10 . 1 1 104 104 ASN N N 104 125.938 125.938 126.587 -0.649 25324 7025 1 10 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.299 0.387 25324 7026 1 10 . 1 1 104 104 ASN C C 104 174.870 174.870 173.545 1.325 25324 7027 1 10 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.441 0.112 25324 7028 1 10 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.388 -1.536 25324 7029 1 10 . 1 1 104 104 ASN H H 104 8.668 8.668 8.752 -0.084 25324 7030 1 10 . 1 1 105 105 VAL N N 105 114.631 114.631 120.067 -5.436 25324 7031 1 10 . 1 1 105 105 VAL HA H 105 5.205 5.205 4.934 0.271 25324 7032 1 10 . 1 1 105 105 VAL C C 105 174.788 174.788 173.857 0.931 25324 7033 1 10 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.417 -2.438 25324 7034 1 10 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.244 0.796 25324 7035 1 10 . 1 1 105 105 VAL H H 105 8.933 8.933 8.791 0.142 25324 7036 1 10 . 1 1 106 106 GLU N N 106 118.347 118.347 127.235 -8.888 25324 7037 1 10 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.029 0.051 25324 7038 1 10 . 1 1 106 106 GLU C C 106 174.777 174.777 175.225 -0.448 25324 7039 1 10 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.383 -0.416 25324 7040 1 10 . 1 1 106 106 GLU CB C 106 33.643 33.643 31.458 2.185 25324 7041 1 10 . 1 1 106 106 GLU H H 106 8.814 8.814 8.468 0.346 25324 7042 1 10 . 1 1 107 107 SER N N 107 115.335 115.335 118.328 -2.993 25324 7043 1 10 . 1 1 107 107 SER HA H 107 5.266 5.266 4.782 0.484 25324 7044 1 10 . 1 1 107 107 SER C C 107 175.787 175.787 172.554 3.233 25324 7045 1 10 . 1 1 107 107 SER CA C 107 55.888 55.888 57.944 -2.056 25324 7046 1 10 . 1 1 107 107 SER CB C 107 65.921 65.921 66.788 -0.867 25324 7047 1 10 . 1 1 107 107 SER H H 107 8.576 8.576 9.119 -0.543 25324 7048 1 10 . 1 1 108 108 GLY N N 108 117.567 117.567 108.660 8.907 25324 7049 1 10 . 1 1 108 108 GLY C C 108 173.959 173.959 173.939 0.020 25324 7050 1 10 . 1 1 108 108 GLY CA C 108 44.677 44.677 44.924 -0.247 25324 7051 1 10 . 1 1 108 108 GLY H H 108 9.532 9.532 8.463 1.069 25324 7052 1 10 . 1 1 109 109 ASP N N 109 122.108 122.108 122.545 -0.437 25324 7053 1 10 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.580 0.221 25324 7054 1 10 . 1 1 109 109 ASP C C 109 176.203 176.203 176.527 -0.324 25324 7055 1 10 . 1 1 109 109 ASP CA C 109 52.134 52.134 56.081 -3.947 25324 7056 1 10 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.230 -1.888 25324 7057 1 10 . 1 1 109 109 ASP H H 109 8.605 8.605 8.796 -0.191 25324 7058 1 10 . 1 1 110 110 ASP N N 110 116.197 116.197 117.803 -1.606 25324 7059 1 10 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.720 -0.498 25324 7060 1 10 . 1 1 110 110 ASP C C 110 175.951 175.951 175.679 0.272 25324 7061 1 10 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.420 1.778 25324 7062 1 10 . 1 1 110 110 ASP CB C 110 38.630 38.630 41.273 -2.643 25324 7063 1 10 . 1 1 110 110 ASP H H 110 9.087 9.087 7.971 1.116 25324 7064 1 10 . 1 1 111 111 GLY N N 111 103.841 103.841 107.065 -3.224 25324 7065 1 10 . 1 1 111 111 GLY C C 111 173.924 173.924 175.111 -1.187 25324 7066 1 10 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.627 -0.465 25324 7067 1 10 . 1 1 111 111 GLY H H 111 8.930 8.930 8.177 0.753 25324 7068 1 10 . 1 1 112 112 GLN N N 112 121.626 121.626 117.714 3.912 25324 7069 1 10 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.231 -0.161 25324 7070 1 10 . 1 1 112 112 GLN C C 112 176.431 176.431 175.635 0.796 25324 7071 1 10 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.090 0.183 25324 7072 1 10 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.364 -1.671 25324 7073 1 10 . 1 1 112 112 GLN H H 112 7.351 7.351 8.191 -0.840 25324 7074 1 10 . 1 1 113 113 THR N N 113 112.322 112.322 106.819 5.503 25324 7075 1 10 . 1 1 113 113 THR HA H 113 5.331 5.331 5.085 0.246 25324 7076 1 10 . 1 1 113 113 THR C C 113 174.452 174.452 173.255 1.197 25324 7077 1 10 . 1 1 113 113 THR CA C 113 59.739 59.739 59.900 -0.161 25324 7078 1 10 . 1 1 113 113 THR CB C 113 71.773 71.773 71.768 0.005 25324 7079 1 10 . 1 1 113 113 THR H H 113 10.053 10.053 7.560 2.493 25324 7080 1 10 . 1 1 114 114 LEU N N 114 122.083 122.083 122.409 -0.326 25324 7081 1 10 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.671 -0.090 25324 7082 1 10 . 1 1 114 114 LEU C C 114 175.113 175.113 174.878 0.235 25324 7083 1 10 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.073 -1.168 25324 7084 1 10 . 1 1 114 114 LEU CB C 114 47.033 47.033 45.118 1.915 25324 7085 1 10 . 1 1 114 114 LEU H H 114 8.978 8.978 8.871 0.107 25324 7086 1 10 . 1 1 115 115 ASN N N 115 118.846 118.846 120.255 -1.409 25324 7087 1 10 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.910 -0.140 25324 7088 1 10 . 1 1 115 115 ASN C C 115 174.788 174.788 174.885 -0.097 25324 7089 1 10 . 1 1 115 115 ASN CA C 115 52.342 52.342 52.009 0.333 25324 7090 1 10 . 1 1 115 115 ASN CB C 115 43.414 43.414 43.313 0.101 25324 7091 1 10 . 1 1 115 115 ASN H H 115 8.837 8.837 8.727 0.110 25324 7092 1 10 . 1 1 116 116 GLY N N 116 109.661 109.661 108.604 1.057 25324 7093 1 10 . 1 1 116 116 GLY C C 116 172.452 172.452 172.457 -0.005 25324 7094 1 10 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.310 0.161 25324 7095 1 10 . 1 1 116 116 GLY H H 116 8.625 8.625 9.043 -0.418 25324 7096 1 10 . 1 1 117 117 THR N N 117 120.009 120.009 114.404 5.605 25324 7097 1 10 . 1 1 117 117 THR HA H 117 5.556 5.556 5.734 -0.178 25324 7098 1 10 . 1 1 117 117 THR C C 117 171.619 171.619 173.269 -1.650 25324 7099 1 10 . 1 1 117 117 THR CA C 117 59.373 59.373 60.228 -0.855 25324 7100 1 10 . 1 1 117 117 THR CB C 117 72.777 72.777 72.790 -0.013 25324 7101 1 10 . 1 1 117 117 THR H H 117 8.911 8.911 8.978 -0.067 25324 7102 1 10 . 1 1 118 118 MET N N 118 115.550 115.550 118.100 -2.550 25324 7103 1 10 . 1 1 118 118 MET HA H 118 4.889 4.889 5.271 -0.382 25324 7104 1 10 . 1 1 118 118 MET C C 118 172.707 172.707 174.496 -1.789 25324 7105 1 10 . 1 1 118 118 MET CA C 118 54.714 54.714 54.698 0.016 25324 7106 1 10 . 1 1 118 118 MET CB C 118 33.663 33.663 37.388 -3.725 25324 7107 1 10 . 1 1 118 118 MET H H 118 9.159 9.159 9.412 -0.253 25324 7108 1 10 . 1 1 119 119 THR N N 119 113.716 113.716 117.841 -4.125 25324 7109 1 10 . 1 1 119 119 THR HA H 119 4.682 4.682 4.897 -0.215 25324 7110 1 10 . 1 1 119 119 THR C C 119 173.952 173.952 173.282 0.670 25324 7111 1 10 . 1 1 119 119 THR CA C 119 61.395 61.395 61.615 -0.220 25324 7112 1 10 . 1 1 119 119 THR CB C 119 71.746 71.746 71.308 0.438 25324 7113 1 10 . 1 1 119 119 THR H H 119 8.685 8.685 8.836 -0.151 25324 7114 1 10 . 1 1 120 120 TYR N N 120 129.153 129.153 126.377 2.776 25324 7115 1 10 . 1 1 120 120 TYR HA H 120 4.800 4.800 5.056 -0.256 25324 7116 1 10 . 1 1 120 120 TYR C C 120 175.214 175.214 175.552 -0.338 25324 7117 1 10 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.362 1.514 25324 7118 1 10 . 1 1 120 120 TYR CB C 120 40.502 40.502 41.670 -1.168 25324 7119 1 10 . 1 1 120 120 TYR H H 120 10.107 10.107 8.731 1.376 25324 7120 1 10 . 1 1 121 121 ALA N N 121 119.947 119.947 125.721 -5.774 25324 7121 1 10 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.332 -0.328 25324 7122 1 10 . 1 1 121 121 ALA C C 121 178.456 178.456 177.394 1.062 25324 7123 1 10 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.786 0.170 25324 7124 1 10 . 1 1 121 121 ALA CB C 121 18.710 18.710 19.300 -0.590 25324 7125 1 10 . 1 1 121 121 ALA H H 121 8.704 8.704 8.293 0.411 25324 7126 1 10 . 1 1 122 122 GLY N N 122 111.186 111.186 110.825 0.361 25324 7127 1 10 . 1 1 122 122 GLY C C 122 173.949 173.949 174.202 -0.253 25324 7128 1 10 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.625 -0.623 25324 7129 1 10 . 1 1 122 122 GLY H H 122 8.792 8.792 8.575 0.217 25324 7130 1 10 . 1 1 123 123 GLU N N 123 120.099 120.099 119.489 0.610 25324 7131 1 10 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.631 0.074 25324 7132 1 10 . 1 1 123 123 GLU C C 123 175.912 175.912 175.446 0.466 25324 7133 1 10 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.804 -0.390 25324 7134 1 10 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.497 0.287 25324 7135 1 10 . 1 1 123 123 GLU H H 123 8.072 8.072 7.877 0.195 25324 7136 1 10 . 1 1 124 124 GLY N N 124 105.303 105.303 108.205 -2.902 25324 7137 1 10 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.705 0.097 25324 7138 1 10 . 1 1 124 124 GLY H H 124 7.939 7.939 8.440 -0.501 25324 7139 1 10 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.980 -0.045 25324 7140 1 10 . 1 1 125 125 PRO C C 125 177.788 177.788 176.527 1.261 25324 7141 1 10 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.868 0.263 25324 7142 1 10 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.571 -0.712 25324 7143 1 10 . 1 1 126 126 ILE N N 126 117.387 117.387 116.812 0.575 25324 7144 1 10 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.674 0.225 25324 7145 1 10 . 1 1 126 126 ILE C C 126 175.625 175.625 175.122 0.503 25324 7146 1 10 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.092 0.361 25324 7147 1 10 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.046 1.502 25324 7148 1 10 . 1 1 126 126 ILE H H 126 9.599 9.599 8.924 0.675 25324 7149 1 10 . 1 1 127 127 GLY N N 127 106.753 106.753 107.557 -0.804 25324 7150 1 10 . 1 1 127 127 GLY C C 127 173.627 173.627 172.819 0.808 25324 7151 1 10 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.830 1.453 25324 7152 1 10 . 1 1 127 127 GLY H H 127 8.840 8.840 8.581 0.259 25324 7153 1 10 . 1 1 128 128 PHE N N 128 124.826 124.826 126.774 -1.948 25324 7154 1 10 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.156 -0.212 25324 7155 1 10 . 1 1 128 128 PHE C C 128 173.087 173.087 173.475 -0.388 25324 7156 1 10 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.850 0.159 25324 7157 1 10 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.084 0.076 25324 7158 1 10 . 1 1 128 128 PHE H H 128 8.924 8.924 9.240 -0.316 25324 7159 1 10 . 1 1 129 129 LYS N N 129 131.518 131.518 128.921 2.597 25324 7160 1 10 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.944 -0.062 25324 7161 1 10 . 1 1 129 129 LYS C C 129 173.863 173.863 173.905 -0.042 25324 7162 1 10 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.989 0.746 25324 7163 1 10 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.718 -0.997 25324 7164 1 10 . 1 1 129 129 LYS H H 129 8.201 8.201 8.310 -0.109 25324 7165 1 10 . 1 1 130 130 GLY N N 130 114.030 114.030 113.293 0.737 25324 7166 1 10 . 1 1 130 130 GLY C C 130 171.951 171.951 172.381 -0.430 25324 7167 1 10 . 1 1 130 130 GLY CA C 130 43.787 43.787 44.112 -0.325 25324 7168 1 10 . 1 1 130 130 GLY H H 130 9.325 9.325 8.974 0.351 25324 7169 1 10 . 1 1 131 131 THR N N 131 120.583 120.583 118.878 1.705 25324 7170 1 10 . 1 1 131 131 THR HA H 131 4.939 4.939 5.049 -0.110 25324 7171 1 10 . 1 1 131 131 THR C C 131 173.118 173.118 174.267 -1.149 25324 7172 1 10 . 1 1 131 131 THR CA C 131 61.266 61.266 61.382 -0.116 25324 7173 1 10 . 1 1 131 131 THR CB C 131 70.392 70.392 72.733 -2.341 25324 7174 1 10 . 1 1 131 131 THR H H 131 8.916 8.916 8.495 0.421 25324 7175 1 10 . 1 1 132 132 LEU N N 132 130.774 130.774 127.194 3.580 25324 7176 1 10 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.995 -0.495 25324 7177 1 10 . 1 1 132 132 LEU C C 132 176.574 176.574 177.526 -0.952 25324 7178 1 10 . 1 1 132 132 LEU CA C 132 56.187 56.187 56.111 0.076 25324 7179 1 10 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.866 0.581 25324 7180 1 10 . 1 1 132 132 LEU H H 132 8.527 8.527 8.744 -0.217 25324 7181 1 11 . 1 1 3 3 LEU N N 3 123.202 123.202 122.494 0.708 25324 7182 1 11 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.893 0.264 25324 7183 1 11 . 1 1 3 3 LEU C C 3 175.786 175.786 175.164 0.622 25324 7184 1 11 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.411 -0.127 25324 7185 1 11 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.103 0.227 25324 7186 1 11 . 1 1 3 3 LEU H H 3 8.711 8.711 8.677 0.034 25324 7187 1 11 . 1 1 4 4 TYR N N 4 120.906 120.906 125.334 -4.428 25324 7188 1 11 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.159 -0.135 25324 7189 1 11 . 1 1 4 4 TYR C C 4 175.953 175.953 175.323 0.630 25324 7190 1 11 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.600 -0.223 25324 7191 1 11 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.216 -0.561 25324 7192 1 11 . 1 1 4 4 TYR H H 4 9.142 9.142 9.612 -0.470 25324 7193 1 11 . 1 1 5 5 ASN N N 5 120.496 120.496 120.378 0.118 25324 7194 1 11 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.989 0.127 25324 7195 1 11 . 1 1 5 5 ASN C C 5 174.953 174.953 173.749 1.204 25324 7196 1 11 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.081 -0.134 25324 7197 1 11 . 1 1 5 5 ASN CB C 5 38.891 38.891 41.504 -2.613 25324 7198 1 11 . 1 1 5 5 ASN H H 5 8.787 8.787 8.997 -0.210 25324 7199 1 11 . 1 1 6 6 VAL N N 6 127.428 127.428 124.198 3.230 25324 7200 1 11 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.389 -0.027 25324 7201 1 11 . 1 1 6 6 VAL C C 6 174.955 174.955 174.879 0.076 25324 7202 1 11 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.142 0.291 25324 7203 1 11 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.364 -0.033 25324 7204 1 11 . 1 1 6 6 VAL H H 6 8.806 8.806 9.004 -0.198 25324 7205 1 11 . 1 1 7 7 GLU N N 7 124.355 124.355 127.297 -2.942 25324 7206 1 11 . 1 1 7 7 GLU HA H 7 4.982 4.982 5.144 -0.162 25324 7207 1 11 . 1 1 7 7 GLU C C 7 174.551 174.551 175.072 -0.521 25324 7208 1 11 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.728 -0.939 25324 7209 1 11 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.306 1.261 25324 7210 1 11 . 1 1 7 7 GLU H H 7 8.800 8.800 8.909 -0.109 25324 7211 1 11 . 1 1 8 8 ASN N N 8 116.231 116.231 120.905 -4.674 25324 7212 1 11 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.866 0.175 25324 7213 1 11 . 1 1 8 8 ASN C C 8 172.709 172.709 173.661 -0.952 25324 7214 1 11 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.889 -1.272 25324 7215 1 11 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.380 2.205 25324 7216 1 11 . 1 1 8 8 ASN H H 8 9.320 9.320 9.519 -0.199 25324 7217 1 11 . 1 1 9 9 GLN N N 9 120.762 120.762 121.370 -0.608 25324 7218 1 11 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.571 -0.397 25324 7219 1 11 . 1 1 9 9 GLN C C 9 173.454 173.454 174.176 -0.722 25324 7220 1 11 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.441 -0.481 25324 7221 1 11 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.014 -0.323 25324 7222 1 11 . 1 1 9 9 GLN H H 9 6.887 6.887 8.443 -1.556 25324 7223 1 11 . 1 1 10 10 TRP N N 10 127.775 127.775 124.456 3.319 25324 7224 1 11 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.026 -0.038 25324 7225 1 11 . 1 1 10 10 TRP C C 10 175.281 175.281 175.429 -0.148 25324 7226 1 11 . 1 1 10 10 TRP CA C 10 56.293 56.293 57.081 -0.788 25324 7227 1 11 . 1 1 10 10 TRP CB C 10 29.742 29.742 29.740 0.002 25324 7228 1 11 . 1 1 10 10 TRP H H 10 8.518 8.518 8.182 0.336 25324 7229 1 11 . 1 1 11 11 GLY N N 11 107.838 107.838 108.558 -0.720 25324 7230 1 11 . 1 1 11 11 GLY C C 11 174.733 174.733 174.684 0.049 25324 7231 1 11 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.533 0.303 25324 7232 1 11 . 1 1 11 11 GLY H H 11 8.461 8.461 7.757 0.704 25324 7233 1 11 . 1 1 12 12 GLY N N 12 109.696 109.696 107.847 1.849 25324 7234 1 11 . 1 1 12 12 GLY C C 12 174.133 174.133 173.689 0.444 25324 7235 1 11 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.204 -0.415 25324 7236 1 11 . 1 1 12 12 GLY H H 12 8.138 8.138 7.717 0.421 25324 7237 1 11 . 1 1 13 13 SER N N 13 111.308 111.308 116.540 -5.232 25324 7238 1 11 . 1 1 13 13 SER HA H 13 4.092 4.092 4.378 -0.286 25324 7239 1 11 . 1 1 13 13 SER C C 13 175.622 175.622 174.851 0.771 25324 7240 1 11 . 1 1 13 13 SER CA C 13 60.494 60.494 59.184 1.310 25324 7241 1 11 . 1 1 13 13 SER CB C 13 63.028 63.028 63.469 -0.441 25324 7242 1 11 . 1 1 13 13 SER H H 13 8.215 8.215 8.315 -0.100 25324 7243 1 11 . 1 1 14 14 SER N N 14 115.290 115.290 113.913 1.377 25324 7244 1 11 . 1 1 14 14 SER HA H 14 4.566 4.566 4.152 0.414 25324 7245 1 11 . 1 1 14 14 SER C C 14 173.532 173.532 172.793 0.739 25324 7246 1 11 . 1 1 14 14 SER CA C 14 57.317 57.317 59.049 -1.732 25324 7247 1 11 . 1 1 14 14 SER CB C 14 63.230 63.230 61.910 1.320 25324 7248 1 11 . 1 1 14 14 SER H H 14 8.213 8.213 8.734 -0.521 25324 7249 1 11 . 1 1 15 15 ALA N N 15 126.470 126.470 123.777 2.693 25324 7250 1 11 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.472 -0.069 25324 7251 1 11 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.990 0.474 25324 7252 1 11 . 1 1 15 15 ALA CB C 15 18.229 18.229 19.425 -1.196 25324 7253 1 11 . 1 1 15 15 ALA H H 15 7.308 7.308 7.276 0.032 25324 7254 1 11 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.411 -0.002 25324 7255 1 11 . 1 1 16 16 PRO C C 16 175.627 175.627 175.810 -0.183 25324 7256 1 11 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.632 -0.240 25324 7257 1 11 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.508 -0.371 25324 7258 1 11 . 1 1 17 17 TRP N N 17 120.228 120.228 120.242 -0.014 25324 7259 1 11 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.912 -0.594 25324 7260 1 11 . 1 1 17 17 TRP C C 17 175.951 175.951 176.121 -0.170 25324 7261 1 11 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.786 0.129 25324 7262 1 11 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.129 -0.720 25324 7263 1 11 . 1 1 17 17 TRP H H 17 8.380 8.380 8.338 0.042 25324 7264 1 11 . 1 1 18 18 ASN N N 18 120.663 120.663 121.489 -0.826 25324 7265 1 11 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.144 -0.058 25324 7266 1 11 . 1 1 18 18 ASN C C 18 174.793 174.793 174.914 -0.121 25324 7267 1 11 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.354 -0.753 25324 7268 1 11 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.678 0.970 25324 7269 1 11 . 1 1 18 18 ASN H H 18 9.094 9.094 9.168 -0.074 25324 7270 1 11 . 1 1 19 19 GLU N N 19 122.202 122.202 122.468 -0.266 25324 7271 1 11 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.483 -0.344 25324 7272 1 11 . 1 1 19 19 GLU C C 19 176.869 176.869 176.503 0.366 25324 7273 1 11 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.064 1.536 25324 7274 1 11 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.079 0.303 25324 7275 1 11 . 1 1 19 19 GLU H H 19 9.013 9.013 8.897 0.116 25324 7276 1 11 . 1 1 20 20 GLY N N 20 112.893 112.893 112.574 0.319 25324 7277 1 11 . 1 1 20 20 GLY C C 20 174.878 174.878 173.819 1.059 25324 7278 1 11 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.673 0.322 25324 7279 1 11 . 1 1 20 20 GLY H H 20 8.926 8.926 9.011 -0.085 25324 7280 1 11 . 1 1 21 21 GLY N N 21 110.354 110.354 108.457 1.897 25324 7281 1 11 . 1 1 21 21 GLY C C 21 171.623 171.623 171.823 -0.200 25324 7282 1 11 . 1 1 21 21 GLY CA C 21 44.398 44.398 44.767 -0.369 25324 7283 1 11 . 1 1 21 21 GLY H H 21 8.258 8.258 7.559 0.699 25324 7284 1 11 . 1 1 22 22 GLN N N 22 117.541 117.541 118.827 -1.286 25324 7285 1 11 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.185 0.492 25324 7286 1 11 . 1 1 22 22 GLN C C 22 175.957 175.957 174.528 1.429 25324 7287 1 11 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.629 0.315 25324 7288 1 11 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.336 -1.251 25324 7289 1 11 . 1 1 22 22 GLN H H 22 8.564 8.564 8.295 0.269 25324 7290 1 11 . 1 1 23 23 TRP N N 23 127.208 127.208 123.309 3.899 25324 7291 1 11 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.136 0.063 25324 7292 1 11 . 1 1 23 23 TRP CA C 23 54.531 54.531 53.853 0.678 25324 7293 1 11 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.725 -1.042 25324 7294 1 11 . 1 1 23 23 TRP H H 23 9.347 9.347 8.864 0.483 25324 7295 1 11 . 1 1 24 24 GLU N N 24 123.504 123.504 121.246 2.258 25324 7296 1 11 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.424 0.084 25324 7297 1 11 . 1 1 24 24 GLU C C 24 174.222 174.222 175.258 -1.036 25324 7298 1 11 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.057 0.534 25324 7299 1 11 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.608 -1.994 25324 7300 1 11 . 1 1 24 24 GLU H H 24 9.296 9.296 8.468 0.828 25324 7301 1 11 . 1 1 25 25 ILE N N 25 123.447 123.447 126.694 -3.247 25324 7302 1 11 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.033 0.403 25324 7303 1 11 . 1 1 25 25 ILE C C 25 175.790 175.790 174.554 1.236 25324 7304 1 11 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.614 0.013 25324 7305 1 11 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.190 0.763 25324 7306 1 11 . 1 1 25 25 ILE H H 25 8.635 8.635 8.600 0.035 25324 7307 1 11 . 1 1 26 26 GLY N N 26 111.544 111.544 113.577 -2.033 25324 7308 1 11 . 1 1 26 26 GLY C C 26 172.122 172.122 175.101 -2.979 25324 7309 1 11 . 1 1 26 26 GLY CA C 26 44.078 44.078 45.123 -1.045 25324 7310 1 11 . 1 1 26 26 GLY H H 26 3.381 3.381 7.939 -4.558 25324 7311 1 11 . 1 1 27 27 SER N N 27 112.279 112.279 115.800 -3.521 25324 7312 1 11 . 1 1 27 27 SER HA H 27 4.876 4.876 4.305 0.571 25324 7313 1 11 . 1 1 27 27 SER C C 27 174.113 174.113 175.455 -1.342 25324 7314 1 11 . 1 1 27 27 SER CA C 27 56.954 56.954 61.299 -4.345 25324 7315 1 11 . 1 1 27 27 SER CB C 27 64.554 64.554 63.782 0.772 25324 7316 1 11 . 1 1 27 27 SER H H 27 8.212 8.212 8.959 -0.747 25324 7317 1 11 . 1 1 28 28 ARG N N 28 120.872 120.872 122.331 -1.459 25324 7318 1 11 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.393 0.370 25324 7319 1 11 . 1 1 28 28 ARG C C 28 176.119 176.119 177.748 -1.629 25324 7320 1 11 . 1 1 28 28 ARG CA C 28 55.117 55.117 56.116 -0.999 25324 7321 1 11 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.545 1.285 25324 7322 1 11 . 1 1 28 28 ARG H H 28 7.849 7.849 8.578 -0.729 25324 7323 1 11 . 1 1 29 29 SER N N 29 118.985 118.985 119.513 -0.528 25324 7324 1 11 . 1 1 29 29 SER HA H 29 4.192 4.192 4.321 -0.129 25324 7325 1 11 . 1 1 29 29 SER C C 29 174.622 174.622 174.716 -0.094 25324 7326 1 11 . 1 1 29 29 SER CA C 29 60.072 60.072 60.420 -0.348 25324 7327 1 11 . 1 1 29 29 SER CB C 29 62.876 62.876 63.382 -0.506 25324 7328 1 11 . 1 1 29 29 SER H H 29 8.892 8.892 8.882 0.011 25324 7329 1 11 . 1 1 30 30 ASP N N 30 117.632 117.632 119.541 -1.909 25324 7330 1 11 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.767 -0.149 25324 7331 1 11 . 1 1 30 30 ASP C C 30 175.101 175.101 174.784 0.317 25324 7332 1 11 . 1 1 30 30 ASP CA C 30 53.052 53.052 54.235 -1.183 25324 7333 1 11 . 1 1 30 30 ASP CB C 30 40.523 40.523 40.850 -0.327 25324 7334 1 11 . 1 1 30 30 ASP H H 30 8.441 8.441 8.185 0.256 25324 7335 1 11 . 1 1 31 31 GLN N N 31 118.273 118.273 118.188 0.085 25324 7336 1 11 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.559 -0.074 25324 7337 1 11 . 1 1 31 31 GLN C C 31 173.453 173.453 173.730 -0.277 25324 7338 1 11 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.328 -0.460 25324 7339 1 11 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.559 2.690 25324 7340 1 11 . 1 1 31 31 GLN H H 31 7.029 7.029 7.526 -0.497 25324 7341 1 11 . 1 1 32 32 ASN N N 32 120.865 120.865 120.083 0.782 25324 7342 1 11 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.054 0.066 25324 7343 1 11 . 1 1 32 32 ASN C C 32 175.198 175.198 174.532 0.666 25324 7344 1 11 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.126 -0.257 25324 7345 1 11 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.421 -0.791 25324 7346 1 11 . 1 1 32 32 ASN H H 32 8.713 8.713 8.511 0.202 25324 7347 1 11 . 1 1 33 33 VAL N N 33 122.111 122.111 121.246 0.865 25324 7348 1 11 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.177 -0.472 25324 7349 1 11 . 1 1 33 33 VAL C C 33 174.950 174.950 175.916 -0.966 25324 7350 1 11 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.337 1.510 25324 7351 1 11 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.831 0.519 25324 7352 1 11 . 1 1 33 33 VAL H H 33 8.542 8.542 8.853 -0.311 25324 7353 1 11 . 1 1 34 34 VAL N N 34 113.282 113.282 119.962 -6.680 25324 7354 1 11 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.384 0.261 25324 7355 1 11 . 1 1 34 34 VAL C C 34 175.574 175.574 174.424 1.150 25324 7356 1 11 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.467 -1.493 25324 7357 1 11 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.784 0.245 25324 7358 1 11 . 1 1 34 34 VAL H H 34 8.744 8.744 8.974 -0.230 25324 7359 1 11 . 1 1 35 35 ALA N N 35 122.102 122.102 120.707 1.395 25324 7360 1 11 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.239 -0.436 25324 7361 1 11 . 1 1 35 35 ALA C C 35 175.947 175.947 174.953 0.994 25324 7362 1 11 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.085 2.165 25324 7363 1 11 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.255 -0.627 25324 7364 1 11 . 1 1 35 35 ALA H H 35 7.677 7.677 7.756 -0.079 25324 7365 1 11 . 1 1 36 36 ILE N N 36 118.005 118.005 121.685 -3.680 25324 7366 1 11 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.259 -0.231 25324 7367 1 11 . 1 1 36 36 ILE C C 36 173.116 173.116 173.905 -0.789 25324 7368 1 11 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.073 1.109 25324 7369 1 11 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.627 0.858 25324 7370 1 11 . 1 1 36 36 ILE H H 36 8.126 8.126 8.866 -0.740 25324 7371 1 11 . 1 1 37 37 ASN N N 37 125.632 125.632 126.478 -0.846 25324 7372 1 11 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.705 -0.024 25324 7373 1 11 . 1 1 37 37 ASN C C 37 174.854 174.854 173.699 1.155 25324 7374 1 11 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.187 0.343 25324 7375 1 11 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.202 -2.349 25324 7376 1 11 . 1 1 37 37 ASN H H 37 8.577 8.577 8.893 -0.316 25324 7377 1 11 . 1 1 38 38 VAL N N 38 114.223 114.223 118.983 -4.760 25324 7378 1 11 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.992 0.211 25324 7379 1 11 . 1 1 38 38 VAL C C 38 174.854 174.854 173.384 1.470 25324 7380 1 11 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.011 -2.031 25324 7381 1 11 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.821 0.223 25324 7382 1 11 . 1 1 38 38 VAL H H 38 8.874 8.874 8.637 0.237 25324 7383 1 11 . 1 1 39 39 GLU N N 39 118.277 118.277 122.125 -3.848 25324 7384 1 11 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.288 -0.206 25324 7385 1 11 . 1 1 39 39 GLU C C 39 174.548 174.548 174.712 -0.164 25324 7386 1 11 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.495 0.498 25324 7387 1 11 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.404 -0.826 25324 7388 1 11 . 1 1 39 39 GLU H H 39 8.761 8.761 9.035 -0.274 25324 7389 1 11 . 1 1 40 40 SER N N 40 114.960 114.960 118.578 -3.618 25324 7390 1 11 . 1 1 40 40 SER HA H 40 5.265 5.265 5.274 -0.010 25324 7391 1 11 . 1 1 40 40 SER C C 40 175.783 175.783 175.697 0.086 25324 7392 1 11 . 1 1 40 40 SER CA C 40 55.880 55.880 57.089 -1.209 25324 7393 1 11 . 1 1 40 40 SER CB C 40 65.911 65.911 64.236 1.675 25324 7394 1 11 . 1 1 40 40 SER H H 40 8.500 8.500 8.386 0.114 25324 7395 1 11 . 1 1 41 41 GLY N N 41 117.567 117.567 114.545 3.022 25324 7396 1 11 . 1 1 41 41 GLY C C 41 174.119 174.119 174.139 -0.020 25324 7397 1 11 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.247 -0.559 25324 7398 1 11 . 1 1 41 41 GLY H H 41 9.533 9.533 8.715 0.818 25324 7399 1 11 . 1 1 42 42 ASP N N 42 122.141 122.141 119.727 2.414 25324 7400 1 11 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.909 -0.109 25324 7401 1 11 . 1 1 42 42 ASP C C 42 176.121 176.121 175.948 0.173 25324 7402 1 11 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.276 -1.130 25324 7403 1 11 . 1 1 42 42 ASP CB C 42 39.354 39.354 43.072 -3.718 25324 7404 1 11 . 1 1 42 42 ASP H H 42 8.644 8.644 7.538 1.106 25324 7405 1 11 . 1 1 43 43 ASP N N 43 116.025 116.025 121.037 -5.012 25324 7406 1 11 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.562 -0.333 25324 7407 1 11 . 1 1 43 43 ASP C C 43 176.018 176.018 176.507 -0.489 25324 7408 1 11 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.656 0.593 25324 7409 1 11 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.377 -0.818 25324 7410 1 11 . 1 1 43 43 ASP H H 43 9.111 9.111 8.729 0.382 25324 7411 1 11 . 1 1 44 44 GLY N N 44 104.263 104.263 106.700 -2.437 25324 7412 1 11 . 1 1 44 44 GLY C C 44 173.922 173.922 174.890 -0.968 25324 7413 1 11 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.493 -0.192 25324 7414 1 11 . 1 1 44 44 GLY H H 44 9.063 9.063 7.887 1.176 25324 7415 1 11 . 1 1 45 45 GLN N N 45 121.691 121.691 118.414 3.277 25324 7416 1 11 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.115 -0.029 25324 7417 1 11 . 1 1 45 45 GLN C C 45 176.284 176.284 175.984 0.300 25324 7418 1 11 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.956 0.162 25324 7419 1 11 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.348 -1.674 25324 7420 1 11 . 1 1 45 45 GLN H H 45 7.356 7.356 8.170 -0.814 25324 7421 1 11 . 1 1 46 46 THR N N 46 111.843 111.843 114.040 -2.197 25324 7422 1 11 . 1 1 46 46 THR HA H 46 5.355 5.355 5.256 0.099 25324 7423 1 11 . 1 1 46 46 THR C C 46 174.451 174.451 172.566 1.885 25324 7424 1 11 . 1 1 46 46 THR CA C 46 59.644 59.644 60.200 -0.556 25324 7425 1 11 . 1 1 46 46 THR CB C 46 72.714 72.714 69.768 2.946 25324 7426 1 11 . 1 1 46 46 THR H H 46 10.123 10.123 7.503 2.620 25324 7427 1 11 . 1 1 47 47 LEU N N 47 119.302 119.302 129.373 -10.071 25324 7428 1 11 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.623 0.184 25324 7429 1 11 . 1 1 47 47 LEU C C 47 175.487 175.487 175.182 0.305 25324 7430 1 11 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.874 -0.804 25324 7431 1 11 . 1 1 47 47 LEU CB C 47 48.003 48.003 42.742 5.261 25324 7432 1 11 . 1 1 47 47 LEU H H 47 8.364 8.364 8.574 -0.210 25324 7433 1 11 . 1 1 48 48 ASN N N 48 116.844 116.844 121.017 -4.173 25324 7434 1 11 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.686 0.043 25324 7435 1 11 . 1 1 48 48 ASN C C 48 174.460 174.460 174.843 -0.383 25324 7436 1 11 . 1 1 48 48 ASN CA C 48 52.739 52.739 52.140 0.599 25324 7437 1 11 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.400 1.013 25324 7438 1 11 . 1 1 48 48 ASN H H 48 8.748 8.748 8.801 -0.053 25324 7439 1 11 . 1 1 49 49 GLY N N 49 109.417 109.417 109.542 -0.125 25324 7440 1 11 . 1 1 49 49 GLY C C 49 172.126 172.126 172.172 -0.046 25324 7441 1 11 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.206 0.285 25324 7442 1 11 . 1 1 49 49 GLY H H 49 8.744 8.744 8.815 -0.071 25324 7443 1 11 . 1 1 50 50 THR N N 50 119.162 119.162 117.275 1.887 25324 7444 1 11 . 1 1 50 50 THR HA H 50 5.556 5.556 5.278 0.278 25324 7445 1 11 . 1 1 50 50 THR C C 50 171.790 171.790 172.511 -0.721 25324 7446 1 11 . 1 1 50 50 THR CA C 50 59.371 59.371 61.788 -2.417 25324 7447 1 11 . 1 1 50 50 THR CB C 50 72.799 72.799 71.958 0.841 25324 7448 1 11 . 1 1 50 50 THR H H 50 8.799 8.799 8.844 -0.045 25324 7449 1 11 . 1 1 51 51 MET N N 51 115.232 115.232 126.223 -10.991 25324 7450 1 11 . 1 1 51 51 MET HA H 51 4.886 4.886 4.980 -0.094 25324 7451 1 11 . 1 1 51 51 MET C C 51 172.708 172.708 173.841 -1.133 25324 7452 1 11 . 1 1 51 51 MET CA C 51 54.722 54.722 53.976 0.746 25324 7453 1 11 . 1 1 51 51 MET CB C 51 34.557 34.557 37.071 -2.514 25324 7454 1 11 . 1 1 51 51 MET H H 51 9.062 9.062 9.272 -0.210 25324 7455 1 11 . 1 1 52 52 THR N N 52 113.697 113.697 121.744 -8.047 25324 7456 1 11 . 1 1 52 52 THR HA H 52 4.682 4.682 4.828 -0.146 25324 7457 1 11 . 1 1 52 52 THR C C 52 173.952 173.952 173.619 0.333 25324 7458 1 11 . 1 1 52 52 THR CA C 52 61.395 61.395 61.415 -0.020 25324 7459 1 11 . 1 1 52 52 THR CB C 52 71.734 71.734 70.581 1.153 25324 7460 1 11 . 1 1 52 52 THR H H 52 8.685 8.685 8.789 -0.104 25324 7461 1 11 . 1 1 53 53 TYR N N 53 129.086 129.086 126.439 2.647 25324 7462 1 11 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.958 -0.158 25324 7463 1 11 . 1 1 53 53 TYR C C 53 175.214 175.214 176.379 -1.165 25324 7464 1 11 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.086 0.795 25324 7465 1 11 . 1 1 53 53 TYR CB C 53 40.512 40.512 40.042 0.470 25324 7466 1 11 . 1 1 53 53 TYR H H 53 10.112 10.112 8.611 1.501 25324 7467 1 11 . 1 1 54 54 ALA N N 54 119.947 119.947 124.244 -4.297 25324 7468 1 11 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.370 -0.368 25324 7469 1 11 . 1 1 54 54 ALA C C 54 178.285 178.285 177.739 0.546 25324 7470 1 11 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.544 0.427 25324 7471 1 11 . 1 1 54 54 ALA CB C 54 18.717 18.717 19.012 -0.295 25324 7472 1 11 . 1 1 54 54 ALA H H 54 8.704 8.704 8.552 0.152 25324 7473 1 11 . 1 1 55 55 GLY N N 55 110.940 110.940 111.158 -0.218 25324 7474 1 11 . 1 1 55 55 GLY C C 55 173.903 173.903 174.558 -0.655 25324 7475 1 11 . 1 1 55 55 GLY CA C 55 45.016 45.016 46.048 -1.032 25324 7476 1 11 . 1 1 55 55 GLY H H 55 8.745 8.745 8.837 -0.092 25324 7477 1 11 . 1 1 56 56 GLU N N 56 120.073 120.073 120.206 -0.133 25324 7478 1 11 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.739 -0.030 25324 7479 1 11 . 1 1 56 56 GLU C C 56 175.906 175.906 176.161 -0.255 25324 7480 1 11 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.982 -0.559 25324 7481 1 11 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.307 0.517 25324 7482 1 11 . 1 1 56 56 GLU H H 56 8.039 8.039 7.759 0.280 25324 7483 1 11 . 1 1 57 57 GLY N N 57 105.298 105.298 107.885 -2.587 25324 7484 1 11 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.322 0.480 25324 7485 1 11 . 1 1 57 57 GLY H H 57 7.937 7.937 8.213 -0.276 25324 7486 1 11 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.552 0.382 25324 7487 1 11 . 1 1 58 58 PRO C C 58 177.785 177.785 176.318 1.467 25324 7488 1 11 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.395 -0.263 25324 7489 1 11 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.096 -0.257 25324 7490 1 11 . 1 1 59 59 ILE N N 59 117.386 117.386 118.536 -1.150 25324 7491 1 11 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.997 -0.009 25324 7492 1 11 . 1 1 59 59 ILE C C 59 175.688 175.688 175.413 0.275 25324 7493 1 11 . 1 1 59 59 ILE CA C 59 59.543 59.543 58.883 0.660 25324 7494 1 11 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.892 0.396 25324 7495 1 11 . 1 1 59 59 ILE H H 59 9.600 9.600 8.870 0.730 25324 7496 1 11 . 1 1 60 60 GLY N N 60 107.164 107.164 107.817 -0.653 25324 7497 1 11 . 1 1 60 60 GLY C C 60 173.787 173.787 172.459 1.328 25324 7498 1 11 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.629 1.606 25324 7499 1 11 . 1 1 60 60 GLY H H 60 8.957 8.957 8.501 0.456 25324 7500 1 11 . 1 1 61 61 PHE N N 61 124.597 124.597 126.427 -1.830 25324 7501 1 11 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.477 -0.254 25324 7502 1 11 . 1 1 61 61 PHE C C 61 173.126 173.126 173.243 -0.117 25324 7503 1 11 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.569 0.292 25324 7504 1 11 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.267 -0.050 25324 7505 1 11 . 1 1 61 61 PHE H H 61 8.788 8.788 8.961 -0.173 25324 7506 1 11 . 1 1 62 62 ARG N N 62 129.706 129.706 127.717 1.989 25324 7507 1 11 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.128 0.004 25324 7508 1 11 . 1 1 62 62 ARG C C 62 172.456 172.456 173.025 -0.569 25324 7509 1 11 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.139 0.814 25324 7510 1 11 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.397 -1.527 25324 7511 1 11 . 1 1 62 62 ARG H H 62 8.405 8.405 8.510 -0.105 25324 7512 1 11 . 1 1 63 63 ALA N N 63 122.744 122.744 129.147 -6.403 25324 7513 1 11 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.429 -0.084 25324 7514 1 11 . 1 1 63 63 ALA C C 63 176.120 176.120 175.632 0.488 25324 7515 1 11 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.078 -0.159 25324 7516 1 11 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.844 1.929 25324 7517 1 11 . 1 1 63 63 ALA H H 63 8.628 8.628 8.904 -0.276 25324 7518 1 11 . 1 1 64 64 THR N N 64 116.855 116.855 118.252 -1.397 25324 7519 1 11 . 1 1 64 64 THR HA H 64 4.848 4.848 5.249 -0.401 25324 7520 1 11 . 1 1 64 64 THR C C 64 172.957 172.957 173.732 -0.775 25324 7521 1 11 . 1 1 64 64 THR CA C 64 61.211 61.211 61.036 0.175 25324 7522 1 11 . 1 1 64 64 THR CB C 64 71.064 71.064 71.697 -0.633 25324 7523 1 11 . 1 1 64 64 THR H H 64 8.315 8.315 8.613 -0.298 25324 7524 1 11 . 1 1 65 65 LEU N N 65 129.360 129.360 129.718 -0.358 25324 7525 1 11 . 1 1 65 65 LEU HA H 65 3.362 3.362 4.052 -0.690 25324 7526 1 11 . 1 1 65 65 LEU C C 65 176.459 176.459 176.238 0.221 25324 7527 1 11 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.991 0.696 25324 7528 1 11 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.014 -0.303 25324 7529 1 11 . 1 1 65 65 LEU H H 65 8.877 8.877 9.011 -0.134 25324 7530 1 11 . 1 1 66 66 LEU N N 66 128.683 128.683 128.562 0.121 25324 7531 1 11 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.288 0.088 25324 7532 1 11 . 1 1 66 66 LEU C C 66 177.621 177.621 177.597 0.024 25324 7533 1 11 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.533 -0.833 25324 7534 1 11 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.233 0.069 25324 7535 1 11 . 1 1 66 66 LEU H H 66 9.320 9.320 8.839 0.481 25324 7536 1 11 . 1 1 67 67 GLY N N 67 105.361 105.361 104.884 0.477 25324 7537 1 11 . 1 1 67 67 GLY C C 67 173.618 173.618 173.364 0.254 25324 7538 1 11 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.089 -0.722 25324 7539 1 11 . 1 1 67 67 GLY H H 67 6.639 6.639 7.415 -0.776 25324 7540 1 11 . 1 1 68 68 ASN N N 68 121.848 121.848 117.729 4.119 25324 7541 1 11 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.267 0.064 25324 7542 1 11 . 1 1 68 68 ASN C C 68 174.316 174.316 175.167 -0.851 25324 7543 1 11 . 1 1 68 68 ASN CA C 68 54.552 54.552 54.163 0.389 25324 7544 1 11 . 1 1 68 68 ASN CB C 68 37.165 37.165 37.627 -0.462 25324 7545 1 11 . 1 1 68 68 ASN H H 68 9.236 9.236 8.713 0.523 25324 7546 1 11 . 1 1 69 69 ASN N N 69 109.509 109.509 109.401 0.108 25324 7547 1 11 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.332 -0.252 25324 7548 1 11 . 1 1 69 69 ASN C C 69 171.456 171.456 174.125 -2.669 25324 7549 1 11 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.799 0.951 25324 7550 1 11 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.649 -0.343 25324 7551 1 11 . 1 1 69 69 ASN H H 69 8.651 8.651 8.787 -0.136 25324 7552 1 11 . 1 1 70 70 SER N N 70 113.479 113.479 114.188 -0.709 25324 7553 1 11 . 1 1 70 70 SER HA H 70 5.437 5.437 5.148 0.289 25324 7554 1 11 . 1 1 70 70 SER C C 70 173.750 173.750 173.261 0.489 25324 7555 1 11 . 1 1 70 70 SER CA C 70 57.139 57.139 58.173 -1.034 25324 7556 1 11 . 1 1 70 70 SER CB C 70 63.818 63.818 65.117 -1.299 25324 7557 1 11 . 1 1 70 70 SER H H 70 7.693 7.693 7.269 0.424 25324 7558 1 11 . 1 1 71 71 TYR N N 71 123.132 123.132 123.423 -0.291 25324 7559 1 11 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.134 0.009 25324 7560 1 11 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.593 0.055 25324 7561 1 11 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.686 -0.241 25324 7562 1 11 . 1 1 71 71 TYR H H 71 9.326 9.326 9.524 -0.198 25324 7563 1 11 . 1 1 72 72 GLU N N 72 122.396 122.396 121.509 0.887 25324 7564 1 11 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.856 -0.050 25324 7565 1 11 . 1 1 72 72 GLU C C 72 175.698 175.698 174.932 0.766 25324 7566 1 11 . 1 1 72 72 GLU CA C 72 55.167 55.167 54.867 0.300 25324 7567 1 11 . 1 1 72 72 GLU CB C 72 30.184 30.184 32.711 -2.527 25324 7568 1 11 . 1 1 72 72 GLU H H 72 8.624 8.624 8.999 -0.375 25324 7569 1 11 . 1 1 73 73 VAL N N 73 128.513 128.513 126.976 1.537 25324 7570 1 11 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.532 -0.333 25324 7571 1 11 . 1 1 73 73 VAL C C 73 175.369 175.369 174.583 0.786 25324 7572 1 11 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.745 0.735 25324 7573 1 11 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.781 -0.448 25324 7574 1 11 . 1 1 73 73 VAL H H 73 8.564 8.564 9.124 -0.560 25324 7575 1 11 . 1 1 74 74 GLU N N 74 124.842 124.842 125.154 -0.312 25324 7576 1 11 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.174 -0.087 25324 7577 1 11 . 1 1 74 74 GLU C C 74 174.415 174.415 174.877 -0.462 25324 7578 1 11 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.641 -0.304 25324 7579 1 11 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.779 1.378 25324 7580 1 11 . 1 1 74 74 GLU H H 74 9.011 9.011 8.935 0.076 25324 7581 1 11 . 1 1 75 75 ASN N N 75 116.136 116.136 119.443 -3.307 25324 7582 1 11 . 1 1 75 75 ASN HA H 75 6.139 6.139 6.155 -0.016 25324 7583 1 11 . 1 1 75 75 ASN C C 75 172.703 172.703 173.583 -0.880 25324 7584 1 11 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.346 -0.521 25324 7585 1 11 . 1 1 75 75 ASN CB C 75 45.896 45.896 43.483 2.413 25324 7586 1 11 . 1 1 75 75 ASN H H 75 9.424 9.424 9.324 0.100 25324 7587 1 11 . 1 1 76 76 GLN N N 76 120.762 120.762 118.794 1.968 25324 7588 1 11 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.369 -0.329 25324 7589 1 11 . 1 1 76 76 GLN C C 76 173.113 173.113 173.694 -0.581 25324 7590 1 11 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.833 -0.610 25324 7591 1 11 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.939 -1.591 25324 7592 1 11 . 1 1 76 76 GLN H H 76 7.106 7.106 8.609 -1.503 25324 7593 1 11 . 1 1 77 77 TRP N N 77 125.598 125.598 122.037 3.561 25324 7594 1 11 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.096 0.056 25324 7595 1 11 . 1 1 77 77 TRP C C 77 175.502 175.502 175.249 0.253 25324 7596 1 11 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.569 -0.805 25324 7597 1 11 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.983 -0.984 25324 7598 1 11 . 1 1 77 77 TRP H H 77 8.181 8.181 8.039 0.142 25324 7599 1 11 . 1 1 78 78 GLY N N 78 107.901 107.901 109.463 -1.562 25324 7600 1 11 . 1 1 78 78 GLY C C 78 174.611 174.611 175.361 -0.750 25324 7601 1 11 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.236 -0.334 25324 7602 1 11 . 1 1 78 78 GLY H H 78 8.778 8.778 8.784 -0.006 25324 7603 1 11 . 1 1 79 79 GLY N N 79 109.844 109.844 111.105 -1.261 25324 7604 1 11 . 1 1 79 79 GLY C C 79 173.782 173.782 175.639 -1.857 25324 7605 1 11 . 1 1 79 79 GLY CA C 79 43.793 43.793 45.065 -1.272 25324 7606 1 11 . 1 1 79 79 GLY H H 79 8.198 8.198 8.499 -0.301 25324 7607 1 11 . 1 1 80 80 ASP N N 80 115.837 115.837 119.010 -3.173 25324 7608 1 11 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.358 -0.117 25324 7609 1 11 . 1 1 80 80 ASP C C 80 177.285 177.285 176.135 1.150 25324 7610 1 11 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.596 0.587 25324 7611 1 11 . 1 1 80 80 ASP CB C 80 40.523 40.523 39.483 1.040 25324 7612 1 11 . 1 1 80 80 ASP H H 80 8.132 8.132 8.547 -0.415 25324 7613 1 11 . 1 1 81 81 SER N N 81 112.690 112.690 114.203 -1.513 25324 7614 1 11 . 1 1 81 81 SER HA H 81 4.513 4.513 4.370 0.143 25324 7615 1 11 . 1 1 81 81 SER C C 81 173.684 173.684 174.795 -1.111 25324 7616 1 11 . 1 1 81 81 SER CA C 81 57.232 57.232 58.120 -0.888 25324 7617 1 11 . 1 1 81 81 SER CB C 81 63.170 63.170 63.368 -0.198 25324 7618 1 11 . 1 1 81 81 SER H H 81 8.179 8.179 7.870 0.309 25324 7619 1 11 . 1 1 82 82 ALA N N 82 126.310 126.310 126.339 -0.029 25324 7620 1 11 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.505 -0.102 25324 7621 1 11 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.406 0.060 25324 7622 1 11 . 1 1 82 82 ALA CB C 82 18.198 18.198 17.906 0.292 25324 7623 1 11 . 1 1 82 82 ALA H H 82 7.274 7.274 7.231 0.043 25324 7624 1 11 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.282 0.091 25324 7625 1 11 . 1 1 83 83 PRO C C 83 175.378 175.378 174.959 0.419 25324 7626 1 11 . 1 1 83 83 PRO CA C 83 62.327 62.327 61.908 0.419 25324 7627 1 11 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.287 -0.123 25324 7628 1 11 . 1 1 84 84 TRP N N 84 120.106 120.106 117.982 2.124 25324 7629 1 11 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.365 -0.094 25324 7630 1 11 . 1 1 84 84 TRP C C 84 176.358 176.358 175.923 0.435 25324 7631 1 11 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.779 0.167 25324 7632 1 11 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.908 -1.192 25324 7633 1 11 . 1 1 84 84 TRP H H 84 8.329 8.329 7.936 0.393 25324 7634 1 11 . 1 1 85 85 HIS N N 85 118.543 118.543 120.998 -2.455 25324 7635 1 11 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.974 -0.056 25324 7636 1 11 . 1 1 85 85 HIS C C 85 174.950 174.950 175.142 -0.192 25324 7637 1 11 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.015 -1.546 25324 7638 1 11 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.134 -1.461 25324 7639 1 11 . 1 1 85 85 HIS H H 85 9.204 9.204 9.241 -0.037 25324 7640 1 11 . 1 1 86 86 SER N N 86 117.803 117.803 118.199 -0.396 25324 7641 1 11 . 1 1 86 86 SER HA H 86 4.412 4.412 4.283 0.129 25324 7642 1 11 . 1 1 86 86 SER C C 86 175.691 175.691 174.403 1.288 25324 7643 1 11 . 1 1 86 86 SER CA C 86 60.257 60.257 59.956 0.301 25324 7644 1 11 . 1 1 86 86 SER CB C 86 63.015 63.015 63.242 -0.227 25324 7645 1 11 . 1 1 86 86 SER H H 86 9.168 9.168 8.974 0.194 25324 7646 1 11 . 1 1 87 87 GLY N N 87 115.773 115.773 110.326 5.447 25324 7647 1 11 . 1 1 87 87 GLY C C 87 174.288 174.288 173.775 0.513 25324 7648 1 11 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.093 -0.392 25324 7649 1 11 . 1 1 87 87 GLY H H 87 9.284 9.284 8.865 0.419 25324 7650 1 11 . 1 1 88 88 GLY N N 88 109.162 109.162 108.053 1.109 25324 7651 1 11 . 1 1 88 88 GLY C C 88 171.120 171.120 172.106 -0.986 25324 7652 1 11 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.846 -0.252 25324 7653 1 11 . 1 1 88 88 GLY H H 88 8.054 8.054 7.975 0.079 25324 7654 1 11 . 1 1 89 89 ASN N N 89 117.048 117.048 119.395 -2.347 25324 7655 1 11 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.699 0.339 25324 7656 1 11 . 1 1 89 89 ASN C C 89 175.287 175.287 174.907 0.380 25324 7657 1 11 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.420 -1.555 25324 7658 1 11 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.636 -2.031 25324 7659 1 11 . 1 1 89 89 ASN H H 89 8.516 8.516 8.630 -0.114 25324 7660 1 11 . 1 1 90 90 TRP N N 90 125.844 125.844 121.822 4.022 25324 7661 1 11 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.307 -0.054 25324 7662 1 11 . 1 1 90 90 TRP C C 90 175.278 175.278 174.963 0.315 25324 7663 1 11 . 1 1 90 90 TRP CA C 90 54.268 54.268 55.452 -1.184 25324 7664 1 11 . 1 1 90 90 TRP CB C 90 31.958 31.958 33.210 -1.252 25324 7665 1 11 . 1 1 90 90 TRP H H 90 9.282 9.282 9.469 -0.187 25324 7666 1 11 . 1 1 91 91 ILE N N 91 123.134 123.134 121.956 1.178 25324 7667 1 11 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.858 0.588 25324 7668 1 11 . 1 1 91 91 ILE C C 91 175.489 175.489 175.178 0.311 25324 7669 1 11 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.929 -0.103 25324 7670 1 11 . 1 1 91 91 ILE CB C 91 39.676 39.676 39.067 0.609 25324 7671 1 11 . 1 1 91 91 ILE H H 91 9.318 9.318 8.555 0.763 25324 7672 1 11 . 1 1 92 92 LEU N N 92 123.452 123.452 127.673 -4.221 25324 7673 1 11 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.622 0.320 25324 7674 1 11 . 1 1 92 92 LEU C C 92 173.620 173.620 174.972 -1.352 25324 7675 1 11 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.629 -1.373 25324 7676 1 11 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.237 2.271 25324 7677 1 11 . 1 1 92 92 LEU H H 92 8.463 8.463 8.723 -0.260 25324 7678 1 11 . 1 1 93 93 GLY N N 93 103.987 103.987 107.647 -3.660 25324 7679 1 11 . 1 1 93 93 GLY C C 93 172.284 172.284 174.675 -2.391 25324 7680 1 11 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.748 -2.248 25324 7681 1 11 . 1 1 93 93 GLY H H 93 2.937 2.937 7.940 -5.003 25324 7682 1 11 . 1 1 94 94 SER N N 94 110.274 110.274 113.191 -2.917 25324 7683 1 11 . 1 1 94 94 SER HA H 94 4.711 4.711 4.251 0.460 25324 7684 1 11 . 1 1 94 94 SER C C 94 174.784 174.784 173.950 0.834 25324 7685 1 11 . 1 1 94 94 SER CA C 94 56.555 56.555 60.242 -3.687 25324 7686 1 11 . 1 1 94 94 SER CB C 94 65.051 65.051 63.208 1.843 25324 7687 1 11 . 1 1 94 94 SER H H 94 7.919 7.919 8.723 -0.804 25324 7688 1 11 . 1 1 95 95 ARG N N 95 123.020 123.020 121.476 1.544 25324 7689 1 11 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.540 0.132 25324 7690 1 11 . 1 1 95 95 ARG C C 95 176.120 176.120 177.316 -1.196 25324 7691 1 11 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.156 0.218 25324 7692 1 11 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.172 0.676 25324 7693 1 11 . 1 1 95 95 ARG H H 95 9.148 9.148 7.885 1.263 25324 7694 1 11 . 1 1 96 96 GLU N N 96 120.357 120.357 123.850 -3.493 25324 7695 1 11 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.047 0.235 25324 7696 1 11 . 1 1 96 96 GLU C C 96 176.278 176.278 176.712 -0.434 25324 7697 1 11 . 1 1 96 96 GLU CA C 96 56.530 56.530 59.048 -2.518 25324 7698 1 11 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.879 0.274 25324 7699 1 11 . 1 1 96 96 GLU H H 96 8.610 8.610 8.873 -0.263 25324 7700 1 11 . 1 1 97 97 ASN N N 97 117.678 117.678 116.419 1.259 25324 7701 1 11 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.859 -0.247 25324 7702 1 11 . 1 1 97 97 ASN C C 97 173.949 173.949 173.989 -0.040 25324 7703 1 11 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.841 0.174 25324 7704 1 11 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.358 -0.192 25324 7705 1 11 . 1 1 97 97 ASN H H 97 8.533 8.533 8.231 0.302 25324 7706 1 11 . 1 1 98 98 GLN N N 98 118.592 118.592 120.153 -1.561 25324 7707 1 11 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.422 -0.062 25324 7708 1 11 . 1 1 98 98 GLN C C 98 173.116 173.116 173.691 -0.575 25324 7709 1 11 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.581 0.047 25324 7710 1 11 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.843 0.026 25324 7711 1 11 . 1 1 98 98 GLN H H 98 7.663 7.663 7.551 0.112 25324 7712 1 11 . 1 1 99 99 ASN N N 99 122.855 122.855 122.521 0.334 25324 7713 1 11 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.056 0.079 25324 7714 1 11 . 1 1 99 99 ASN C C 99 175.287 175.287 174.878 0.409 25324 7715 1 11 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.665 0.325 25324 7716 1 11 . 1 1 99 99 ASN CB C 99 40.491 40.491 41.163 -0.673 25324 7717 1 11 . 1 1 99 99 ASN H H 99 8.759 8.759 8.631 0.128 25324 7718 1 11 . 1 1 100 100 VAL N N 100 121.385 121.385 118.679 2.706 25324 7719 1 11 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.914 -0.166 25324 7720 1 11 . 1 1 100 100 VAL C C 100 174.956 174.956 176.445 -1.489 25324 7721 1 11 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.321 0.522 25324 7722 1 11 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.888 0.555 25324 7723 1 11 . 1 1 100 100 VAL H H 100 8.717 8.717 8.055 0.662 25324 7724 1 11 . 1 1 101 101 VAL N N 101 112.736 112.736 120.057 -7.321 25324 7725 1 11 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.482 0.163 25324 7726 1 11 . 1 1 101 101 VAL C C 101 175.577 175.577 174.521 1.056 25324 7727 1 11 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.490 -1.527 25324 7728 1 11 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.648 -0.607 25324 7729 1 11 . 1 1 101 101 VAL H H 101 8.802 8.802 8.782 0.020 25324 7730 1 11 . 1 1 102 102 ALA N N 102 122.104 122.104 121.715 0.389 25324 7731 1 11 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.137 -0.330 25324 7732 1 11 . 1 1 102 102 ALA C C 102 176.046 176.046 174.947 1.099 25324 7733 1 11 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.692 2.562 25324 7734 1 11 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.290 -0.665 25324 7735 1 11 . 1 1 102 102 ALA H H 102 7.677 7.677 7.765 -0.088 25324 7736 1 11 . 1 1 103 103 ILE N N 103 118.218 118.218 121.903 -3.685 25324 7737 1 11 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.358 -0.331 25324 7738 1 11 . 1 1 103 103 ILE C C 103 173.118 173.118 173.850 -0.732 25324 7739 1 11 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.537 1.690 25324 7740 1 11 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.743 0.728 25324 7741 1 11 . 1 1 103 103 ILE H H 103 8.102 8.102 8.655 -0.553 25324 7742 1 11 . 1 1 104 104 ASN N N 104 125.938 125.938 126.300 -0.362 25324 7743 1 11 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.547 0.139 25324 7744 1 11 . 1 1 104 104 ASN C C 104 174.870 174.870 173.721 1.149 25324 7745 1 11 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.063 0.490 25324 7746 1 11 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.166 -1.314 25324 7747 1 11 . 1 1 104 104 ASN H H 104 8.668 8.668 8.899 -0.231 25324 7748 1 11 . 1 1 105 105 VAL N N 105 114.631 114.631 118.470 -3.839 25324 7749 1 11 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.142 0.063 25324 7750 1 11 . 1 1 105 105 VAL C C 105 174.788 174.788 173.352 1.436 25324 7751 1 11 . 1 1 105 105 VAL CA C 105 57.979 57.979 59.761 -1.782 25324 7752 1 11 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.897 0.143 25324 7753 1 11 . 1 1 105 105 VAL H H 105 8.933 8.933 8.792 0.141 25324 7754 1 11 . 1 1 106 106 GLU N N 106 118.347 118.347 123.240 -4.893 25324 7755 1 11 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.498 -0.418 25324 7756 1 11 . 1 1 106 106 GLU C C 106 174.777 174.777 174.386 0.391 25324 7757 1 11 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.924 0.043 25324 7758 1 11 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.506 -0.863 25324 7759 1 11 . 1 1 106 106 GLU H H 106 8.814 8.814 8.965 -0.151 25324 7760 1 11 . 1 1 107 107 SER N N 107 115.335 115.335 118.142 -2.807 25324 7761 1 11 . 1 1 107 107 SER HA H 107 5.266 5.266 4.962 0.304 25324 7762 1 11 . 1 1 107 107 SER C C 107 175.787 175.787 174.682 1.105 25324 7763 1 11 . 1 1 107 107 SER CA C 107 55.888 55.888 56.987 -1.099 25324 7764 1 11 . 1 1 107 107 SER CB C 107 65.921 65.921 65.202 0.719 25324 7765 1 11 . 1 1 107 107 SER H H 107 8.576 8.576 8.565 0.011 25324 7766 1 11 . 1 1 108 108 GLY N N 108 117.567 117.567 113.180 4.387 25324 7767 1 11 . 1 1 108 108 GLY C C 108 173.959 173.959 174.506 -0.547 25324 7768 1 11 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.288 -0.611 25324 7769 1 11 . 1 1 108 108 GLY H H 108 9.532 9.532 8.825 0.707 25324 7770 1 11 . 1 1 109 109 ASP N N 109 122.108 122.108 120.583 1.525 25324 7771 1 11 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.854 -0.053 25324 7772 1 11 . 1 1 109 109 ASP C C 109 176.203 176.203 175.413 0.790 25324 7773 1 11 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.905 -0.771 25324 7774 1 11 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.644 -3.301 25324 7775 1 11 . 1 1 109 109 ASP H H 109 8.605 8.605 7.682 0.923 25324 7776 1 11 . 1 1 110 110 ASP N N 110 116.197 116.197 120.404 -4.207 25324 7777 1 11 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.714 -0.492 25324 7778 1 11 . 1 1 110 110 ASP C C 110 175.951 175.951 176.433 -0.482 25324 7779 1 11 . 1 1 110 110 ASP CA C 110 55.198 55.198 54.294 0.904 25324 7780 1 11 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.241 -1.611 25324 7781 1 11 . 1 1 110 110 ASP H H 110 9.087 9.087 8.576 0.511 25324 7782 1 11 . 1 1 111 111 GLY N N 111 103.841 103.841 105.989 -2.148 25324 7783 1 11 . 1 1 111 111 GLY C C 111 173.924 173.924 175.049 -1.125 25324 7784 1 11 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.562 -0.399 25324 7785 1 11 . 1 1 111 111 GLY H H 111 8.930 8.930 8.449 0.481 25324 7786 1 11 . 1 1 112 112 GLN N N 112 121.626 121.626 119.275 2.351 25324 7787 1 11 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.080 -0.010 25324 7788 1 11 . 1 1 112 112 GLN C C 112 176.431 176.431 175.799 0.632 25324 7789 1 11 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.208 0.065 25324 7790 1 11 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.259 -1.567 25324 7791 1 11 . 1 1 112 112 GLN H H 112 7.351 7.351 8.357 -1.006 25324 7792 1 11 . 1 1 113 113 THR N N 113 112.322 112.322 109.304 3.018 25324 7793 1 11 . 1 1 113 113 THR HA H 113 5.331 5.331 5.200 0.131 25324 7794 1 11 . 1 1 113 113 THR C C 113 174.452 174.452 173.677 0.775 25324 7795 1 11 . 1 1 113 113 THR CA C 113 59.739 59.739 59.798 -0.059 25324 7796 1 11 . 1 1 113 113 THR CB C 113 71.773 71.773 70.160 1.613 25324 7797 1 11 . 1 1 113 113 THR H H 113 10.053 10.053 7.534 2.519 25324 7798 1 11 . 1 1 114 114 LEU N N 114 122.083 122.083 128.226 -6.143 25324 7799 1 11 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.571 0.010 25324 7800 1 11 . 1 1 114 114 LEU C C 114 175.113 175.113 175.310 -0.197 25324 7801 1 11 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.214 -1.308 25324 7802 1 11 . 1 1 114 114 LEU CB C 114 47.033 47.033 42.065 4.968 25324 7803 1 11 . 1 1 114 114 LEU H H 114 8.978 8.978 9.147 -0.169 25324 7804 1 11 . 1 1 115 115 ASN N N 115 118.846 118.846 122.549 -3.703 25324 7805 1 11 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.697 0.073 25324 7806 1 11 . 1 1 115 115 ASN C C 115 174.788 174.788 175.202 -0.414 25324 7807 1 11 . 1 1 115 115 ASN CA C 115 52.342 52.342 52.150 0.192 25324 7808 1 11 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.146 1.268 25324 7809 1 11 . 1 1 115 115 ASN H H 115 8.837 8.837 7.935 0.902 25324 7810 1 11 . 1 1 116 116 GLY N N 116 109.661 109.661 109.434 0.227 25324 7811 1 11 . 1 1 116 116 GLY C C 116 172.452 172.452 172.354 0.098 25324 7812 1 11 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.171 0.300 25324 7813 1 11 . 1 1 116 116 GLY H H 116 8.625 8.625 8.865 -0.240 25324 7814 1 11 . 1 1 117 117 THR N N 117 120.009 120.009 113.510 6.499 25324 7815 1 11 . 1 1 117 117 THR HA H 117 5.556 5.556 5.647 -0.091 25324 7816 1 11 . 1 1 117 117 THR C C 117 171.619 171.619 173.307 -1.688 25324 7817 1 11 . 1 1 117 117 THR CA C 117 59.373 59.373 60.019 -0.646 25324 7818 1 11 . 1 1 117 117 THR CB C 117 72.777 72.777 72.638 0.139 25324 7819 1 11 . 1 1 117 117 THR H H 117 8.911 8.911 9.090 -0.179 25324 7820 1 11 . 1 1 118 118 MET N N 118 115.550 115.550 117.668 -2.118 25324 7821 1 11 . 1 1 118 118 MET HA H 118 4.889 4.889 5.288 -0.399 25324 7822 1 11 . 1 1 118 118 MET C C 118 172.707 172.707 173.989 -1.282 25324 7823 1 11 . 1 1 118 118 MET CA C 118 54.714 54.714 54.459 0.255 25324 7824 1 11 . 1 1 118 118 MET CB C 118 33.663 33.663 37.302 -3.639 25324 7825 1 11 . 1 1 118 118 MET H H 118 9.159 9.159 9.310 -0.151 25324 7826 1 11 . 1 1 119 119 THR N N 119 113.716 113.716 116.370 -2.654 25324 7827 1 11 . 1 1 119 119 THR HA H 119 4.682 4.682 4.877 -0.195 25324 7828 1 11 . 1 1 119 119 THR C C 119 173.952 173.952 173.607 0.345 25324 7829 1 11 . 1 1 119 119 THR CA C 119 61.395 61.395 61.365 0.030 25324 7830 1 11 . 1 1 119 119 THR CB C 119 71.746 71.746 71.614 0.132 25324 7831 1 11 . 1 1 119 119 THR H H 119 8.685 8.685 8.726 -0.041 25324 7832 1 11 . 1 1 120 120 TYR N N 120 129.153 129.153 125.192 3.961 25324 7833 1 11 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.705 0.095 25324 7834 1 11 . 1 1 120 120 TYR C C 120 175.214 175.214 177.000 -1.786 25324 7835 1 11 . 1 1 120 120 TYR CA C 120 58.877 58.877 59.033 -0.156 25324 7836 1 11 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.472 1.030 25324 7837 1 11 . 1 1 120 120 TYR H H 120 10.107 10.107 8.381 1.726 25324 7838 1 11 . 1 1 121 121 ALA N N 121 119.947 119.947 123.780 -3.833 25324 7839 1 11 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.134 -0.130 25324 7840 1 11 . 1 1 121 121 ALA C C 121 178.456 178.456 177.430 1.026 25324 7841 1 11 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.214 -0.258 25324 7842 1 11 . 1 1 121 121 ALA CB C 121 18.710 18.710 19.040 -0.330 25324 7843 1 11 . 1 1 121 121 ALA H H 121 8.704 8.704 8.396 0.308 25324 7844 1 11 . 1 1 122 122 GLY N N 122 111.186 111.186 105.926 5.260 25324 7845 1 11 . 1 1 122 122 GLY C C 122 173.949 173.949 173.186 0.763 25324 7846 1 11 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.290 -0.288 25324 7847 1 11 . 1 1 122 122 GLY H H 122 8.792 8.792 8.036 0.756 25324 7848 1 11 . 1 1 123 123 GLU N N 123 120.099 120.099 122.422 -2.323 25324 7849 1 11 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.412 0.293 25324 7850 1 11 . 1 1 123 123 GLU C C 123 175.912 175.912 175.588 0.324 25324 7851 1 11 . 1 1 123 123 GLU CA C 123 54.414 54.414 57.026 -2.612 25324 7852 1 11 . 1 1 123 123 GLU CB C 123 32.784 32.784 30.474 2.310 25324 7853 1 11 . 1 1 123 123 GLU H H 123 8.072 8.072 8.806 -0.734 25324 7854 1 11 . 1 1 124 124 GLY N N 124 105.303 105.303 108.995 -3.692 25324 7855 1 11 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.725 -0.923 25324 7856 1 11 . 1 1 124 124 GLY H H 124 7.939 7.939 8.047 -0.108 25324 7857 1 11 . 1 1 125 125 PRO HA H 125 4.935 4.935 5.036 -0.101 25324 7858 1 11 . 1 1 125 125 PRO C C 125 177.788 177.788 176.495 1.293 25324 7859 1 11 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.903 0.228 25324 7860 1 11 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.147 -0.288 25324 7861 1 11 . 1 1 126 126 ILE N N 126 117.387 117.387 117.974 -0.587 25324 7862 1 11 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.662 0.236 25324 7863 1 11 . 1 1 126 126 ILE C C 126 175.625 175.625 174.879 0.746 25324 7864 1 11 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.181 0.272 25324 7865 1 11 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.536 1.012 25324 7866 1 11 . 1 1 126 126 ILE H H 126 9.599 9.599 8.877 0.722 25324 7867 1 11 . 1 1 127 127 GLY N N 127 106.753 106.753 107.836 -1.083 25324 7868 1 11 . 1 1 127 127 GLY C C 127 173.627 173.627 172.784 0.843 25324 7869 1 11 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.607 1.676 25324 7870 1 11 . 1 1 127 127 GLY H H 127 8.840 8.840 8.545 0.295 25324 7871 1 11 . 1 1 128 128 PHE N N 128 124.826 124.826 126.250 -1.424 25324 7872 1 11 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.367 -0.423 25324 7873 1 11 . 1 1 128 128 PHE C C 128 173.087 173.087 173.221 -0.134 25324 7874 1 11 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.597 0.411 25324 7875 1 11 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.733 -0.573 25324 7876 1 11 . 1 1 128 128 PHE H H 128 8.924 8.924 9.339 -0.415 25324 7877 1 11 . 1 1 129 129 LYS N N 129 131.518 131.518 128.002 3.516 25324 7878 1 11 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.679 0.204 25324 7879 1 11 . 1 1 129 129 LYS C C 129 173.863 173.863 174.224 -0.361 25324 7880 1 11 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.313 1.422 25324 7881 1 11 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.066 -0.345 25324 7882 1 11 . 1 1 129 129 LYS H H 129 8.201 8.201 8.433 -0.232 25324 7883 1 11 . 1 1 130 130 GLY N N 130 114.030 114.030 114.001 0.029 25324 7884 1 11 . 1 1 130 130 GLY C C 130 171.951 171.951 172.688 -0.737 25324 7885 1 11 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.737 0.050 25324 7886 1 11 . 1 1 130 130 GLY H H 130 9.325 9.325 8.735 0.590 25324 7887 1 11 . 1 1 131 131 THR N N 131 120.583 120.583 121.509 -0.926 25324 7888 1 11 . 1 1 131 131 THR HA H 131 4.939 4.939 5.148 -0.209 25324 7889 1 11 . 1 1 131 131 THR C C 131 173.118 173.118 173.986 -0.868 25324 7890 1 11 . 1 1 131 131 THR CA C 131 61.266 61.266 61.134 0.132 25324 7891 1 11 . 1 1 131 131 THR CB C 131 70.392 70.392 72.122 -1.730 25324 7892 1 11 . 1 1 131 131 THR H H 131 8.916 8.916 8.771 0.145 25324 7893 1 11 . 1 1 132 132 LEU N N 132 130.774 130.774 127.805 2.969 25324 7894 1 11 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.693 -0.193 25324 7895 1 11 . 1 1 132 132 LEU C C 132 176.574 176.574 177.044 -0.470 25324 7896 1 11 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.827 0.360 25324 7897 1 11 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.115 1.332 25324 7898 1 11 . 1 1 132 132 LEU H H 132 8.527 8.527 8.384 0.143 25324 7899 1 12 . 1 1 3 3 LEU N N 3 123.202 123.202 123.120 0.082 25324 7900 1 12 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.176 -0.019 25324 7901 1 12 . 1 1 3 3 LEU C C 3 175.786 175.786 174.781 1.005 25324 7902 1 12 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.812 0.472 25324 7903 1 12 . 1 1 3 3 LEU CB C 3 43.330 43.330 44.022 -0.692 25324 7904 1 12 . 1 1 3 3 LEU H H 3 8.711 8.711 8.356 0.355 25324 7905 1 12 . 1 1 4 4 TYR N N 4 120.906 120.906 124.068 -3.162 25324 7906 1 12 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.033 -0.009 25324 7907 1 12 . 1 1 4 4 TYR C C 4 175.953 175.953 174.994 0.959 25324 7908 1 12 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.272 0.105 25324 7909 1 12 . 1 1 4 4 TYR CB C 4 41.655 41.655 41.923 -0.268 25324 7910 1 12 . 1 1 4 4 TYR H H 4 9.142 9.142 9.527 -0.385 25324 7911 1 12 . 1 1 5 5 ASN N N 5 120.496 120.496 120.542 -0.046 25324 7912 1 12 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.869 0.247 25324 7913 1 12 . 1 1 5 5 ASN C C 5 174.953 174.953 174.024 0.929 25324 7914 1 12 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.108 -0.161 25324 7915 1 12 . 1 1 5 5 ASN CB C 5 38.891 38.891 39.622 -0.731 25324 7916 1 12 . 1 1 5 5 ASN H H 5 8.787 8.787 9.072 -0.285 25324 7917 1 12 . 1 1 6 6 VAL N N 6 127.428 127.428 125.073 2.355 25324 7918 1 12 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.438 -0.076 25324 7919 1 12 . 1 1 6 6 VAL C C 6 174.955 174.955 174.558 0.397 25324 7920 1 12 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.263 0.170 25324 7921 1 12 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.348 -0.017 25324 7922 1 12 . 1 1 6 6 VAL H H 6 8.806 8.806 8.580 0.226 25324 7923 1 12 . 1 1 7 7 GLU N N 7 124.355 124.355 126.588 -2.233 25324 7924 1 12 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.923 0.059 25324 7925 1 12 . 1 1 7 7 GLU C C 7 174.551 174.551 174.903 -0.352 25324 7926 1 12 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.604 -0.815 25324 7927 1 12 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.621 1.946 25324 7928 1 12 . 1 1 7 7 GLU H H 7 8.800 8.800 8.920 -0.120 25324 7929 1 12 . 1 1 8 8 ASN N N 8 116.231 116.231 121.737 -5.506 25324 7930 1 12 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.618 0.423 25324 7931 1 12 . 1 1 8 8 ASN C C 8 172.709 172.709 173.549 -0.840 25324 7932 1 12 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.425 -0.808 25324 7933 1 12 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.898 2.687 25324 7934 1 12 . 1 1 8 8 ASN H H 8 9.320 9.320 9.135 0.185 25324 7935 1 12 . 1 1 9 9 GLN N N 9 120.762 120.762 123.617 -2.855 25324 7936 1 12 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.422 -0.248 25324 7937 1 12 . 1 1 9 9 GLN C C 9 173.454 173.454 174.008 -0.554 25324 7938 1 12 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.114 -0.154 25324 7939 1 12 . 1 1 9 9 GLN CB C 9 30.691 30.691 30.589 0.102 25324 7940 1 12 . 1 1 9 9 GLN H H 9 6.887 6.887 8.530 -1.643 25324 7941 1 12 . 1 1 10 10 TRP N N 10 127.775 127.775 124.172 3.603 25324 7942 1 12 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.115 -0.127 25324 7943 1 12 . 1 1 10 10 TRP C C 10 175.281 175.281 176.280 -0.999 25324 7944 1 12 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.232 0.061 25324 7945 1 12 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.175 -0.433 25324 7946 1 12 . 1 1 10 10 TRP H H 10 8.518 8.518 7.701 0.817 25324 7947 1 12 . 1 1 11 11 GLY N N 11 107.838 107.838 109.791 -1.953 25324 7948 1 12 . 1 1 11 11 GLY C C 11 174.733 174.733 175.880 -1.147 25324 7949 1 12 . 1 1 11 11 GLY CA C 11 44.836 44.836 46.550 -1.714 25324 7950 1 12 . 1 1 11 11 GLY H H 11 8.461 8.461 8.867 -0.406 25324 7951 1 12 . 1 1 12 12 GLY N N 12 109.696 109.696 110.103 -0.407 25324 7952 1 12 . 1 1 12 12 GLY C C 12 174.133 174.133 175.130 -0.997 25324 7953 1 12 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.911 -1.122 25324 7954 1 12 . 1 1 12 12 GLY H H 12 8.138 8.138 8.289 -0.151 25324 7955 1 12 . 1 1 13 13 SER N N 13 111.308 111.308 113.157 -1.849 25324 7956 1 12 . 1 1 13 13 SER HA H 13 4.092 4.092 3.951 0.141 25324 7957 1 12 . 1 1 13 13 SER C C 13 175.622 175.622 174.804 0.818 25324 7958 1 12 . 1 1 13 13 SER CA C 13 60.494 60.494 59.715 0.779 25324 7959 1 12 . 1 1 13 13 SER CB C 13 63.028 63.028 62.966 0.062 25324 7960 1 12 . 1 1 13 13 SER H H 13 8.215 8.215 7.777 0.438 25324 7961 1 12 . 1 1 14 14 SER N N 14 115.290 115.290 114.153 1.137 25324 7962 1 12 . 1 1 14 14 SER HA H 14 4.566 4.566 4.430 0.136 25324 7963 1 12 . 1 1 14 14 SER C C 14 173.532 173.532 173.769 -0.237 25324 7964 1 12 . 1 1 14 14 SER CA C 14 57.317 57.317 57.709 -0.392 25324 7965 1 12 . 1 1 14 14 SER CB C 14 63.230 63.230 63.692 -0.462 25324 7966 1 12 . 1 1 14 14 SER H H 14 8.213 8.213 8.080 0.133 25324 7967 1 12 . 1 1 15 15 ALA N N 15 126.470 126.470 125.760 0.710 25324 7968 1 12 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.525 -0.122 25324 7969 1 12 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.386 0.078 25324 7970 1 12 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.329 -0.100 25324 7971 1 12 . 1 1 15 15 ALA H H 15 7.308 7.308 7.571 -0.263 25324 7972 1 12 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.197 0.212 25324 7973 1 12 . 1 1 16 16 PRO C C 16 175.627 175.627 175.269 0.358 25324 7974 1 12 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.211 0.181 25324 7975 1 12 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.461 -0.324 25324 7976 1 12 . 1 1 17 17 TRP N N 17 120.228 120.228 119.534 0.694 25324 7977 1 12 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.291 0.027 25324 7978 1 12 . 1 1 17 17 TRP C C 17 175.951 175.951 175.919 0.032 25324 7979 1 12 . 1 1 17 17 TRP CA C 17 56.915 56.915 57.071 -0.156 25324 7980 1 12 . 1 1 17 17 TRP CB C 17 29.409 29.409 29.975 -0.566 25324 7981 1 12 . 1 1 17 17 TRP H H 17 8.380 8.380 8.097 0.283 25324 7982 1 12 . 1 1 18 18 ASN N N 18 120.663 120.663 123.924 -3.261 25324 7983 1 12 . 1 1 18 18 ASN HA H 18 5.086 5.086 4.940 0.146 25324 7984 1 12 . 1 1 18 18 ASN C C 18 174.793 174.793 174.401 0.392 25324 7985 1 12 . 1 1 18 18 ASN CA C 18 51.601 51.601 51.906 -0.305 25324 7986 1 12 . 1 1 18 18 ASN CB C 18 42.648 42.648 39.560 3.088 25324 7987 1 12 . 1 1 18 18 ASN H H 18 9.094 9.094 8.663 0.431 25324 7988 1 12 . 1 1 19 19 GLU N N 19 122.202 122.202 124.812 -2.610 25324 7989 1 12 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.759 -0.620 25324 7990 1 12 . 1 1 19 19 GLU C C 19 176.869 176.869 176.835 0.034 25324 7991 1 12 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.254 2.346 25324 7992 1 12 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.720 -0.338 25324 7993 1 12 . 1 1 19 19 GLU H H 19 9.013 9.013 8.904 0.109 25324 7994 1 12 . 1 1 20 20 GLY N N 20 112.893 112.893 112.283 0.610 25324 7995 1 12 . 1 1 20 20 GLY C C 20 174.878 174.878 173.042 1.836 25324 7996 1 12 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.943 0.052 25324 7997 1 12 . 1 1 20 20 GLY H H 20 8.926 8.926 8.366 0.560 25324 7998 1 12 . 1 1 21 21 GLY N N 21 110.354 110.354 106.781 3.573 25324 7999 1 12 . 1 1 21 21 GLY C C 21 171.623 171.623 171.989 -0.366 25324 8000 1 12 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.114 -0.716 25324 8001 1 12 . 1 1 21 21 GLY H H 21 8.258 8.258 7.690 0.568 25324 8002 1 12 . 1 1 22 22 GLN N N 22 117.541 117.541 119.107 -1.566 25324 8003 1 12 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.101 0.576 25324 8004 1 12 . 1 1 22 22 GLN C C 22 175.957 175.957 174.760 1.197 25324 8005 1 12 . 1 1 22 22 GLN CA C 22 54.944 54.944 55.049 -0.105 25324 8006 1 12 . 1 1 22 22 GLN CB C 22 31.085 31.085 33.651 -2.566 25324 8007 1 12 . 1 1 22 22 GLN H H 22 8.564 8.564 8.580 -0.016 25324 8008 1 12 . 1 1 23 23 TRP N N 23 127.208 127.208 121.060 6.148 25324 8009 1 12 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.126 0.073 25324 8010 1 12 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.294 0.237 25324 8011 1 12 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.168 -0.485 25324 8012 1 12 . 1 1 23 23 TRP H H 23 9.347 9.347 9.350 -0.003 25324 8013 1 12 . 1 1 24 24 GLU N N 24 123.504 123.504 120.885 2.619 25324 8014 1 12 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.420 0.088 25324 8015 1 12 . 1 1 24 24 GLU C C 24 174.222 174.222 175.889 -1.667 25324 8016 1 12 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.706 -0.115 25324 8017 1 12 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.666 -1.051 25324 8018 1 12 . 1 1 24 24 GLU H H 24 9.296 9.296 8.575 0.721 25324 8019 1 12 . 1 1 25 25 ILE N N 25 123.447 123.447 124.135 -0.688 25324 8020 1 12 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.682 -0.246 25324 8021 1 12 . 1 1 25 25 ILE C C 25 175.790 175.790 173.903 1.887 25324 8022 1 12 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.754 -0.127 25324 8023 1 12 . 1 1 25 25 ILE CB C 25 40.952 40.952 41.276 -0.324 25324 8024 1 12 . 1 1 25 25 ILE H H 25 8.635 8.635 8.551 0.084 25324 8025 1 12 . 1 1 26 26 GLY N N 26 111.544 111.544 111.622 -0.078 25324 8026 1 12 . 1 1 26 26 GLY C C 26 172.122 172.122 174.576 -2.454 25324 8027 1 12 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.098 -0.020 25324 8028 1 12 . 1 1 26 26 GLY H H 26 3.381 3.381 6.271 -2.890 25324 8029 1 12 . 1 1 27 27 SER N N 27 112.279 112.279 117.898 -5.619 25324 8030 1 12 . 1 1 27 27 SER HA H 27 4.876 4.876 4.525 0.351 25324 8031 1 12 . 1 1 27 27 SER C C 27 174.113 174.113 175.096 -0.983 25324 8032 1 12 . 1 1 27 27 SER CA C 27 56.954 56.954 58.365 -1.411 25324 8033 1 12 . 1 1 27 27 SER CB C 27 64.554 64.554 64.068 0.486 25324 8034 1 12 . 1 1 27 27 SER H H 27 8.212 8.212 8.939 -0.727 25324 8035 1 12 . 1 1 28 28 ARG N N 28 120.872 120.872 122.116 -1.244 25324 8036 1 12 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.288 0.475 25324 8037 1 12 . 1 1 28 28 ARG C C 28 176.119 176.119 175.714 0.405 25324 8038 1 12 . 1 1 28 28 ARG CA C 28 55.117 55.117 57.574 -2.457 25324 8039 1 12 . 1 1 28 28 ARG CB C 28 31.830 31.830 29.876 1.954 25324 8040 1 12 . 1 1 28 28 ARG H H 28 7.849 7.849 8.118 -0.269 25324 8041 1 12 . 1 1 29 29 SER N N 29 118.985 118.985 123.461 -4.476 25324 8042 1 12 . 1 1 29 29 SER HA H 29 4.192 4.192 4.582 -0.390 25324 8043 1 12 . 1 1 29 29 SER C C 29 174.622 174.622 174.869 -0.247 25324 8044 1 12 . 1 1 29 29 SER CA C 29 60.072 60.072 59.498 0.574 25324 8045 1 12 . 1 1 29 29 SER CB C 29 62.876 62.876 63.639 -0.763 25324 8046 1 12 . 1 1 29 29 SER H H 29 8.892 8.892 8.833 0.059 25324 8047 1 12 . 1 1 30 30 ASP N N 30 117.632 117.632 118.619 -0.987 25324 8048 1 12 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.778 -0.160 25324 8049 1 12 . 1 1 30 30 ASP C C 30 175.101 175.101 175.102 -0.001 25324 8050 1 12 . 1 1 30 30 ASP CA C 30 53.052 53.052 54.262 -1.210 25324 8051 1 12 . 1 1 30 30 ASP CB C 30 40.523 40.523 42.276 -1.752 25324 8052 1 12 . 1 1 30 30 ASP H H 30 8.441 8.441 8.152 0.289 25324 8053 1 12 . 1 1 31 31 GLN N N 31 118.273 118.273 119.065 -0.792 25324 8054 1 12 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.458 0.027 25324 8055 1 12 . 1 1 31 31 GLN C C 31 173.453 173.453 173.936 -0.483 25324 8056 1 12 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.084 -0.216 25324 8057 1 12 . 1 1 31 31 GLN CB C 31 33.249 33.249 31.427 1.822 25324 8058 1 12 . 1 1 31 31 GLN H H 31 7.029 7.029 7.640 -0.611 25324 8059 1 12 . 1 1 32 32 ASN N N 32 120.865 120.865 119.763 1.102 25324 8060 1 12 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.961 0.159 25324 8061 1 12 . 1 1 32 32 ASN C C 32 175.198 175.198 174.484 0.714 25324 8062 1 12 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.649 -0.780 25324 8063 1 12 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.443 -0.813 25324 8064 1 12 . 1 1 32 32 ASN H H 32 8.713 8.713 8.653 0.060 25324 8065 1 12 . 1 1 33 33 VAL N N 33 122.111 122.111 120.026 2.085 25324 8066 1 12 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.179 -0.474 25324 8067 1 12 . 1 1 33 33 VAL C C 33 174.950 174.950 175.589 -0.639 25324 8068 1 12 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.728 1.119 25324 8069 1 12 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.220 0.130 25324 8070 1 12 . 1 1 33 33 VAL H H 33 8.542 8.542 8.828 -0.286 25324 8071 1 12 . 1 1 34 34 VAL N N 34 113.282 113.282 118.722 -5.440 25324 8072 1 12 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.776 -0.131 25324 8073 1 12 . 1 1 34 34 VAL C C 34 175.574 175.574 175.237 0.337 25324 8074 1 12 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.144 -1.170 25324 8075 1 12 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.779 -0.750 25324 8076 1 12 . 1 1 34 34 VAL H H 34 8.744 8.744 8.572 0.172 25324 8077 1 12 . 1 1 35 35 ALA N N 35 122.102 122.102 122.634 -0.532 25324 8078 1 12 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.190 -0.387 25324 8079 1 12 . 1 1 35 35 ALA C C 35 175.947 175.947 174.903 1.044 25324 8080 1 12 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.100 2.150 25324 8081 1 12 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.565 -0.937 25324 8082 1 12 . 1 1 35 35 ALA H H 35 7.677 7.677 7.894 -0.217 25324 8083 1 12 . 1 1 36 36 ILE N N 36 118.005 118.005 121.743 -3.738 25324 8084 1 12 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.360 -0.332 25324 8085 1 12 . 1 1 36 36 ILE C C 36 173.116 173.116 173.722 -0.606 25324 8086 1 12 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.015 1.167 25324 8087 1 12 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.984 0.501 25324 8088 1 12 . 1 1 36 36 ILE H H 36 8.126 8.126 8.690 -0.564 25324 8089 1 12 . 1 1 37 37 ASN N N 37 125.632 125.632 125.790 -0.158 25324 8090 1 12 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.900 -0.219 25324 8091 1 12 . 1 1 37 37 ASN C C 37 174.854 174.854 173.449 1.405 25324 8092 1 12 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.332 0.198 25324 8093 1 12 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.727 -2.874 25324 8094 1 12 . 1 1 37 37 ASN H H 37 8.577 8.577 8.727 -0.150 25324 8095 1 12 . 1 1 38 38 VAL N N 38 114.223 114.223 118.563 -4.340 25324 8096 1 12 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.912 0.291 25324 8097 1 12 . 1 1 38 38 VAL C C 38 174.854 174.854 173.006 1.848 25324 8098 1 12 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.860 -1.880 25324 8099 1 12 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.811 0.233 25324 8100 1 12 . 1 1 38 38 VAL H H 38 8.874 8.874 8.801 0.073 25324 8101 1 12 . 1 1 39 39 GLU N N 39 118.277 118.277 121.840 -3.563 25324 8102 1 12 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.186 -0.104 25324 8103 1 12 . 1 1 39 39 GLU C C 39 174.548 174.548 174.894 -0.346 25324 8104 1 12 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.183 0.810 25324 8105 1 12 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.583 -1.005 25324 8106 1 12 . 1 1 39 39 GLU H H 39 8.761 8.761 9.206 -0.445 25324 8107 1 12 . 1 1 40 40 SER N N 40 114.960 114.960 120.013 -5.053 25324 8108 1 12 . 1 1 40 40 SER HA H 40 5.265 5.265 4.999 0.266 25324 8109 1 12 . 1 1 40 40 SER C C 40 175.783 175.783 175.803 -0.020 25324 8110 1 12 . 1 1 40 40 SER CA C 40 55.880 55.880 58.142 -2.262 25324 8111 1 12 . 1 1 40 40 SER CB C 40 65.911 65.911 63.901 2.010 25324 8112 1 12 . 1 1 40 40 SER H H 40 8.500 8.500 8.762 -0.262 25324 8113 1 12 . 1 1 41 41 GLY N N 41 117.567 117.567 115.010 2.557 25324 8114 1 12 . 1 1 41 41 GLY C C 41 174.119 174.119 174.029 0.090 25324 8115 1 12 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.166 -0.478 25324 8116 1 12 . 1 1 41 41 GLY H H 41 9.533 9.533 8.832 0.701 25324 8117 1 12 . 1 1 42 42 ASP N N 42 122.141 122.141 119.724 2.417 25324 8118 1 12 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.849 -0.049 25324 8119 1 12 . 1 1 42 42 ASP C C 42 176.121 176.121 175.681 0.440 25324 8120 1 12 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.371 -1.225 25324 8121 1 12 . 1 1 42 42 ASP CB C 42 39.354 39.354 43.036 -3.682 25324 8122 1 12 . 1 1 42 42 ASP H H 42 8.644 8.644 7.606 1.038 25324 8123 1 12 . 1 1 43 43 ASP N N 43 116.025 116.025 121.670 -5.645 25324 8124 1 12 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.618 -0.389 25324 8125 1 12 . 1 1 43 43 ASP C C 43 176.018 176.018 176.627 -0.609 25324 8126 1 12 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.225 1.024 25324 8127 1 12 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.706 -0.147 25324 8128 1 12 . 1 1 43 43 ASP H H 43 9.111 9.111 8.694 0.417 25324 8129 1 12 . 1 1 44 44 GLY N N 44 104.263 104.263 107.584 -3.321 25324 8130 1 12 . 1 1 44 44 GLY C C 44 173.922 173.922 175.373 -1.451 25324 8131 1 12 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.886 -0.585 25324 8132 1 12 . 1 1 44 44 GLY H H 44 9.063 9.063 8.267 0.796 25324 8133 1 12 . 1 1 45 45 GLN N N 45 121.691 121.691 119.843 1.848 25324 8134 1 12 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.038 0.048 25324 8135 1 12 . 1 1 45 45 GLN C C 45 176.284 176.284 176.003 0.281 25324 8136 1 12 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.436 -0.318 25324 8137 1 12 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.324 -1.650 25324 8138 1 12 . 1 1 45 45 GLN H H 45 7.356 7.356 8.389 -1.033 25324 8139 1 12 . 1 1 46 46 THR N N 46 111.843 111.843 113.146 -1.303 25324 8140 1 12 . 1 1 46 46 THR HA H 46 5.355 5.355 5.537 -0.182 25324 8141 1 12 . 1 1 46 46 THR C C 46 174.451 174.451 173.136 1.315 25324 8142 1 12 . 1 1 46 46 THR CA C 46 59.644 59.644 59.923 -0.279 25324 8143 1 12 . 1 1 46 46 THR CB C 46 72.714 72.714 70.188 2.526 25324 8144 1 12 . 1 1 46 46 THR H H 46 10.123 10.123 7.598 2.525 25324 8145 1 12 . 1 1 47 47 LEU N N 47 119.302 119.302 129.733 -10.431 25324 8146 1 12 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.706 0.101 25324 8147 1 12 . 1 1 47 47 LEU C C 47 175.487 175.487 175.081 0.406 25324 8148 1 12 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.990 -0.920 25324 8149 1 12 . 1 1 47 47 LEU CB C 47 48.003 48.003 43.276 4.726 25324 8150 1 12 . 1 1 47 47 LEU H H 47 8.364 8.364 8.731 -0.367 25324 8151 1 12 . 1 1 48 48 ASN N N 48 116.844 116.844 121.343 -4.499 25324 8152 1 12 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.012 -0.283 25324 8153 1 12 . 1 1 48 48 ASN C C 48 174.460 174.460 175.227 -0.767 25324 8154 1 12 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.392 1.347 25324 8155 1 12 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.434 0.978 25324 8156 1 12 . 1 1 48 48 ASN H H 48 8.748 8.748 8.850 -0.102 25324 8157 1 12 . 1 1 49 49 GLY N N 49 109.417 109.417 109.013 0.404 25324 8158 1 12 . 1 1 49 49 GLY C C 49 172.126 172.126 172.134 -0.008 25324 8159 1 12 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.177 0.314 25324 8160 1 12 . 1 1 49 49 GLY H H 49 8.744 8.744 8.911 -0.167 25324 8161 1 12 . 1 1 50 50 THR N N 50 119.162 119.162 113.006 6.156 25324 8162 1 12 . 1 1 50 50 THR HA H 50 5.556 5.556 5.507 0.049 25324 8163 1 12 . 1 1 50 50 THR C C 50 171.790 171.790 172.835 -1.045 25324 8164 1 12 . 1 1 50 50 THR CA C 50 59.371 59.371 60.113 -0.742 25324 8165 1 12 . 1 1 50 50 THR CB C 50 72.799 72.799 72.630 0.169 25324 8166 1 12 . 1 1 50 50 THR H H 50 8.799 8.799 9.001 -0.202 25324 8167 1 12 . 1 1 51 51 MET N N 51 115.232 115.232 122.735 -7.503 25324 8168 1 12 . 1 1 51 51 MET HA H 51 4.886 4.886 4.982 -0.096 25324 8169 1 12 . 1 1 51 51 MET C C 51 172.708 172.708 173.796 -1.088 25324 8170 1 12 . 1 1 51 51 MET CA C 51 54.722 54.722 54.234 0.488 25324 8171 1 12 . 1 1 51 51 MET CB C 51 34.557 34.557 37.156 -2.599 25324 8172 1 12 . 1 1 51 51 MET H H 51 9.062 9.062 9.069 -0.007 25324 8173 1 12 . 1 1 52 52 THR N N 52 113.697 113.697 123.326 -9.629 25324 8174 1 12 . 1 1 52 52 THR HA H 52 4.682 4.682 4.699 -0.017 25324 8175 1 12 . 1 1 52 52 THR C C 52 173.952 173.952 173.272 0.680 25324 8176 1 12 . 1 1 52 52 THR CA C 52 61.395 61.395 61.221 0.174 25324 8177 1 12 . 1 1 52 52 THR CB C 52 71.734 71.734 71.220 0.514 25324 8178 1 12 . 1 1 52 52 THR H H 52 8.685 8.685 8.854 -0.169 25324 8179 1 12 . 1 1 53 53 TYR N N 53 129.086 129.086 125.351 3.735 25324 8180 1 12 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.896 -0.096 25324 8181 1 12 . 1 1 53 53 TYR C C 53 175.214 175.214 176.516 -1.302 25324 8182 1 12 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.141 0.740 25324 8183 1 12 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.545 0.967 25324 8184 1 12 . 1 1 53 53 TYR H H 53 10.112 10.112 8.848 1.264 25324 8185 1 12 . 1 1 54 54 ALA N N 54 119.947 119.947 123.495 -3.548 25324 8186 1 12 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.279 -0.277 25324 8187 1 12 . 1 1 54 54 ALA C C 54 178.285 178.285 177.801 0.484 25324 8188 1 12 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.156 0.815 25324 8189 1 12 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.308 0.409 25324 8190 1 12 . 1 1 54 54 ALA H H 54 8.704 8.704 8.401 0.303 25324 8191 1 12 . 1 1 55 55 GLY N N 55 110.940 110.940 111.719 -0.779 25324 8192 1 12 . 1 1 55 55 GLY C C 55 173.903 173.903 174.361 -0.458 25324 8193 1 12 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.496 -0.480 25324 8194 1 12 . 1 1 55 55 GLY H H 55 8.745 8.745 8.632 0.113 25324 8195 1 12 . 1 1 56 56 GLU N N 56 120.073 120.073 119.973 0.100 25324 8196 1 12 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.734 -0.025 25324 8197 1 12 . 1 1 56 56 GLU C C 56 175.906 175.906 176.322 -0.416 25324 8198 1 12 . 1 1 56 56 GLU CA C 56 54.423 54.423 54.981 -0.558 25324 8199 1 12 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.202 0.623 25324 8200 1 12 . 1 1 56 56 GLU H H 56 8.039 8.039 7.805 0.234 25324 8201 1 12 . 1 1 57 57 GLY N N 57 105.298 105.298 108.653 -3.355 25324 8202 1 12 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.618 0.184 25324 8203 1 12 . 1 1 57 57 GLY H H 57 7.937 7.937 8.383 -0.446 25324 8204 1 12 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.716 0.218 25324 8205 1 12 . 1 1 58 58 PRO C C 58 177.785 177.785 176.538 1.247 25324 8206 1 12 . 1 1 58 58 PRO CA C 58 63.132 63.132 62.808 0.324 25324 8207 1 12 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.603 -0.763 25324 8208 1 12 . 1 1 59 59 ILE N N 59 117.386 117.386 116.516 0.870 25324 8209 1 12 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.725 0.263 25324 8210 1 12 . 1 1 59 59 ILE C C 59 175.688 175.688 175.319 0.369 25324 8211 1 12 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.185 0.358 25324 8212 1 12 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.252 1.036 25324 8213 1 12 . 1 1 59 59 ILE H H 59 9.600 9.600 8.849 0.751 25324 8214 1 12 . 1 1 60 60 GLY N N 60 107.164 107.164 108.326 -1.162 25324 8215 1 12 . 1 1 60 60 GLY C C 60 173.787 173.787 172.578 1.209 25324 8216 1 12 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.581 1.654 25324 8217 1 12 . 1 1 60 60 GLY H H 60 8.957 8.957 8.626 0.331 25324 8218 1 12 . 1 1 61 61 PHE N N 61 124.597 124.597 125.299 -0.702 25324 8219 1 12 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.275 -0.052 25324 8220 1 12 . 1 1 61 61 PHE C C 61 173.126 173.126 173.231 -0.105 25324 8221 1 12 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.762 0.099 25324 8222 1 12 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.275 -0.058 25324 8223 1 12 . 1 1 61 61 PHE H H 61 8.788 8.788 9.065 -0.277 25324 8224 1 12 . 1 1 62 62 ARG N N 62 129.706 129.706 127.630 2.076 25324 8225 1 12 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.203 -0.071 25324 8226 1 12 . 1 1 62 62 ARG C C 62 172.456 172.456 173.017 -0.561 25324 8227 1 12 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.969 0.985 25324 8228 1 12 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.216 -1.346 25324 8229 1 12 . 1 1 62 62 ARG H H 62 8.405 8.405 8.299 0.106 25324 8230 1 12 . 1 1 63 63 ALA N N 63 122.744 122.744 129.130 -6.386 25324 8231 1 12 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.348 -0.003 25324 8232 1 12 . 1 1 63 63 ALA C C 63 176.120 176.120 175.528 0.592 25324 8233 1 12 . 1 1 63 63 ALA CA C 63 49.919 49.919 49.889 0.030 25324 8234 1 12 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.910 1.863 25324 8235 1 12 . 1 1 63 63 ALA H H 63 8.628 8.628 8.763 -0.135 25324 8236 1 12 . 1 1 64 64 THR N N 64 116.855 116.855 118.226 -1.371 25324 8237 1 12 . 1 1 64 64 THR HA H 64 4.848 4.848 5.297 -0.449 25324 8238 1 12 . 1 1 64 64 THR C C 64 172.957 172.957 173.445 -0.488 25324 8239 1 12 . 1 1 64 64 THR CA C 64 61.211 61.211 61.039 0.172 25324 8240 1 12 . 1 1 64 64 THR CB C 64 71.064 71.064 71.543 -0.479 25324 8241 1 12 . 1 1 64 64 THR H H 64 8.315 8.315 8.528 -0.213 25324 8242 1 12 . 1 1 65 65 LEU N N 65 129.360 129.360 129.399 -0.039 25324 8243 1 12 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.895 -0.533 25324 8244 1 12 . 1 1 65 65 LEU C C 65 176.459 176.459 176.230 0.229 25324 8245 1 12 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.500 1.187 25324 8246 1 12 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.274 -0.563 25324 8247 1 12 . 1 1 65 65 LEU H H 65 8.877 8.877 8.778 0.099 25324 8248 1 12 . 1 1 66 66 LEU N N 66 128.683 128.683 128.209 0.474 25324 8249 1 12 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.313 0.063 25324 8250 1 12 . 1 1 66 66 LEU C C 66 177.621 177.621 177.242 0.379 25324 8251 1 12 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.655 -0.955 25324 8252 1 12 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.328 -0.026 25324 8253 1 12 . 1 1 66 66 LEU H H 66 9.320 9.320 9.072 0.248 25324 8254 1 12 . 1 1 67 67 GLY N N 67 105.361 105.361 106.641 -1.280 25324 8255 1 12 . 1 1 67 67 GLY C C 67 173.618 173.618 174.383 -0.765 25324 8256 1 12 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.034 -1.667 25324 8257 1 12 . 1 1 67 67 GLY H H 67 6.639 6.639 8.086 -1.447 25324 8258 1 12 . 1 1 68 68 ASN N N 68 121.848 121.848 118.048 3.800 25324 8259 1 12 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.822 -0.491 25324 8260 1 12 . 1 1 68 68 ASN C C 68 174.316 174.316 174.864 -0.548 25324 8261 1 12 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.755 2.797 25324 8262 1 12 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.432 -1.267 25324 8263 1 12 . 1 1 68 68 ASN H H 68 9.236 9.236 8.113 1.123 25324 8264 1 12 . 1 1 69 69 ASN N N 69 109.509 109.509 111.923 -2.414 25324 8265 1 12 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.394 -0.314 25324 8266 1 12 . 1 1 69 69 ASN C C 69 171.456 171.456 174.075 -2.619 25324 8267 1 12 . 1 1 69 69 ASN CA C 69 55.750 55.750 55.008 0.742 25324 8268 1 12 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.178 0.128 25324 8269 1 12 . 1 1 69 69 ASN H H 69 8.651 8.651 8.526 0.125 25324 8270 1 12 . 1 1 70 70 SER N N 70 113.479 113.479 116.468 -2.989 25324 8271 1 12 . 1 1 70 70 SER HA H 70 5.437 5.437 5.119 0.318 25324 8272 1 12 . 1 1 70 70 SER C C 70 173.750 173.750 173.598 0.152 25324 8273 1 12 . 1 1 70 70 SER CA C 70 57.139 57.139 59.580 -2.441 25324 8274 1 12 . 1 1 70 70 SER CB C 70 63.818 63.818 64.400 -0.582 25324 8275 1 12 . 1 1 70 70 SER H H 70 7.693 7.693 7.415 0.278 25324 8276 1 12 . 1 1 71 71 TYR N N 71 123.132 123.132 122.975 0.157 25324 8277 1 12 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.145 -0.002 25324 8278 1 12 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.527 0.121 25324 8279 1 12 . 1 1 71 71 TYR CB C 71 42.445 42.445 41.691 0.754 25324 8280 1 12 . 1 1 71 71 TYR H H 71 9.326 9.326 9.624 -0.298 25324 8281 1 12 . 1 1 72 72 GLU N N 72 122.396 122.396 123.839 -1.443 25324 8282 1 12 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.673 0.133 25324 8283 1 12 . 1 1 72 72 GLU C C 72 175.698 175.698 175.215 0.483 25324 8284 1 12 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.798 -0.631 25324 8285 1 12 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.012 -0.829 25324 8286 1 12 . 1 1 72 72 GLU H H 72 8.624 8.624 9.083 -0.459 25324 8287 1 12 . 1 1 73 73 VAL N N 73 128.513 128.513 128.295 0.218 25324 8288 1 12 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.385 -0.186 25324 8289 1 12 . 1 1 73 73 VAL C C 73 175.369 175.369 174.502 0.867 25324 8290 1 12 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.768 0.712 25324 8291 1 12 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.472 -0.140 25324 8292 1 12 . 1 1 73 73 VAL H H 73 8.564 8.564 9.083 -0.519 25324 8293 1 12 . 1 1 74 74 GLU N N 74 124.842 124.842 126.660 -1.818 25324 8294 1 12 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.037 0.050 25324 8295 1 12 . 1 1 74 74 GLU C C 74 174.415 174.415 175.029 -0.614 25324 8296 1 12 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.685 -0.348 25324 8297 1 12 . 1 1 74 74 GLU CB C 74 35.157 35.157 32.459 2.698 25324 8298 1 12 . 1 1 74 74 GLU H H 74 9.011 9.011 8.850 0.161 25324 8299 1 12 . 1 1 75 75 ASN N N 75 116.136 116.136 123.325 -7.189 25324 8300 1 12 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.544 0.595 25324 8301 1 12 . 1 1 75 75 ASN C C 75 172.703 172.703 174.157 -1.454 25324 8302 1 12 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.212 -0.387 25324 8303 1 12 . 1 1 75 75 ASN CB C 75 45.896 45.896 40.764 5.133 25324 8304 1 12 . 1 1 75 75 ASN H H 75 9.424 9.424 8.872 0.552 25324 8305 1 12 . 1 1 76 76 GLN N N 76 120.762 120.762 123.217 -2.455 25324 8306 1 12 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.543 -0.503 25324 8307 1 12 . 1 1 76 76 GLN C C 76 173.113 173.113 174.061 -0.948 25324 8308 1 12 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.454 -0.231 25324 8309 1 12 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.231 -0.883 25324 8310 1 12 . 1 1 76 76 GLN H H 76 7.106 7.106 8.789 -1.683 25324 8311 1 12 . 1 1 77 77 TRP N N 77 125.598 125.598 124.306 1.292 25324 8312 1 12 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.113 0.039 25324 8313 1 12 . 1 1 77 77 TRP C C 77 175.502 175.502 175.833 -0.331 25324 8314 1 12 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.602 -0.838 25324 8315 1 12 . 1 1 77 77 TRP CB C 77 29.999 29.999 31.013 -1.014 25324 8316 1 12 . 1 1 77 77 TRP H H 77 8.181 8.181 8.095 0.086 25324 8317 1 12 . 1 1 78 78 GLY N N 78 107.901 107.901 108.814 -0.913 25324 8318 1 12 . 1 1 78 78 GLY C C 78 174.611 174.611 174.473 0.138 25324 8319 1 12 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.888 0.014 25324 8320 1 12 . 1 1 78 78 GLY H H 78 8.778 8.778 8.839 -0.061 25324 8321 1 12 . 1 1 79 79 GLY N N 79 109.844 109.844 107.399 2.445 25324 8322 1 12 . 1 1 79 79 GLY C C 79 173.782 173.782 174.017 -0.235 25324 8323 1 12 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.473 -0.680 25324 8324 1 12 . 1 1 79 79 GLY H H 79 8.198 8.198 7.368 0.830 25324 8325 1 12 . 1 1 80 80 ASP N N 80 115.837 115.837 117.094 -1.257 25324 8326 1 12 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.317 -0.076 25324 8327 1 12 . 1 1 80 80 ASP C C 80 177.285 177.285 176.391 0.894 25324 8328 1 12 . 1 1 80 80 ASP CA C 80 56.183 56.183 56.071 0.112 25324 8329 1 12 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.708 -0.185 25324 8330 1 12 . 1 1 80 80 ASP H H 80 8.132 8.132 8.685 -0.553 25324 8331 1 12 . 1 1 81 81 SER N N 81 112.690 112.690 115.278 -2.588 25324 8332 1 12 . 1 1 81 81 SER HA H 81 4.513 4.513 4.440 0.073 25324 8333 1 12 . 1 1 81 81 SER C C 81 173.684 173.684 173.845 -0.161 25324 8334 1 12 . 1 1 81 81 SER CA C 81 57.232 57.232 58.319 -1.087 25324 8335 1 12 . 1 1 81 81 SER CB C 81 63.170 63.170 63.033 0.137 25324 8336 1 12 . 1 1 81 81 SER H H 81 8.179 8.179 8.152 0.027 25324 8337 1 12 . 1 1 82 82 ALA N N 82 126.310 126.310 125.077 1.233 25324 8338 1 12 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.581 -0.178 25324 8339 1 12 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.612 0.854 25324 8340 1 12 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.865 -0.667 25324 8341 1 12 . 1 1 82 82 ALA H H 82 7.274 7.274 7.179 0.095 25324 8342 1 12 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.181 0.192 25324 8343 1 12 . 1 1 83 83 PRO C C 83 175.378 175.378 175.386 -0.008 25324 8344 1 12 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.177 0.150 25324 8345 1 12 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.527 -0.363 25324 8346 1 12 . 1 1 84 84 TRP N N 84 120.106 120.106 117.269 2.837 25324 8347 1 12 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.374 -0.103 25324 8348 1 12 . 1 1 84 84 TRP C C 84 176.358 176.358 175.904 0.454 25324 8349 1 12 . 1 1 84 84 TRP CA C 84 56.946 56.946 57.140 -0.194 25324 8350 1 12 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.627 -0.911 25324 8351 1 12 . 1 1 84 84 TRP H H 84 8.329 8.329 7.957 0.372 25324 8352 1 12 . 1 1 85 85 HIS N N 85 118.543 118.543 120.596 -2.053 25324 8353 1 12 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.773 0.145 25324 8354 1 12 . 1 1 85 85 HIS C C 85 174.950 174.950 174.809 0.141 25324 8355 1 12 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.948 -1.479 25324 8356 1 12 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.753 -1.080 25324 8357 1 12 . 1 1 85 85 HIS H H 85 9.204 9.204 8.762 0.442 25324 8358 1 12 . 1 1 86 86 SER N N 86 117.803 117.803 117.233 0.570 25324 8359 1 12 . 1 1 86 86 SER HA H 86 4.412 4.412 4.217 0.195 25324 8360 1 12 . 1 1 86 86 SER C C 86 175.691 175.691 174.661 1.030 25324 8361 1 12 . 1 1 86 86 SER CA C 86 60.257 60.257 59.747 0.510 25324 8362 1 12 . 1 1 86 86 SER CB C 86 63.015 63.015 63.182 -0.167 25324 8363 1 12 . 1 1 86 86 SER H H 86 9.168 9.168 8.825 0.343 25324 8364 1 12 . 1 1 87 87 GLY N N 87 115.773 115.773 113.532 2.241 25324 8365 1 12 . 1 1 87 87 GLY C C 87 174.288 174.288 174.064 0.224 25324 8366 1 12 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.881 -0.180 25324 8367 1 12 . 1 1 87 87 GLY H H 87 9.284 9.284 8.947 0.337 25324 8368 1 12 . 1 1 88 88 GLY N N 88 109.162 109.162 108.192 0.970 25324 8369 1 12 . 1 1 88 88 GLY C C 88 171.120 171.120 171.789 -0.669 25324 8370 1 12 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.051 -0.457 25324 8371 1 12 . 1 1 88 88 GLY H H 88 8.054 8.054 7.875 0.179 25324 8372 1 12 . 1 1 89 89 ASN N N 89 117.048 117.048 120.083 -3.035 25324 8373 1 12 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.680 0.358 25324 8374 1 12 . 1 1 89 89 ASN C C 89 175.287 175.287 174.979 0.308 25324 8375 1 12 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.447 -0.582 25324 8376 1 12 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.093 -0.488 25324 8377 1 12 . 1 1 89 89 ASN H H 89 8.516 8.516 8.743 -0.227 25324 8378 1 12 . 1 1 90 90 TRP N N 90 125.844 125.844 126.272 -0.428 25324 8379 1 12 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.070 0.183 25324 8380 1 12 . 1 1 90 90 TRP C C 90 175.278 175.278 175.420 -0.142 25324 8381 1 12 . 1 1 90 90 TRP CA C 90 54.268 54.268 53.998 0.270 25324 8382 1 12 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.488 0.470 25324 8383 1 12 . 1 1 90 90 TRP H H 90 9.282 9.282 9.196 0.086 25324 8384 1 12 . 1 1 91 91 ILE N N 91 123.134 123.134 121.105 2.029 25324 8385 1 12 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.916 0.530 25324 8386 1 12 . 1 1 91 91 ILE C C 91 175.489 175.489 175.464 0.025 25324 8387 1 12 . 1 1 91 91 ILE CA C 91 60.826 60.826 59.849 0.977 25324 8388 1 12 . 1 1 91 91 ILE CB C 91 39.676 39.676 37.612 2.064 25324 8389 1 12 . 1 1 91 91 ILE H H 91 9.318 9.318 8.670 0.648 25324 8390 1 12 . 1 1 92 92 LEU N N 92 123.452 123.452 129.050 -5.598 25324 8391 1 12 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.797 0.145 25324 8392 1 12 . 1 1 92 92 LEU C C 92 173.620 173.620 174.294 -0.674 25324 8393 1 12 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.570 -1.314 25324 8394 1 12 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.330 2.178 25324 8395 1 12 . 1 1 92 92 LEU H H 92 8.463 8.463 8.800 -0.337 25324 8396 1 12 . 1 1 93 93 GLY N N 93 103.987 103.987 107.823 -3.836 25324 8397 1 12 . 1 1 93 93 GLY C C 93 172.284 172.284 173.854 -1.570 25324 8398 1 12 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.544 -2.044 25324 8399 1 12 . 1 1 93 93 GLY H H 93 2.937 2.937 7.241 -4.304 25324 8400 1 12 . 1 1 94 94 SER N N 94 110.274 110.274 118.915 -8.641 25324 8401 1 12 . 1 1 94 94 SER HA H 94 4.711 4.711 4.910 -0.199 25324 8402 1 12 . 1 1 94 94 SER C C 94 174.784 174.784 175.786 -1.002 25324 8403 1 12 . 1 1 94 94 SER CA C 94 56.555 56.555 58.526 -1.971 25324 8404 1 12 . 1 1 94 94 SER CB C 94 65.051 65.051 65.313 -0.262 25324 8405 1 12 . 1 1 94 94 SER H H 94 7.919 7.919 8.873 -0.954 25324 8406 1 12 . 1 1 95 95 ARG N N 95 123.020 123.020 121.642 1.378 25324 8407 1 12 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.453 0.219 25324 8408 1 12 . 1 1 95 95 ARG C C 95 176.120 176.120 176.311 -0.191 25324 8409 1 12 . 1 1 95 95 ARG CA C 95 55.374 55.374 56.330 -0.956 25324 8410 1 12 . 1 1 95 95 ARG CB C 95 31.848 31.848 29.906 1.942 25324 8411 1 12 . 1 1 95 95 ARG H H 95 9.148 9.148 8.009 1.139 25324 8412 1 12 . 1 1 96 96 GLU N N 96 120.357 120.357 118.635 1.722 25324 8413 1 12 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.002 0.280 25324 8414 1 12 . 1 1 96 96 GLU C C 96 176.278 176.278 176.254 0.024 25324 8415 1 12 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.992 -2.462 25324 8416 1 12 . 1 1 96 96 GLU CB C 96 30.153 30.153 28.019 2.134 25324 8417 1 12 . 1 1 96 96 GLU H H 96 8.610 8.610 8.653 -0.043 25324 8418 1 12 . 1 1 97 97 ASN N N 97 117.678 117.678 119.620 -1.942 25324 8419 1 12 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.767 -0.155 25324 8420 1 12 . 1 1 97 97 ASN C C 97 173.949 173.949 174.242 -0.293 25324 8421 1 12 . 1 1 97 97 ASN CA C 97 53.015 53.015 53.841 -0.826 25324 8422 1 12 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.969 -0.803 25324 8423 1 12 . 1 1 97 97 ASN H H 97 8.533 8.533 8.245 0.288 25324 8424 1 12 . 1 1 98 98 GLN N N 98 118.592 118.592 119.567 -0.975 25324 8425 1 12 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.449 -0.089 25324 8426 1 12 . 1 1 98 98 GLN C C 98 173.116 173.116 173.968 -0.852 25324 8427 1 12 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.197 0.431 25324 8428 1 12 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.715 0.154 25324 8429 1 12 . 1 1 98 98 GLN H H 98 7.663 7.663 7.627 0.036 25324 8430 1 12 . 1 1 99 99 ASN N N 99 122.855 122.855 122.437 0.418 25324 8431 1 12 . 1 1 99 99 ASN HA H 99 5.135 5.135 4.951 0.184 25324 8432 1 12 . 1 1 99 99 ASN C C 99 175.287 175.287 175.370 -0.083 25324 8433 1 12 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.916 0.074 25324 8434 1 12 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.060 0.431 25324 8435 1 12 . 1 1 99 99 ASN H H 99 8.759 8.759 8.637 0.122 25324 8436 1 12 . 1 1 100 100 VAL N N 100 121.385 121.385 120.026 1.359 25324 8437 1 12 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.719 0.029 25324 8438 1 12 . 1 1 100 100 VAL C C 100 174.956 174.956 176.362 -1.406 25324 8439 1 12 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.718 0.125 25324 8440 1 12 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.399 1.044 25324 8441 1 12 . 1 1 100 100 VAL H H 100 8.717 8.717 8.013 0.704 25324 8442 1 12 . 1 1 101 101 VAL N N 101 112.736 112.736 120.822 -8.086 25324 8443 1 12 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.430 0.215 25324 8444 1 12 . 1 1 101 101 VAL C C 101 175.577 175.577 174.620 0.957 25324 8445 1 12 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.121 -1.158 25324 8446 1 12 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.230 -0.189 25324 8447 1 12 . 1 1 101 101 VAL H H 101 8.802 8.802 8.798 0.004 25324 8448 1 12 . 1 1 102 102 ALA N N 102 122.104 122.104 121.653 0.451 25324 8449 1 12 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.204 -0.397 25324 8450 1 12 . 1 1 102 102 ALA C C 102 176.046 176.046 174.992 1.054 25324 8451 1 12 . 1 1 102 102 ALA CA C 102 53.254 53.254 51.249 2.005 25324 8452 1 12 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.431 -0.806 25324 8453 1 12 . 1 1 102 102 ALA H H 102 7.677 7.677 7.762 -0.085 25324 8454 1 12 . 1 1 103 103 ILE N N 103 118.218 118.218 120.982 -2.764 25324 8455 1 12 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.234 -0.207 25324 8456 1 12 . 1 1 103 103 ILE C C 103 173.118 173.118 173.697 -0.579 25324 8457 1 12 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.842 1.385 25324 8458 1 12 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.614 0.857 25324 8459 1 12 . 1 1 103 103 ILE H H 103 8.102 8.102 8.792 -0.690 25324 8460 1 12 . 1 1 104 104 ASN N N 104 125.938 125.938 126.802 -0.864 25324 8461 1 12 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.105 0.581 25324 8462 1 12 . 1 1 104 104 ASN C C 104 174.870 174.870 173.504 1.366 25324 8463 1 12 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.472 0.081 25324 8464 1 12 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.329 -1.477 25324 8465 1 12 . 1 1 104 104 ASN H H 104 8.668 8.668 9.012 -0.344 25324 8466 1 12 . 1 1 105 105 VAL N N 105 114.631 114.631 119.520 -4.889 25324 8467 1 12 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.070 0.135 25324 8468 1 12 . 1 1 105 105 VAL C C 105 174.788 174.788 173.403 1.385 25324 8469 1 12 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.042 -2.063 25324 8470 1 12 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.056 0.984 25324 8471 1 12 . 1 1 105 105 VAL H H 105 8.933 8.933 8.735 0.198 25324 8472 1 12 . 1 1 106 106 GLU N N 106 118.347 118.347 125.012 -6.665 25324 8473 1 12 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.286 -0.206 25324 8474 1 12 . 1 1 106 106 GLU C C 106 174.777 174.777 174.853 -0.076 25324 8475 1 12 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.887 0.080 25324 8476 1 12 . 1 1 106 106 GLU CB C 106 33.643 33.643 33.569 0.074 25324 8477 1 12 . 1 1 106 106 GLU H H 106 8.814 8.814 8.850 -0.036 25324 8478 1 12 . 1 1 107 107 SER N N 107 115.335 115.335 120.467 -5.132 25324 8479 1 12 . 1 1 107 107 SER HA H 107 5.266 5.266 4.890 0.376 25324 8480 1 12 . 1 1 107 107 SER C C 107 175.787 175.787 173.806 1.981 25324 8481 1 12 . 1 1 107 107 SER CA C 107 55.888 55.888 57.092 -1.204 25324 8482 1 12 . 1 1 107 107 SER CB C 107 65.921 65.921 65.871 0.050 25324 8483 1 12 . 1 1 107 107 SER H H 107 8.576 8.576 8.696 -0.120 25324 8484 1 12 . 1 1 108 108 GLY N N 108 117.567 117.567 108.253 9.314 25324 8485 1 12 . 1 1 108 108 GLY C C 108 173.959 173.959 174.344 -0.385 25324 8486 1 12 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.257 -0.580 25324 8487 1 12 . 1 1 108 108 GLY H H 108 9.532 9.532 8.760 0.772 25324 8488 1 12 . 1 1 109 109 ASP N N 109 122.108 122.108 123.056 -0.948 25324 8489 1 12 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.844 -0.043 25324 8490 1 12 . 1 1 109 109 ASP C C 109 176.203 176.203 175.530 0.673 25324 8491 1 12 . 1 1 109 109 ASP CA C 109 52.134 52.134 53.640 -1.506 25324 8492 1 12 . 1 1 109 109 ASP CB C 109 39.342 39.342 40.762 -1.420 25324 8493 1 12 . 1 1 109 109 ASP H H 109 8.605 8.605 8.149 0.456 25324 8494 1 12 . 1 1 110 110 ASP N N 110 116.197 116.197 117.263 -1.066 25324 8495 1 12 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.358 -0.136 25324 8496 1 12 . 1 1 110 110 ASP C C 110 175.951 175.951 176.182 -0.231 25324 8497 1 12 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.569 -0.371 25324 8498 1 12 . 1 1 110 110 ASP CB C 110 38.630 38.630 39.864 -1.234 25324 8499 1 12 . 1 1 110 110 ASP H H 110 9.087 9.087 8.539 0.548 25324 8500 1 12 . 1 1 111 111 GLY N N 111 103.841 103.841 103.363 0.478 25324 8501 1 12 . 1 1 111 111 GLY C C 111 173.924 173.924 174.370 -0.446 25324 8502 1 12 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.258 -0.095 25324 8503 1 12 . 1 1 111 111 GLY H H 111 8.930 8.930 8.434 0.496 25324 8504 1 12 . 1 1 112 112 GLN N N 112 121.626 121.626 119.974 1.652 25324 8505 1 12 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.193 -0.123 25324 8506 1 12 . 1 1 112 112 GLN C C 112 176.431 176.431 175.159 1.272 25324 8507 1 12 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.490 -0.217 25324 8508 1 12 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.655 -1.962 25324 8509 1 12 . 1 1 112 112 GLN H H 112 7.351 7.351 8.156 -0.805 25324 8510 1 12 . 1 1 113 113 THR N N 113 112.322 112.322 109.728 2.594 25324 8511 1 12 . 1 1 113 113 THR HA H 113 5.331 5.331 5.139 0.192 25324 8512 1 12 . 1 1 113 113 THR C C 113 174.452 174.452 172.949 1.503 25324 8513 1 12 . 1 1 113 113 THR CA C 113 59.739 59.739 60.109 -0.370 25324 8514 1 12 . 1 1 113 113 THR CB C 113 71.773 71.773 71.214 0.559 25324 8515 1 12 . 1 1 113 113 THR H H 113 10.053 10.053 7.473 2.580 25324 8516 1 12 . 1 1 114 114 LEU N N 114 122.083 122.083 125.988 -3.905 25324 8517 1 12 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.685 -0.104 25324 8518 1 12 . 1 1 114 114 LEU C C 114 175.113 175.113 174.072 1.041 25324 8519 1 12 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.642 -0.737 25324 8520 1 12 . 1 1 114 114 LEU CB C 114 47.033 47.033 45.398 1.635 25324 8521 1 12 . 1 1 114 114 LEU H H 114 8.978 8.978 8.922 0.056 25324 8522 1 12 . 1 1 115 115 ASN N N 115 118.846 118.846 121.498 -2.652 25324 8523 1 12 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.770 -0.000 25324 8524 1 12 . 1 1 115 115 ASN C C 115 174.788 174.788 174.413 0.375 25324 8525 1 12 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.471 0.871 25324 8526 1 12 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.080 1.334 25324 8527 1 12 . 1 1 115 115 ASN H H 115 8.837 8.837 8.108 0.729 25324 8528 1 12 . 1 1 116 116 GLY N N 116 109.661 109.661 105.934 3.727 25324 8529 1 12 . 1 1 116 116 GLY C C 116 172.452 172.452 172.698 -0.246 25324 8530 1 12 . 1 1 116 116 GLY CA C 116 46.471 46.471 45.928 0.543 25324 8531 1 12 . 1 1 116 116 GLY H H 116 8.625 8.625 8.674 -0.049 25324 8532 1 12 . 1 1 117 117 THR N N 117 120.009 120.009 113.906 6.103 25324 8533 1 12 . 1 1 117 117 THR HA H 117 5.556 5.556 5.629 -0.073 25324 8534 1 12 . 1 1 117 117 THR C C 117 171.619 171.619 173.234 -1.615 25324 8535 1 12 . 1 1 117 117 THR CA C 117 59.373 59.373 60.003 -0.630 25324 8536 1 12 . 1 1 117 117 THR CB C 117 72.777 72.777 72.656 0.121 25324 8537 1 12 . 1 1 117 117 THR H H 117 8.911 8.911 9.005 -0.094 25324 8538 1 12 . 1 1 118 118 MET N N 118 115.550 115.550 117.596 -2.046 25324 8539 1 12 . 1 1 118 118 MET HA H 118 4.889 4.889 4.958 -0.069 25324 8540 1 12 . 1 1 118 118 MET C C 118 172.707 172.707 173.740 -1.033 25324 8541 1 12 . 1 1 118 118 MET CA C 118 54.714 54.714 54.848 -0.134 25324 8542 1 12 . 1 1 118 118 MET CB C 118 33.663 33.663 36.620 -2.957 25324 8543 1 12 . 1 1 118 118 MET H H 118 9.159 9.159 9.412 -0.253 25324 8544 1 12 . 1 1 119 119 THR N N 119 113.716 113.716 116.307 -2.591 25324 8545 1 12 . 1 1 119 119 THR HA H 119 4.682 4.682 4.861 -0.179 25324 8546 1 12 . 1 1 119 119 THR C C 119 173.952 173.952 173.138 0.814 25324 8547 1 12 . 1 1 119 119 THR CA C 119 61.395 61.395 61.850 -0.455 25324 8548 1 12 . 1 1 119 119 THR CB C 119 71.746 71.746 71.642 0.104 25324 8549 1 12 . 1 1 119 119 THR H H 119 8.685 8.685 8.728 -0.043 25324 8550 1 12 . 1 1 120 120 TYR N N 120 129.153 129.153 125.999 3.154 25324 8551 1 12 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.954 -0.154 25324 8552 1 12 . 1 1 120 120 TYR C C 120 175.214 175.214 175.740 -0.526 25324 8553 1 12 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.122 0.755 25324 8554 1 12 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.701 -0.199 25324 8555 1 12 . 1 1 120 120 TYR H H 120 10.107 10.107 8.684 1.423 25324 8556 1 12 . 1 1 121 121 ALA N N 121 119.947 119.947 124.063 -4.116 25324 8557 1 12 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.290 -0.286 25324 8558 1 12 . 1 1 121 121 ALA C C 121 178.456 178.456 178.108 0.348 25324 8559 1 12 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.605 0.351 25324 8560 1 12 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.711 -0.001 25324 8561 1 12 . 1 1 121 121 ALA H H 121 8.704 8.704 8.648 0.056 25324 8562 1 12 . 1 1 122 122 GLY N N 122 111.186 111.186 111.205 -0.019 25324 8563 1 12 . 1 1 122 122 GLY C C 122 173.949 173.949 174.081 -0.132 25324 8564 1 12 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.216 -0.214 25324 8565 1 12 . 1 1 122 122 GLY H H 122 8.792 8.792 8.606 0.186 25324 8566 1 12 . 1 1 123 123 GLU N N 123 120.099 120.099 119.277 0.822 25324 8567 1 12 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.592 0.113 25324 8568 1 12 . 1 1 123 123 GLU C C 123 175.912 175.912 175.827 0.085 25324 8569 1 12 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.837 -0.423 25324 8570 1 12 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.382 0.402 25324 8571 1 12 . 1 1 123 123 GLU H H 123 8.072 8.072 7.707 0.365 25324 8572 1 12 . 1 1 124 124 GLY N N 124 105.303 105.303 108.927 -3.624 25324 8573 1 12 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.899 -0.097 25324 8574 1 12 . 1 1 124 124 GLY H H 124 7.939 7.939 8.502 -0.563 25324 8575 1 12 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.833 0.102 25324 8576 1 12 . 1 1 125 125 PRO C C 125 177.788 177.788 176.471 1.317 25324 8577 1 12 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.993 0.138 25324 8578 1 12 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.505 -0.646 25324 8579 1 12 . 1 1 126 126 ILE N N 126 117.387 117.387 116.846 0.541 25324 8580 1 12 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.751 0.148 25324 8581 1 12 . 1 1 126 126 ILE C C 126 175.625 175.625 174.860 0.765 25324 8582 1 12 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.208 0.245 25324 8583 1 12 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.495 1.053 25324 8584 1 12 . 1 1 126 126 ILE H H 126 9.599 9.599 9.025 0.574 25324 8585 1 12 . 1 1 127 127 GLY N N 127 106.753 106.753 107.795 -1.042 25324 8586 1 12 . 1 1 127 127 GLY C C 127 173.627 173.627 172.656 0.971 25324 8587 1 12 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.423 1.860 25324 8588 1 12 . 1 1 127 127 GLY H H 127 8.840 8.840 8.782 0.058 25324 8589 1 12 . 1 1 128 128 PHE N N 128 124.826 124.826 125.418 -0.592 25324 8590 1 12 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.247 -0.303 25324 8591 1 12 . 1 1 128 128 PHE C C 128 173.087 173.087 173.147 -0.060 25324 8592 1 12 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.665 0.344 25324 8593 1 12 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.592 -0.432 25324 8594 1 12 . 1 1 128 128 PHE H H 128 8.924 8.924 9.186 -0.262 25324 8595 1 12 . 1 1 129 129 LYS N N 129 131.518 131.518 126.847 4.671 25324 8596 1 12 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.745 0.138 25324 8597 1 12 . 1 1 129 129 LYS C C 129 173.863 173.863 173.600 0.263 25324 8598 1 12 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.285 1.450 25324 8599 1 12 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.842 -1.121 25324 8600 1 12 . 1 1 129 129 LYS H H 129 8.201 8.201 8.231 -0.030 25324 8601 1 12 . 1 1 130 130 GLY N N 130 114.030 114.030 112.849 1.181 25324 8602 1 12 . 1 1 130 130 GLY C C 130 171.951 171.951 172.296 -0.345 25324 8603 1 12 . 1 1 130 130 GLY CA C 130 43.787 43.787 44.030 -0.243 25324 8604 1 12 . 1 1 130 130 GLY H H 130 9.325 9.325 8.838 0.487 25324 8605 1 12 . 1 1 131 131 THR N N 131 120.583 120.583 121.604 -1.021 25324 8606 1 12 . 1 1 131 131 THR HA H 131 4.939 4.939 4.874 0.065 25324 8607 1 12 . 1 1 131 131 THR C C 131 173.118 173.118 173.370 -0.252 25324 8608 1 12 . 1 1 131 131 THR CA C 131 61.266 61.266 61.709 -0.444 25324 8609 1 12 . 1 1 131 131 THR CB C 131 70.392 70.392 71.414 -1.022 25324 8610 1 12 . 1 1 131 131 THR H H 131 8.916 8.916 8.820 0.096 25324 8611 1 12 . 1 1 132 132 LEU N N 132 130.774 130.774 130.287 0.487 25324 8612 1 12 . 1 1 132 132 LEU HA H 132 3.500 3.500 4.105 -0.605 25324 8613 1 12 . 1 1 132 132 LEU C C 132 176.574 176.574 175.796 0.778 25324 8614 1 12 . 1 1 132 132 LEU CA C 132 56.187 56.187 54.502 1.685 25324 8615 1 12 . 1 1 132 132 LEU CB C 132 42.447 42.447 43.201 -0.754 25324 8616 1 12 . 1 1 132 132 LEU H H 132 8.527 8.527 8.915 -0.388 25324 8617 1 13 . 1 1 3 3 LEU N N 3 123.202 123.202 122.121 1.081 25324 8618 1 13 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.003 0.154 25324 8619 1 13 . 1 1 3 3 LEU C C 3 175.786 175.786 175.240 0.546 25324 8620 1 13 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.243 0.041 25324 8621 1 13 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.103 0.227 25324 8622 1 13 . 1 1 3 3 LEU H H 3 8.711 8.711 8.635 0.076 25324 8623 1 13 . 1 1 4 4 TYR N N 4 120.906 120.906 125.087 -4.181 25324 8624 1 13 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.121 -0.097 25324 8625 1 13 . 1 1 4 4 TYR C C 4 175.953 175.953 175.002 0.951 25324 8626 1 13 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.494 -0.117 25324 8627 1 13 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.694 -1.039 25324 8628 1 13 . 1 1 4 4 TYR H H 4 9.142 9.142 9.196 -0.054 25324 8629 1 13 . 1 1 5 5 ASN N N 5 120.496 120.496 119.560 0.936 25324 8630 1 13 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.973 0.143 25324 8631 1 13 . 1 1 5 5 ASN C C 5 174.953 174.953 173.879 1.074 25324 8632 1 13 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.701 0.246 25324 8633 1 13 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.381 -1.490 25324 8634 1 13 . 1 1 5 5 ASN H H 5 8.787 8.787 9.020 -0.233 25324 8635 1 13 . 1 1 6 6 VAL N N 6 127.428 127.428 123.247 4.181 25324 8636 1 13 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.212 0.150 25324 8637 1 13 . 1 1 6 6 VAL C C 6 174.955 174.955 174.383 0.572 25324 8638 1 13 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.778 0.655 25324 8639 1 13 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.603 0.728 25324 8640 1 13 . 1 1 6 6 VAL H H 6 8.806 8.806 8.600 0.206 25324 8641 1 13 . 1 1 7 7 GLU N N 7 124.355 124.355 126.395 -2.040 25324 8642 1 13 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.892 0.090 25324 8643 1 13 . 1 1 7 7 GLU C C 7 174.551 174.551 174.917 -0.366 25324 8644 1 13 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.576 -0.787 25324 8645 1 13 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.037 1.530 25324 8646 1 13 . 1 1 7 7 GLU H H 7 8.800 8.800 8.828 -0.028 25324 8647 1 13 . 1 1 8 8 ASN N N 8 116.231 116.231 120.942 -4.711 25324 8648 1 13 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.897 0.144 25324 8649 1 13 . 1 1 8 8 ASN C C 8 172.709 172.709 173.667 -0.958 25324 8650 1 13 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.465 -0.848 25324 8651 1 13 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.347 2.238 25324 8652 1 13 . 1 1 8 8 ASN H H 8 9.320 9.320 9.177 0.143 25324 8653 1 13 . 1 1 9 9 GLN N N 9 120.762 120.762 122.188 -1.426 25324 8654 1 13 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.511 -0.337 25324 8655 1 13 . 1 1 9 9 GLN C C 9 173.454 173.454 174.237 -0.783 25324 8656 1 13 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.310 -0.350 25324 8657 1 13 . 1 1 9 9 GLN CB C 9 30.691 30.691 30.840 -0.149 25324 8658 1 13 . 1 1 9 9 GLN H H 9 6.887 6.887 8.742 -1.855 25324 8659 1 13 . 1 1 10 10 TRP N N 10 127.775 127.775 124.510 3.265 25324 8660 1 13 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.104 -0.116 25324 8661 1 13 . 1 1 10 10 TRP C C 10 175.281 175.281 175.532 -0.251 25324 8662 1 13 . 1 1 10 10 TRP CA C 10 56.293 56.293 55.920 0.373 25324 8663 1 13 . 1 1 10 10 TRP CB C 10 29.742 29.742 29.952 -0.210 25324 8664 1 13 . 1 1 10 10 TRP H H 10 8.518 8.518 8.037 0.481 25324 8665 1 13 . 1 1 11 11 GLY N N 11 107.838 107.838 109.197 -1.359 25324 8666 1 13 . 1 1 11 11 GLY C C 11 174.733 174.733 175.310 -0.577 25324 8667 1 13 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.643 0.193 25324 8668 1 13 . 1 1 11 11 GLY H H 11 8.461 8.461 7.924 0.537 25324 8669 1 13 . 1 1 12 12 GLY N N 12 109.696 109.696 108.165 1.531 25324 8670 1 13 . 1 1 12 12 GLY C C 12 174.133 174.133 174.704 -0.571 25324 8671 1 13 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.650 -0.861 25324 8672 1 13 . 1 1 12 12 GLY H H 12 8.138 8.138 7.891 0.247 25324 8673 1 13 . 1 1 13 13 SER N N 13 111.308 111.308 115.232 -3.924 25324 8674 1 13 . 1 1 13 13 SER HA H 13 4.092 4.092 4.086 0.006 25324 8675 1 13 . 1 1 13 13 SER C C 13 175.622 175.622 174.540 1.082 25324 8676 1 13 . 1 1 13 13 SER CA C 13 60.494 60.494 58.836 1.658 25324 8677 1 13 . 1 1 13 13 SER CB C 13 63.028 63.028 64.034 -1.006 25324 8678 1 13 . 1 1 13 13 SER H H 13 8.215 8.215 8.056 0.159 25324 8679 1 13 . 1 1 14 14 SER N N 14 115.290 115.290 113.196 2.094 25324 8680 1 13 . 1 1 14 14 SER HA H 14 4.566 4.566 4.093 0.473 25324 8681 1 13 . 1 1 14 14 SER C C 14 173.532 173.532 172.786 0.746 25324 8682 1 13 . 1 1 14 14 SER CA C 14 57.317 57.317 59.907 -2.590 25324 8683 1 13 . 1 1 14 14 SER CB C 14 63.230 63.230 62.491 0.739 25324 8684 1 13 . 1 1 14 14 SER H H 14 8.213 8.213 8.570 -0.357 25324 8685 1 13 . 1 1 15 15 ALA N N 15 126.470 126.470 123.159 3.311 25324 8686 1 13 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.500 -0.097 25324 8687 1 13 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.168 0.296 25324 8688 1 13 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.784 -0.555 25324 8689 1 13 . 1 1 15 15 ALA H H 15 7.308 7.308 7.437 -0.129 25324 8690 1 13 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.244 0.165 25324 8691 1 13 . 1 1 16 16 PRO C C 16 175.627 175.627 175.266 0.361 25324 8692 1 13 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.306 0.086 25324 8693 1 13 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.654 -0.516 25324 8694 1 13 . 1 1 17 17 TRP N N 17 120.228 120.228 118.989 1.239 25324 8695 1 13 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.524 -0.206 25324 8696 1 13 . 1 1 17 17 TRP C C 17 175.951 175.951 176.075 -0.124 25324 8697 1 13 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.818 0.097 25324 8698 1 13 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.418 -1.009 25324 8699 1 13 . 1 1 17 17 TRP H H 17 8.380 8.380 8.119 0.261 25324 8700 1 13 . 1 1 18 18 ASN N N 18 120.663 120.663 122.663 -2.000 25324 8701 1 13 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.001 0.085 25324 8702 1 13 . 1 1 18 18 ASN C C 18 174.793 174.793 174.707 0.086 25324 8703 1 13 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.556 -0.954 25324 8704 1 13 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.585 2.063 25324 8705 1 13 . 1 1 18 18 ASN H H 18 9.094 9.094 8.876 0.218 25324 8706 1 13 . 1 1 19 19 GLU N N 19 122.202 122.202 124.287 -2.085 25324 8707 1 13 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.782 -0.643 25324 8708 1 13 . 1 1 19 19 GLU C C 19 176.869 176.869 176.774 0.095 25324 8709 1 13 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.414 2.186 25324 8710 1 13 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.605 -0.223 25324 8711 1 13 . 1 1 19 19 GLU H H 19 9.013 9.013 8.967 0.046 25324 8712 1 13 . 1 1 20 20 GLY N N 20 112.893 112.893 112.661 0.232 25324 8713 1 13 . 1 1 20 20 GLY C C 20 174.878 174.878 173.166 1.712 25324 8714 1 13 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.939 0.056 25324 8715 1 13 . 1 1 20 20 GLY H H 20 8.926 8.926 8.465 0.461 25324 8716 1 13 . 1 1 21 21 GLY N N 21 110.354 110.354 107.288 3.066 25324 8717 1 13 . 1 1 21 21 GLY C C 21 171.623 171.623 171.956 -0.333 25324 8718 1 13 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.237 -0.839 25324 8719 1 13 . 1 1 21 21 GLY H H 21 8.258 8.258 7.580 0.678 25324 8720 1 13 . 1 1 22 22 GLN N N 22 117.541 117.541 117.670 -0.129 25324 8721 1 13 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.041 0.636 25324 8722 1 13 . 1 1 22 22 GLN C C 22 175.957 175.957 174.542 1.415 25324 8723 1 13 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.636 0.308 25324 8724 1 13 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.117 -1.032 25324 8725 1 13 . 1 1 22 22 GLN H H 22 8.564 8.564 8.578 -0.014 25324 8726 1 13 . 1 1 23 23 TRP N N 23 127.208 127.208 122.787 4.421 25324 8727 1 13 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.023 0.176 25324 8728 1 13 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.522 0.009 25324 8729 1 13 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.493 -0.810 25324 8730 1 13 . 1 1 23 23 TRP H H 23 9.347 9.347 8.803 0.544 25324 8731 1 13 . 1 1 24 24 GLU N N 24 123.504 123.504 121.274 2.230 25324 8732 1 13 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.346 0.162 25324 8733 1 13 . 1 1 24 24 GLU C C 24 174.222 174.222 175.338 -1.116 25324 8734 1 13 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.194 0.397 25324 8735 1 13 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.996 -1.381 25324 8736 1 13 . 1 1 24 24 GLU H H 24 9.296 9.296 8.473 0.823 25324 8737 1 13 . 1 1 25 25 ILE N N 25 123.447 123.447 126.326 -2.879 25324 8738 1 13 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.134 0.302 25324 8739 1 13 . 1 1 25 25 ILE C C 25 175.790 175.790 174.816 0.974 25324 8740 1 13 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.804 -0.178 25324 8741 1 13 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.636 0.316 25324 8742 1 13 . 1 1 25 25 ILE H H 25 8.635 8.635 8.288 0.347 25324 8743 1 13 . 1 1 26 26 GLY N N 26 111.544 111.544 113.651 -2.107 25324 8744 1 13 . 1 1 26 26 GLY C C 26 172.122 172.122 175.346 -3.224 25324 8745 1 13 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.987 -0.909 25324 8746 1 13 . 1 1 26 26 GLY H H 26 3.381 3.381 7.831 -4.450 25324 8747 1 13 . 1 1 27 27 SER N N 27 112.279 112.279 115.921 -3.642 25324 8748 1 13 . 1 1 27 27 SER HA H 27 4.876 4.876 4.372 0.504 25324 8749 1 13 . 1 1 27 27 SER C C 27 174.113 174.113 175.366 -1.253 25324 8750 1 13 . 1 1 27 27 SER CA C 27 56.954 56.954 61.448 -4.494 25324 8751 1 13 . 1 1 27 27 SER CB C 27 64.554 64.554 63.830 0.724 25324 8752 1 13 . 1 1 27 27 SER H H 27 8.212 8.212 9.028 -0.816 25324 8753 1 13 . 1 1 28 28 ARG N N 28 120.872 120.872 121.658 -0.786 25324 8754 1 13 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.535 0.228 25324 8755 1 13 . 1 1 28 28 ARG C C 28 176.119 176.119 176.225 -0.106 25324 8756 1 13 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.885 -0.768 25324 8757 1 13 . 1 1 28 28 ARG CB C 28 31.830 31.830 31.195 0.635 25324 8758 1 13 . 1 1 28 28 ARG H H 28 7.849 7.849 8.502 -0.652 25324 8759 1 13 . 1 1 29 29 SER N N 29 118.985 118.985 119.001 -0.016 25324 8760 1 13 . 1 1 29 29 SER HA H 29 4.192 4.192 4.426 -0.234 25324 8761 1 13 . 1 1 29 29 SER C C 29 174.622 174.622 174.965 -0.343 25324 8762 1 13 . 1 1 29 29 SER CA C 29 60.072 60.072 59.487 0.585 25324 8763 1 13 . 1 1 29 29 SER CB C 29 62.876 62.876 63.491 -0.615 25324 8764 1 13 . 1 1 29 29 SER H H 29 8.892 8.892 8.879 0.013 25324 8765 1 13 . 1 1 30 30 ASP N N 30 117.632 117.632 120.684 -3.052 25324 8766 1 13 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.614 0.004 25324 8767 1 13 . 1 1 30 30 ASP C C 30 175.101 175.101 176.417 -1.316 25324 8768 1 13 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.585 -2.533 25324 8769 1 13 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.084 -0.561 25324 8770 1 13 . 1 1 30 30 ASP H H 30 8.441 8.441 8.275 0.166 25324 8771 1 13 . 1 1 31 31 GLN N N 31 118.273 118.273 118.309 -0.036 25324 8772 1 13 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.607 -0.122 25324 8773 1 13 . 1 1 31 31 GLN C C 31 173.453 173.453 174.647 -1.194 25324 8774 1 13 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.836 0.032 25324 8775 1 13 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.406 2.843 25324 8776 1 13 . 1 1 31 31 GLN H H 31 7.029 7.029 8.016 -0.987 25324 8777 1 13 . 1 1 32 32 ASN N N 32 120.865 120.865 120.773 0.092 25324 8778 1 13 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.141 -0.021 25324 8779 1 13 . 1 1 32 32 ASN C C 32 175.198 175.198 174.190 1.008 25324 8780 1 13 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.004 -0.135 25324 8781 1 13 . 1 1 32 32 ASN CB C 32 39.630 39.630 41.037 -1.407 25324 8782 1 13 . 1 1 32 32 ASN H H 32 8.713 8.713 8.763 -0.050 25324 8783 1 13 . 1 1 33 33 VAL N N 33 122.111 122.111 118.799 3.312 25324 8784 1 13 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.059 -0.354 25324 8785 1 13 . 1 1 33 33 VAL C C 33 174.950 174.950 176.043 -1.093 25324 8786 1 13 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.606 1.241 25324 8787 1 13 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.342 0.008 25324 8788 1 13 . 1 1 33 33 VAL H H 33 8.542 8.542 8.666 -0.124 25324 8789 1 13 . 1 1 34 34 VAL N N 34 113.282 113.282 119.964 -6.682 25324 8790 1 13 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.839 -0.194 25324 8791 1 13 . 1 1 34 34 VAL C C 34 175.574 175.574 174.734 0.840 25324 8792 1 13 . 1 1 34 34 VAL CA C 34 59.974 59.974 60.753 -0.779 25324 8793 1 13 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.890 -0.861 25324 8794 1 13 . 1 1 34 34 VAL H H 34 8.744 8.744 8.792 -0.048 25324 8795 1 13 . 1 1 35 35 ALA N N 35 122.102 122.102 121.005 1.097 25324 8796 1 13 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.187 -0.384 25324 8797 1 13 . 1 1 35 35 ALA C C 35 175.947 175.947 175.033 0.914 25324 8798 1 13 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.983 2.267 25324 8799 1 13 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.259 -0.631 25324 8800 1 13 . 1 1 35 35 ALA H H 35 7.677 7.677 7.761 -0.084 25324 8801 1 13 . 1 1 36 36 ILE N N 36 118.005 118.005 121.770 -3.765 25324 8802 1 13 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.331 -0.303 25324 8803 1 13 . 1 1 36 36 ILE C C 36 173.116 173.116 173.916 -0.800 25324 8804 1 13 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.078 1.104 25324 8805 1 13 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.404 1.081 25324 8806 1 13 . 1 1 36 36 ILE H H 36 8.126 8.126 8.665 -0.539 25324 8807 1 13 . 1 1 37 37 ASN N N 37 125.632 125.632 126.530 -0.898 25324 8808 1 13 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.983 -0.302 25324 8809 1 13 . 1 1 37 37 ASN C C 37 174.854 174.854 173.776 1.078 25324 8810 1 13 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.253 0.277 25324 8811 1 13 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.651 -2.798 25324 8812 1 13 . 1 1 37 37 ASN H H 37 8.577 8.577 8.745 -0.168 25324 8813 1 13 . 1 1 38 38 VAL N N 38 114.223 114.223 118.976 -4.753 25324 8814 1 13 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.854 0.349 25324 8815 1 13 . 1 1 38 38 VAL C C 38 174.854 174.854 173.386 1.468 25324 8816 1 13 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.079 -2.099 25324 8817 1 13 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.784 0.260 25324 8818 1 13 . 1 1 38 38 VAL H H 38 8.874 8.874 8.683 0.191 25324 8819 1 13 . 1 1 39 39 GLU N N 39 118.277 118.277 121.830 -3.553 25324 8820 1 13 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.253 -0.171 25324 8821 1 13 . 1 1 39 39 GLU C C 39 174.548 174.548 175.344 -0.796 25324 8822 1 13 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.954 1.039 25324 8823 1 13 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.364 -0.786 25324 8824 1 13 . 1 1 39 39 GLU H H 39 8.761 8.761 9.232 -0.471 25324 8825 1 13 . 1 1 40 40 SER N N 40 114.960 114.960 119.934 -4.974 25324 8826 1 13 . 1 1 40 40 SER HA H 40 5.265 5.265 4.808 0.457 25324 8827 1 13 . 1 1 40 40 SER C C 40 175.783 175.783 175.104 0.679 25324 8828 1 13 . 1 1 40 40 SER CA C 40 55.880 55.880 57.989 -2.109 25324 8829 1 13 . 1 1 40 40 SER CB C 40 65.911 65.911 63.502 2.409 25324 8830 1 13 . 1 1 40 40 SER H H 40 8.500 8.500 8.371 0.129 25324 8831 1 13 . 1 1 41 41 GLY N N 41 117.567 117.567 112.421 5.146 25324 8832 1 13 . 1 1 41 41 GLY C C 41 174.119 174.119 174.850 -0.731 25324 8833 1 13 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.431 -0.743 25324 8834 1 13 . 1 1 41 41 GLY H H 41 9.533 9.533 8.667 0.866 25324 8835 1 13 . 1 1 42 42 ASP N N 42 122.141 122.141 121.029 1.112 25324 8836 1 13 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.818 -0.018 25324 8837 1 13 . 1 1 42 42 ASP C C 42 176.121 176.121 177.457 -1.336 25324 8838 1 13 . 1 1 42 42 ASP CA C 42 52.146 52.146 54.064 -1.918 25324 8839 1 13 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.032 -2.679 25324 8840 1 13 . 1 1 42 42 ASP H H 42 8.644 8.644 8.233 0.411 25324 8841 1 13 . 1 1 43 43 ASP N N 43 116.025 116.025 119.589 -3.564 25324 8842 1 13 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.492 -0.263 25324 8843 1 13 . 1 1 43 43 ASP C C 43 176.018 176.018 176.609 -0.591 25324 8844 1 13 . 1 1 43 43 ASP CA C 43 55.249 55.249 53.938 1.311 25324 8845 1 13 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.416 0.143 25324 8846 1 13 . 1 1 43 43 ASP H H 43 9.111 9.111 8.686 0.425 25324 8847 1 13 . 1 1 44 44 GLY N N 44 104.263 104.263 108.478 -4.215 25324 8848 1 13 . 1 1 44 44 GLY C C 44 173.922 173.922 175.440 -1.518 25324 8849 1 13 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.291 0.010 25324 8850 1 13 . 1 1 44 44 GLY H H 44 9.063 9.063 8.003 1.060 25324 8851 1 13 . 1 1 45 45 GLN N N 45 121.691 121.691 118.939 2.752 25324 8852 1 13 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.184 -0.098 25324 8853 1 13 . 1 1 45 45 GLN C C 45 176.284 176.284 175.540 0.744 25324 8854 1 13 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.449 -0.331 25324 8855 1 13 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.610 -1.936 25324 8856 1 13 . 1 1 45 45 GLN H H 45 7.356 7.356 8.340 -0.984 25324 8857 1 13 . 1 1 46 46 THR N N 46 111.843 111.843 107.864 3.979 25324 8858 1 13 . 1 1 46 46 THR HA H 46 5.355 5.355 5.323 0.032 25324 8859 1 13 . 1 1 46 46 THR C C 46 174.451 174.451 173.279 1.172 25324 8860 1 13 . 1 1 46 46 THR CA C 46 59.644 59.644 59.417 0.227 25324 8861 1 13 . 1 1 46 46 THR CB C 46 72.714 72.714 71.414 1.300 25324 8862 1 13 . 1 1 46 46 THR H H 46 10.123 10.123 7.457 2.666 25324 8863 1 13 . 1 1 47 47 LEU N N 47 119.302 119.302 125.034 -5.732 25324 8864 1 13 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.764 0.043 25324 8865 1 13 . 1 1 47 47 LEU C C 47 175.487 175.487 174.864 0.623 25324 8866 1 13 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.674 -0.604 25324 8867 1 13 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.540 3.463 25324 8868 1 13 . 1 1 47 47 LEU H H 47 8.364 8.364 8.686 -0.322 25324 8869 1 13 . 1 1 48 48 ASN N N 48 116.844 116.844 120.487 -3.643 25324 8870 1 13 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.017 -0.288 25324 8871 1 13 . 1 1 48 48 ASN C C 48 174.460 174.460 174.807 -0.347 25324 8872 1 13 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.853 0.886 25324 8873 1 13 . 1 1 48 48 ASN CB C 48 43.413 43.413 43.169 0.244 25324 8874 1 13 . 1 1 48 48 ASN H H 48 8.748 8.748 8.838 -0.090 25324 8875 1 13 . 1 1 49 49 GLY N N 49 109.417 109.417 109.160 0.257 25324 8876 1 13 . 1 1 49 49 GLY C C 49 172.126 172.126 172.118 0.008 25324 8877 1 13 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.162 0.329 25324 8878 1 13 . 1 1 49 49 GLY H H 49 8.744 8.744 9.051 -0.307 25324 8879 1 13 . 1 1 50 50 THR N N 50 119.162 119.162 117.430 1.732 25324 8880 1 13 . 1 1 50 50 THR HA H 50 5.556 5.556 5.446 0.110 25324 8881 1 13 . 1 1 50 50 THR C C 50 171.790 171.790 173.269 -1.479 25324 8882 1 13 . 1 1 50 50 THR CA C 50 59.371 59.371 61.731 -2.360 25324 8883 1 13 . 1 1 50 50 THR CB C 50 72.799 72.799 71.933 0.866 25324 8884 1 13 . 1 1 50 50 THR H H 50 8.799 8.799 8.931 -0.132 25324 8885 1 13 . 1 1 51 51 MET N N 51 115.232 115.232 125.398 -10.166 25324 8886 1 13 . 1 1 51 51 MET HA H 51 4.886 4.886 4.997 -0.111 25324 8887 1 13 . 1 1 51 51 MET C C 51 172.708 172.708 174.609 -1.901 25324 8888 1 13 . 1 1 51 51 MET CA C 51 54.722 54.722 54.612 0.110 25324 8889 1 13 . 1 1 51 51 MET CB C 51 34.557 34.557 37.228 -2.671 25324 8890 1 13 . 1 1 51 51 MET H H 51 9.062 9.062 9.148 -0.086 25324 8891 1 13 . 1 1 52 52 THR N N 52 113.697 113.697 118.410 -4.713 25324 8892 1 13 . 1 1 52 52 THR HA H 52 4.682 4.682 4.924 -0.242 25324 8893 1 13 . 1 1 52 52 THR C C 52 173.952 173.952 173.627 0.325 25324 8894 1 13 . 1 1 52 52 THR CA C 52 61.395 61.395 61.295 0.100 25324 8895 1 13 . 1 1 52 52 THR CB C 52 71.734 71.734 70.567 1.167 25324 8896 1 13 . 1 1 52 52 THR H H 52 8.685 8.685 8.660 0.025 25324 8897 1 13 . 1 1 53 53 TYR N N 53 129.086 129.086 125.630 3.456 25324 8898 1 13 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.899 -0.099 25324 8899 1 13 . 1 1 53 53 TYR C C 53 175.214 175.214 176.419 -1.205 25324 8900 1 13 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.618 1.263 25324 8901 1 13 . 1 1 53 53 TYR CB C 53 40.512 40.512 40.305 0.207 25324 8902 1 13 . 1 1 53 53 TYR H H 53 10.112 10.112 8.989 1.123 25324 8903 1 13 . 1 1 54 54 ALA N N 54 119.947 119.947 124.039 -4.092 25324 8904 1 13 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.259 -0.257 25324 8905 1 13 . 1 1 54 54 ALA C C 54 178.285 178.285 177.615 0.670 25324 8906 1 13 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.240 0.731 25324 8907 1 13 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.355 1.363 25324 8908 1 13 . 1 1 54 54 ALA H H 54 8.704 8.704 8.639 0.065 25324 8909 1 13 . 1 1 55 55 GLY N N 55 110.940 110.940 112.273 -1.333 25324 8910 1 13 . 1 1 55 55 GLY C C 55 173.903 173.903 174.247 -0.344 25324 8911 1 13 . 1 1 55 55 GLY CA C 55 45.016 45.016 44.926 0.090 25324 8912 1 13 . 1 1 55 55 GLY H H 55 8.745 8.745 8.206 0.539 25324 8913 1 13 . 1 1 56 56 GLU N N 56 120.073 120.073 120.503 -0.430 25324 8914 1 13 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.646 0.063 25324 8915 1 13 . 1 1 56 56 GLU C C 56 175.906 175.906 176.137 -0.231 25324 8916 1 13 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.199 -0.776 25324 8917 1 13 . 1 1 56 56 GLU CB C 56 32.824 32.824 31.869 0.955 25324 8918 1 13 . 1 1 56 56 GLU H H 56 8.039 8.039 7.873 0.166 25324 8919 1 13 . 1 1 57 57 GLY N N 57 105.298 105.298 108.717 -3.419 25324 8920 1 13 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.643 0.159 25324 8921 1 13 . 1 1 57 57 GLY H H 57 7.937 7.937 8.365 -0.428 25324 8922 1 13 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.764 0.170 25324 8923 1 13 . 1 1 58 58 PRO C C 58 177.785 177.785 176.515 1.270 25324 8924 1 13 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.306 -0.174 25324 8925 1 13 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.197 -0.357 25324 8926 1 13 . 1 1 59 59 ILE N N 59 117.386 117.386 118.604 -1.218 25324 8927 1 13 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.673 0.315 25324 8928 1 13 . 1 1 59 59 ILE C C 59 175.688 175.688 175.106 0.582 25324 8929 1 13 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.125 0.418 25324 8930 1 13 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.528 0.760 25324 8931 1 13 . 1 1 59 59 ILE H H 59 9.600 9.600 8.964 0.636 25324 8932 1 13 . 1 1 60 60 GLY N N 60 107.164 107.164 107.733 -0.569 25324 8933 1 13 . 1 1 60 60 GLY C C 60 173.787 173.787 172.608 1.179 25324 8934 1 13 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.488 1.747 25324 8935 1 13 . 1 1 60 60 GLY H H 60 8.957 8.957 8.508 0.449 25324 8936 1 13 . 1 1 61 61 PHE N N 61 124.597 124.597 125.864 -1.267 25324 8937 1 13 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.746 -0.523 25324 8938 1 13 . 1 1 61 61 PHE C C 61 173.126 173.126 173.400 -0.274 25324 8939 1 13 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.124 0.737 25324 8940 1 13 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.318 -0.101 25324 8941 1 13 . 1 1 61 61 PHE H H 61 8.788 8.788 9.174 -0.386 25324 8942 1 13 . 1 1 62 62 ARG N N 62 129.706 129.706 127.671 2.035 25324 8943 1 13 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.160 -0.028 25324 8944 1 13 . 1 1 62 62 ARG C C 62 172.456 172.456 172.864 -0.408 25324 8945 1 13 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.669 1.285 25324 8946 1 13 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.149 -1.279 25324 8947 1 13 . 1 1 62 62 ARG H H 62 8.405 8.405 8.455 -0.050 25324 8948 1 13 . 1 1 63 63 ALA N N 63 122.744 122.744 128.644 -5.900 25324 8949 1 13 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.390 -0.045 25324 8950 1 13 . 1 1 63 63 ALA C C 63 176.120 176.120 175.497 0.623 25324 8951 1 13 . 1 1 63 63 ALA CA C 63 49.919 49.919 49.958 -0.039 25324 8952 1 13 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.896 1.877 25324 8953 1 13 . 1 1 63 63 ALA H H 63 8.628 8.628 8.619 0.009 25324 8954 1 13 . 1 1 64 64 THR N N 64 116.855 116.855 117.769 -0.914 25324 8955 1 13 . 1 1 64 64 THR HA H 64 4.848 4.848 5.360 -0.512 25324 8956 1 13 . 1 1 64 64 THR C C 64 172.957 172.957 175.713 -2.756 25324 8957 1 13 . 1 1 64 64 THR CA C 64 61.211 61.211 60.813 0.398 25324 8958 1 13 . 1 1 64 64 THR CB C 64 71.064 71.064 71.758 -0.694 25324 8959 1 13 . 1 1 64 64 THR H H 64 8.315 8.315 8.363 -0.048 25324 8960 1 13 . 1 1 65 65 LEU N N 65 129.360 129.360 130.195 -0.835 25324 8961 1 13 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.727 -0.365 25324 8962 1 13 . 1 1 65 65 LEU C C 65 176.459 176.459 178.202 -1.743 25324 8963 1 13 . 1 1 65 65 LEU CA C 65 55.687 55.687 58.306 -2.619 25324 8964 1 13 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.238 -0.527 25324 8965 1 13 . 1 1 65 65 LEU H H 65 8.877 8.877 8.919 -0.042 25324 8966 1 13 . 1 1 66 66 LEU N N 66 128.683 128.683 114.828 13.855 25324 8967 1 13 . 1 1 66 66 LEU HA H 66 4.376 4.376 3.878 0.498 25324 8968 1 13 . 1 1 66 66 LEU C C 66 177.621 177.621 176.574 1.047 25324 8969 1 13 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.761 -2.061 25324 8970 1 13 . 1 1 66 66 LEU CB C 66 42.302 42.302 39.971 2.331 25324 8971 1 13 . 1 1 66 66 LEU H H 66 9.320 9.320 8.226 1.093 25324 8972 1 13 . 1 1 67 67 GLY N N 67 105.361 105.361 108.280 -2.919 25324 8973 1 13 . 1 1 67 67 GLY C C 67 173.618 173.618 172.584 1.034 25324 8974 1 13 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.480 -2.113 25324 8975 1 13 . 1 1 67 67 GLY H H 67 6.639 6.639 8.415 -1.776 25324 8976 1 13 . 1 1 68 68 ASN N N 68 121.848 121.848 118.295 3.553 25324 8977 1 13 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.583 -0.252 25324 8978 1 13 . 1 1 68 68 ASN C C 68 174.316 174.316 173.914 0.402 25324 8979 1 13 . 1 1 68 68 ASN CA C 68 54.552 54.552 52.942 1.610 25324 8980 1 13 . 1 1 68 68 ASN CB C 68 37.165 37.165 40.754 -3.589 25324 8981 1 13 . 1 1 68 68 ASN H H 68 9.236 9.236 7.556 1.680 25324 8982 1 13 . 1 1 69 69 ASN N N 69 109.509 109.509 116.027 -6.518 25324 8983 1 13 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.304 -0.224 25324 8984 1 13 . 1 1 69 69 ASN C C 69 171.456 171.456 173.588 -2.132 25324 8985 1 13 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.773 0.977 25324 8986 1 13 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.831 -0.525 25324 8987 1 13 . 1 1 69 69 ASN H H 69 8.651 8.651 9.344 -0.693 25324 8988 1 13 . 1 1 70 70 SER N N 70 113.479 113.479 112.138 1.341 25324 8989 1 13 . 1 1 70 70 SER HA H 70 5.437 5.437 5.305 0.132 25324 8990 1 13 . 1 1 70 70 SER C C 70 173.750 173.750 172.598 1.152 25324 8991 1 13 . 1 1 70 70 SER CA C 70 57.139 57.139 57.542 -0.403 25324 8992 1 13 . 1 1 70 70 SER CB C 70 63.818 63.818 67.414 -3.596 25324 8993 1 13 . 1 1 70 70 SER H H 70 7.693 7.693 7.268 0.425 25324 8994 1 13 . 1 1 71 71 TYR N N 71 123.132 123.132 119.232 3.900 25324 8995 1 13 . 1 1 71 71 TYR HA H 71 5.143 5.143 4.927 0.216 25324 8996 1 13 . 1 1 71 71 TYR CA C 71 56.648 56.648 57.375 -0.727 25324 8997 1 13 . 1 1 71 71 TYR CB C 71 42.445 42.445 43.004 -0.559 25324 8998 1 13 . 1 1 71 71 TYR H H 71 9.326 9.326 9.433 -0.107 25324 8999 1 13 . 1 1 72 72 GLU N N 72 122.396 122.396 123.959 -1.563 25324 9000 1 13 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.724 0.082 25324 9001 1 13 . 1 1 72 72 GLU C C 72 175.698 175.698 175.193 0.505 25324 9002 1 13 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.823 -0.656 25324 9003 1 13 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.664 -1.480 25324 9004 1 13 . 1 1 72 72 GLU H H 72 8.624 8.624 9.017 -0.393 25324 9005 1 13 . 1 1 73 73 VAL N N 73 128.513 128.513 127.839 0.674 25324 9006 1 13 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.264 -0.065 25324 9007 1 13 . 1 1 73 73 VAL C C 73 175.369 175.369 174.625 0.744 25324 9008 1 13 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.645 -0.165 25324 9009 1 13 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.042 0.291 25324 9010 1 13 . 1 1 73 73 VAL H H 73 8.564 8.564 9.155 -0.591 25324 9011 1 13 . 1 1 74 74 GLU N N 74 124.842 124.842 127.223 -2.381 25324 9012 1 13 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.036 0.051 25324 9013 1 13 . 1 1 74 74 GLU C C 74 174.415 174.415 174.900 -0.485 25324 9014 1 13 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.781 -0.444 25324 9015 1 13 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.123 2.034 25324 9016 1 13 . 1 1 74 74 GLU H H 74 9.011 9.011 9.044 -0.033 25324 9017 1 13 . 1 1 75 75 ASN N N 75 116.136 116.136 122.268 -6.132 25324 9018 1 13 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.647 0.492 25324 9019 1 13 . 1 1 75 75 ASN C C 75 172.703 172.703 173.777 -1.074 25324 9020 1 13 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.728 0.097 25324 9021 1 13 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.427 3.469 25324 9022 1 13 . 1 1 75 75 ASN H H 75 9.424 9.424 9.132 0.292 25324 9023 1 13 . 1 1 76 76 GLN N N 76 120.762 120.762 121.565 -0.803 25324 9024 1 13 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.320 -0.280 25324 9025 1 13 . 1 1 76 76 GLN C C 76 173.113 173.113 173.902 -0.789 25324 9026 1 13 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.421 -0.198 25324 9027 1 13 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.113 -0.764 25324 9028 1 13 . 1 1 76 76 GLN H H 76 7.106 7.106 8.843 -1.737 25324 9029 1 13 . 1 1 77 77 TRP N N 77 125.598 125.598 125.024 0.574 25324 9030 1 13 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.107 0.045 25324 9031 1 13 . 1 1 77 77 TRP C C 77 175.502 175.502 175.501 0.001 25324 9032 1 13 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.731 -0.967 25324 9033 1 13 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.796 -0.797 25324 9034 1 13 . 1 1 77 77 TRP H H 77 8.181 8.181 8.176 0.005 25324 9035 1 13 . 1 1 78 78 GLY N N 78 107.901 107.901 108.781 -0.880 25324 9036 1 13 . 1 1 78 78 GLY C C 78 174.611 174.611 174.523 0.088 25324 9037 1 13 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.930 -0.028 25324 9038 1 13 . 1 1 78 78 GLY H H 78 8.778 8.778 8.789 -0.011 25324 9039 1 13 . 1 1 79 79 GLY N N 79 109.844 109.844 107.244 2.600 25324 9040 1 13 . 1 1 79 79 GLY C C 79 173.782 173.782 173.951 -0.169 25324 9041 1 13 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.462 -0.669 25324 9042 1 13 . 1 1 79 79 GLY H H 79 8.198 8.198 7.346 0.852 25324 9043 1 13 . 1 1 80 80 ASP N N 80 115.837 115.837 117.389 -1.552 25324 9044 1 13 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.314 -0.073 25324 9045 1 13 . 1 1 80 80 ASP C C 80 177.285 177.285 176.574 0.711 25324 9046 1 13 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.828 0.355 25324 9047 1 13 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.688 -0.165 25324 9048 1 13 . 1 1 80 80 ASP H H 80 8.132 8.132 8.624 -0.492 25324 9049 1 13 . 1 1 81 81 SER N N 81 112.690 112.690 115.287 -2.597 25324 9050 1 13 . 1 1 81 81 SER HA H 81 4.513 4.513 4.345 0.168 25324 9051 1 13 . 1 1 81 81 SER C C 81 173.684 173.684 174.341 -0.657 25324 9052 1 13 . 1 1 81 81 SER CA C 81 57.232 57.232 58.268 -1.036 25324 9053 1 13 . 1 1 81 81 SER CB C 81 63.170 63.170 63.231 -0.061 25324 9054 1 13 . 1 1 81 81 SER H H 81 8.179 8.179 8.054 0.125 25324 9055 1 13 . 1 1 82 82 ALA N N 82 126.310 126.310 125.692 0.618 25324 9056 1 13 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.476 -0.073 25324 9057 1 13 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.850 0.616 25324 9058 1 13 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.690 -0.492 25324 9059 1 13 . 1 1 82 82 ALA H H 82 7.274 7.274 7.184 0.090 25324 9060 1 13 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.192 0.181 25324 9061 1 13 . 1 1 83 83 PRO C C 83 175.378 175.378 175.225 0.153 25324 9062 1 13 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.129 0.198 25324 9063 1 13 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.524 -0.360 25324 9064 1 13 . 1 1 84 84 TRP N N 84 120.106 120.106 116.606 3.500 25324 9065 1 13 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.417 -0.146 25324 9066 1 13 . 1 1 84 84 TRP C C 84 176.358 176.358 175.926 0.432 25324 9067 1 13 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.663 0.283 25324 9068 1 13 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.971 -1.255 25324 9069 1 13 . 1 1 84 84 TRP H H 84 8.329 8.329 7.953 0.376 25324 9070 1 13 . 1 1 85 85 HIS N N 85 118.543 118.543 120.298 -1.755 25324 9071 1 13 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.914 0.004 25324 9072 1 13 . 1 1 85 85 HIS C C 85 174.950 174.950 174.596 0.354 25324 9073 1 13 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.970 -1.501 25324 9074 1 13 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.288 -1.615 25324 9075 1 13 . 1 1 85 85 HIS H H 85 9.204 9.204 8.983 0.221 25324 9076 1 13 . 1 1 86 86 SER N N 86 117.803 117.803 116.925 0.878 25324 9077 1 13 . 1 1 86 86 SER HA H 86 4.412 4.412 4.139 0.273 25324 9078 1 13 . 1 1 86 86 SER C C 86 175.691 175.691 174.880 0.811 25324 9079 1 13 . 1 1 86 86 SER CA C 86 60.257 60.257 59.134 1.123 25324 9080 1 13 . 1 1 86 86 SER CB C 86 63.015 63.015 63.703 -0.688 25324 9081 1 13 . 1 1 86 86 SER H H 86 9.168 9.168 8.954 0.214 25324 9082 1 13 . 1 1 87 87 GLY N N 87 115.773 115.773 113.086 2.687 25324 9083 1 13 . 1 1 87 87 GLY C C 87 174.288 174.288 173.824 0.464 25324 9084 1 13 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.004 -0.303 25324 9085 1 13 . 1 1 87 87 GLY H H 87 9.284 9.284 8.966 0.318 25324 9086 1 13 . 1 1 88 88 GLY N N 88 109.162 109.162 108.945 0.217 25324 9087 1 13 . 1 1 88 88 GLY C C 88 171.120 171.120 171.749 -0.629 25324 9088 1 13 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.109 -0.515 25324 9089 1 13 . 1 1 88 88 GLY H H 88 8.054 8.054 7.888 0.166 25324 9090 1 13 . 1 1 89 89 ASN N N 89 117.048 117.048 119.208 -2.160 25324 9091 1 13 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.388 0.650 25324 9092 1 13 . 1 1 89 89 ASN C C 89 175.287 175.287 175.036 0.251 25324 9093 1 13 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.656 -0.791 25324 9094 1 13 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.441 -0.836 25324 9095 1 13 . 1 1 89 89 ASN H H 89 8.516 8.516 8.759 -0.243 25324 9096 1 13 . 1 1 90 90 TRP N N 90 125.844 125.844 126.452 -0.608 25324 9097 1 13 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.079 0.174 25324 9098 1 13 . 1 1 90 90 TRP C C 90 175.278 175.278 175.721 -0.443 25324 9099 1 13 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.103 0.165 25324 9100 1 13 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.120 0.838 25324 9101 1 13 . 1 1 90 90 TRP H H 90 9.282 9.282 9.320 -0.038 25324 9102 1 13 . 1 1 91 91 ILE N N 91 123.134 123.134 121.533 1.601 25324 9103 1 13 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.575 0.871 25324 9104 1 13 . 1 1 91 91 ILE C C 91 175.489 175.489 175.112 0.377 25324 9105 1 13 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.843 -0.017 25324 9106 1 13 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.769 0.907 25324 9107 1 13 . 1 1 91 91 ILE H H 91 9.318 9.318 8.566 0.752 25324 9108 1 13 . 1 1 92 92 LEU N N 92 123.452 123.452 128.697 -5.245 25324 9109 1 13 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.524 0.418 25324 9110 1 13 . 1 1 92 92 LEU C C 92 173.620 173.620 174.228 -0.608 25324 9111 1 13 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.667 -1.411 25324 9112 1 13 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.560 0.948 25324 9113 1 13 . 1 1 92 92 LEU H H 92 8.463 8.463 8.443 0.020 25324 9114 1 13 . 1 1 93 93 GLY N N 93 103.987 103.987 107.906 -3.919 25324 9115 1 13 . 1 1 93 93 GLY C C 93 172.284 172.284 174.207 -1.923 25324 9116 1 13 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.551 -2.051 25324 9117 1 13 . 1 1 93 93 GLY H H 93 2.937 2.937 6.787 -3.850 25324 9118 1 13 . 1 1 94 94 SER N N 94 110.274 110.274 117.963 -7.689 25324 9119 1 13 . 1 1 94 94 SER HA H 94 4.711 4.711 4.864 -0.153 25324 9120 1 13 . 1 1 94 94 SER C C 94 174.784 174.784 175.208 -0.424 25324 9121 1 13 . 1 1 94 94 SER CA C 94 56.555 56.555 59.070 -2.515 25324 9122 1 13 . 1 1 94 94 SER CB C 94 65.051 65.051 64.645 0.406 25324 9123 1 13 . 1 1 94 94 SER H H 94 7.919 7.919 9.740 -1.821 25324 9124 1 13 . 1 1 95 95 ARG N N 95 123.020 123.020 122.169 0.851 25324 9125 1 13 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.433 0.239 25324 9126 1 13 . 1 1 95 95 ARG C C 95 176.120 176.120 177.299 -1.179 25324 9127 1 13 . 1 1 95 95 ARG CA C 95 55.374 55.374 54.912 0.462 25324 9128 1 13 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.893 -0.045 25324 9129 1 13 . 1 1 95 95 ARG H H 95 9.148 9.148 7.600 1.548 25324 9130 1 13 . 1 1 96 96 GLU N N 96 120.357 120.357 124.640 -4.283 25324 9131 1 13 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.088 0.194 25324 9132 1 13 . 1 1 96 96 GLU C C 96 176.278 176.278 176.163 0.115 25324 9133 1 13 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.700 -2.170 25324 9134 1 13 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.457 0.696 25324 9135 1 13 . 1 1 96 96 GLU H H 96 8.610 8.610 8.862 -0.252 25324 9136 1 13 . 1 1 97 97 ASN N N 97 117.678 117.678 115.803 1.875 25324 9137 1 13 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.771 -0.159 25324 9138 1 13 . 1 1 97 97 ASN C C 97 173.949 173.949 173.888 0.061 25324 9139 1 13 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.283 0.732 25324 9140 1 13 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.377 -0.211 25324 9141 1 13 . 1 1 97 97 ASN H H 97 8.533 8.533 8.124 0.409 25324 9142 1 13 . 1 1 98 98 GLN N N 98 118.592 118.592 119.399 -0.807 25324 9143 1 13 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.393 -0.033 25324 9144 1 13 . 1 1 98 98 GLN C C 98 173.116 173.116 173.874 -0.758 25324 9145 1 13 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.453 0.175 25324 9146 1 13 . 1 1 98 98 GLN CB C 98 30.869 30.869 32.266 -1.397 25324 9147 1 13 . 1 1 98 98 GLN H H 98 7.663 7.663 7.306 0.357 25324 9148 1 13 . 1 1 99 99 ASN N N 99 122.855 122.855 120.668 2.187 25324 9149 1 13 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.412 -0.277 25324 9150 1 13 . 1 1 99 99 ASN C C 99 175.287 175.287 175.756 -0.469 25324 9151 1 13 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.150 0.840 25324 9152 1 13 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.304 0.187 25324 9153 1 13 . 1 1 99 99 ASN H H 99 8.759 8.759 8.592 0.167 25324 9154 1 13 . 1 1 100 100 VAL N N 100 121.385 121.385 120.406 0.979 25324 9155 1 13 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.791 -0.043 25324 9156 1 13 . 1 1 100 100 VAL C C 100 174.956 174.956 176.783 -1.827 25324 9157 1 13 . 1 1 100 100 VAL CA C 100 63.843 63.843 64.649 -0.806 25324 9158 1 13 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.535 0.908 25324 9159 1 13 . 1 1 100 100 VAL H H 100 8.717 8.717 8.230 0.487 25324 9160 1 13 . 1 1 101 101 VAL N N 101 112.736 112.736 123.154 -10.418 25324 9161 1 13 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.456 0.189 25324 9162 1 13 . 1 1 101 101 VAL C C 101 175.577 175.577 174.353 1.224 25324 9163 1 13 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.494 -1.531 25324 9164 1 13 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.805 -0.764 25324 9165 1 13 . 1 1 101 101 VAL H H 101 8.802 8.802 8.936 -0.134 25324 9166 1 13 . 1 1 102 102 ALA N N 102 122.104 122.104 120.699 1.405 25324 9167 1 13 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.069 -0.262 25324 9168 1 13 . 1 1 102 102 ALA C C 102 176.046 176.046 174.936 1.110 25324 9169 1 13 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.979 2.275 25324 9170 1 13 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.323 -0.698 25324 9171 1 13 . 1 1 102 102 ALA H H 102 7.677 7.677 7.731 -0.054 25324 9172 1 13 . 1 1 103 103 ILE N N 103 118.218 118.218 121.101 -2.883 25324 9173 1 13 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.523 -0.496 25324 9174 1 13 . 1 1 103 103 ILE C C 103 173.118 173.118 173.992 -0.874 25324 9175 1 13 . 1 1 103 103 ILE CA C 103 62.227 62.227 59.239 2.989 25324 9176 1 13 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.377 1.094 25324 9177 1 13 . 1 1 103 103 ILE H H 103 8.102 8.102 8.400 -0.298 25324 9178 1 13 . 1 1 104 104 ASN N N 104 125.938 125.938 126.307 -0.369 25324 9179 1 13 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.176 0.510 25324 9180 1 13 . 1 1 104 104 ASN C C 104 174.870 174.870 173.624 1.246 25324 9181 1 13 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.612 -0.059 25324 9182 1 13 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.220 -1.368 25324 9183 1 13 . 1 1 104 104 ASN H H 104 8.668 8.668 9.142 -0.474 25324 9184 1 13 . 1 1 105 105 VAL N N 105 114.631 114.631 119.554 -4.923 25324 9185 1 13 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.010 0.195 25324 9186 1 13 . 1 1 105 105 VAL C C 105 174.788 174.788 173.512 1.276 25324 9187 1 13 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.207 -2.228 25324 9188 1 13 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.400 0.640 25324 9189 1 13 . 1 1 105 105 VAL H H 105 8.933 8.933 8.857 0.076 25324 9190 1 13 . 1 1 106 106 GLU N N 106 118.347 118.347 126.940 -8.593 25324 9191 1 13 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.019 0.062 25324 9192 1 13 . 1 1 106 106 GLU C C 106 174.777 174.777 174.920 -0.143 25324 9193 1 13 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.509 -0.542 25324 9194 1 13 . 1 1 106 106 GLU CB C 106 33.643 33.643 31.007 2.636 25324 9195 1 13 . 1 1 106 106 GLU H H 106 8.814 8.814 8.480 0.334 25324 9196 1 13 . 1 1 107 107 SER N N 107 115.335 115.335 119.447 -4.112 25324 9197 1 13 . 1 1 107 107 SER HA H 107 5.266 5.266 4.814 0.452 25324 9198 1 13 . 1 1 107 107 SER C C 107 175.787 175.787 172.708 3.079 25324 9199 1 13 . 1 1 107 107 SER CA C 107 55.888 55.888 57.892 -2.003 25324 9200 1 13 . 1 1 107 107 SER CB C 107 65.921 65.921 66.791 -0.870 25324 9201 1 13 . 1 1 107 107 SER H H 107 8.576 8.576 9.050 -0.474 25324 9202 1 13 . 1 1 108 108 GLY N N 108 117.567 117.567 109.454 8.113 25324 9203 1 13 . 1 1 108 108 GLY C C 108 173.959 173.959 173.827 0.132 25324 9204 1 13 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.023 -0.346 25324 9205 1 13 . 1 1 108 108 GLY H H 108 9.532 9.532 8.581 0.951 25324 9206 1 13 . 1 1 109 109 ASP N N 109 122.108 122.108 128.198 -6.090 25324 9207 1 13 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.568 0.233 25324 9208 1 13 . 1 1 109 109 ASP C C 109 176.203 176.203 176.253 -0.050 25324 9209 1 13 . 1 1 109 109 ASP CA C 109 52.134 52.134 55.471 -3.337 25324 9210 1 13 . 1 1 109 109 ASP CB C 109 39.342 39.342 40.668 -1.326 25324 9211 1 13 . 1 1 109 109 ASP H H 109 8.605 8.605 8.641 -0.036 25324 9212 1 13 . 1 1 110 110 ASP N N 110 116.197 116.197 121.852 -5.655 25324 9213 1 13 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.299 -0.077 25324 9214 1 13 . 1 1 110 110 ASP C C 110 175.951 175.951 175.876 0.075 25324 9215 1 13 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.396 -0.198 25324 9216 1 13 . 1 1 110 110 ASP CB C 110 38.630 38.630 39.311 -0.681 25324 9217 1 13 . 1 1 110 110 ASP H H 110 9.087 9.087 8.772 0.315 25324 9218 1 13 . 1 1 111 111 GLY N N 111 103.841 103.841 104.992 -1.151 25324 9219 1 13 . 1 1 111 111 GLY C C 111 173.924 173.924 175.065 -1.141 25324 9220 1 13 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.588 -0.425 25324 9221 1 13 . 1 1 111 111 GLY H H 111 8.930 8.930 7.897 1.033 25324 9222 1 13 . 1 1 112 112 GLN N N 112 121.626 121.626 118.919 2.707 25324 9223 1 13 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.050 0.020 25324 9224 1 13 . 1 1 112 112 GLN C C 112 176.431 176.431 174.748 1.683 25324 9225 1 13 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.880 -0.607 25324 9226 1 13 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.096 -1.403 25324 9227 1 13 . 1 1 112 112 GLN H H 112 7.351 7.351 8.199 -0.848 25324 9228 1 13 . 1 1 113 113 THR N N 113 112.322 112.322 106.814 5.508 25324 9229 1 13 . 1 1 113 113 THR HA H 113 5.331 5.331 5.117 0.214 25324 9230 1 13 . 1 1 113 113 THR C C 113 174.452 174.452 172.991 1.461 25324 9231 1 13 . 1 1 113 113 THR CA C 113 59.739 59.739 59.832 -0.093 25324 9232 1 13 . 1 1 113 113 THR CB C 113 71.773 71.773 72.147 -0.374 25324 9233 1 13 . 1 1 113 113 THR H H 113 10.053 10.053 7.569 2.483 25324 9234 1 13 . 1 1 114 114 LEU N N 114 122.083 122.083 121.736 0.347 25324 9235 1 13 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.655 -0.074 25324 9236 1 13 . 1 1 114 114 LEU C C 114 175.113 175.113 174.813 0.300 25324 9237 1 13 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.112 -1.207 25324 9238 1 13 . 1 1 114 114 LEU CB C 114 47.033 47.033 44.350 2.683 25324 9239 1 13 . 1 1 114 114 LEU H H 114 8.978 8.978 8.867 0.111 25324 9240 1 13 . 1 1 115 115 ASN N N 115 118.846 118.846 122.150 -3.304 25324 9241 1 13 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.708 0.062 25324 9242 1 13 . 1 1 115 115 ASN C C 115 174.788 174.788 175.348 -0.560 25324 9243 1 13 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.537 0.805 25324 9244 1 13 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.077 1.337 25324 9245 1 13 . 1 1 115 115 ASN H H 115 8.837 8.837 8.679 0.158 25324 9246 1 13 . 1 1 116 116 GLY N N 116 109.661 109.661 109.208 0.453 25324 9247 1 13 . 1 1 116 116 GLY C C 116 172.452 172.452 172.720 -0.268 25324 9248 1 13 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.228 0.243 25324 9249 1 13 . 1 1 116 116 GLY H H 116 8.625 8.625 8.974 -0.349 25324 9250 1 13 . 1 1 117 117 THR N N 117 120.009 120.009 114.464 5.545 25324 9251 1 13 . 1 1 117 117 THR HA H 117 5.556 5.556 5.638 -0.082 25324 9252 1 13 . 1 1 117 117 THR C C 117 171.619 171.619 173.132 -1.513 25324 9253 1 13 . 1 1 117 117 THR CA C 117 59.373 59.373 60.633 -1.260 25324 9254 1 13 . 1 1 117 117 THR CB C 117 72.777 72.777 72.825 -0.048 25324 9255 1 13 . 1 1 117 117 THR H H 117 8.911 8.911 8.962 -0.051 25324 9256 1 13 . 1 1 118 118 MET N N 118 115.550 115.550 116.961 -1.411 25324 9257 1 13 . 1 1 118 118 MET HA H 118 4.889 4.889 5.318 -0.429 25324 9258 1 13 . 1 1 118 118 MET C C 118 172.707 172.707 174.028 -1.321 25324 9259 1 13 . 1 1 118 118 MET CA C 118 54.714 54.714 54.813 -0.099 25324 9260 1 13 . 1 1 118 118 MET CB C 118 33.663 33.663 37.257 -3.594 25324 9261 1 13 . 1 1 118 118 MET H H 118 9.159 9.159 9.426 -0.267 25324 9262 1 13 . 1 1 119 119 THR N N 119 113.716 113.716 115.262 -1.546 25324 9263 1 13 . 1 1 119 119 THR HA H 119 4.682 4.682 4.857 -0.175 25324 9264 1 13 . 1 1 119 119 THR C C 119 173.952 173.952 173.162 0.790 25324 9265 1 13 . 1 1 119 119 THR CA C 119 61.395 61.395 61.641 -0.245 25324 9266 1 13 . 1 1 119 119 THR CB C 119 71.746 71.746 72.346 -0.600 25324 9267 1 13 . 1 1 119 119 THR H H 119 8.685 8.685 8.597 0.088 25324 9268 1 13 . 1 1 120 120 TYR N N 120 129.153 129.153 124.518 4.635 25324 9269 1 13 . 1 1 120 120 TYR HA H 120 4.800 4.800 5.086 -0.286 25324 9270 1 13 . 1 1 120 120 TYR C C 120 175.214 175.214 175.933 -0.719 25324 9271 1 13 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.429 1.448 25324 9272 1 13 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.722 -0.220 25324 9273 1 13 . 1 1 120 120 TYR H H 120 10.107 10.107 8.860 1.248 25324 9274 1 13 . 1 1 121 121 ALA N N 121 119.947 119.947 123.885 -3.938 25324 9275 1 13 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.355 -0.351 25324 9276 1 13 . 1 1 121 121 ALA C C 121 178.456 178.456 177.953 0.503 25324 9277 1 13 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.685 0.271 25324 9278 1 13 . 1 1 121 121 ALA CB C 121 18.710 18.710 19.136 -0.426 25324 9279 1 13 . 1 1 121 121 ALA H H 121 8.704 8.704 8.210 0.494 25324 9280 1 13 . 1 1 122 122 GLY N N 122 111.186 111.186 110.619 0.567 25324 9281 1 13 . 1 1 122 122 GLY C C 122 173.949 173.949 174.319 -0.370 25324 9282 1 13 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.599 -0.597 25324 9283 1 13 . 1 1 122 122 GLY H H 122 8.792 8.792 8.775 0.017 25324 9284 1 13 . 1 1 123 123 GLU N N 123 120.099 120.099 120.009 0.090 25324 9285 1 13 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.631 0.074 25324 9286 1 13 . 1 1 123 123 GLU C C 123 175.912 175.912 175.741 0.171 25324 9287 1 13 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.788 -0.374 25324 9288 1 13 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.379 0.405 25324 9289 1 13 . 1 1 123 123 GLU H H 123 8.072 8.072 7.659 0.413 25324 9290 1 13 . 1 1 124 124 GLY N N 124 105.303 105.303 109.133 -3.830 25324 9291 1 13 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.610 0.192 25324 9292 1 13 . 1 1 124 124 GLY H H 124 7.939 7.939 8.404 -0.465 25324 9293 1 13 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.917 0.018 25324 9294 1 13 . 1 1 125 125 PRO C C 125 177.788 177.788 176.463 1.325 25324 9295 1 13 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.856 0.275 25324 9296 1 13 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.380 -0.521 25324 9297 1 13 . 1 1 126 126 ILE N N 126 117.387 117.387 117.554 -0.167 25324 9298 1 13 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.763 0.136 25324 9299 1 13 . 1 1 126 126 ILE C C 126 175.625 175.625 174.997 0.628 25324 9300 1 13 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.176 0.277 25324 9301 1 13 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.510 1.038 25324 9302 1 13 . 1 1 126 126 ILE H H 126 9.599 9.599 9.037 0.562 25324 9303 1 13 . 1 1 127 127 GLY N N 127 106.753 106.753 108.543 -1.790 25324 9304 1 13 . 1 1 127 127 GLY C C 127 173.627 173.627 172.759 0.868 25324 9305 1 13 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.641 1.642 25324 9306 1 13 . 1 1 127 127 GLY H H 127 8.840 8.840 8.742 0.098 25324 9307 1 13 . 1 1 128 128 PHE N N 128 124.826 124.826 126.384 -1.558 25324 9308 1 13 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.213 -0.269 25324 9309 1 13 . 1 1 128 128 PHE C C 128 173.087 173.087 173.215 -0.128 25324 9310 1 13 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.624 0.384 25324 9311 1 13 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.384 -0.224 25324 9312 1 13 . 1 1 128 128 PHE H H 128 8.924 8.924 9.235 -0.311 25324 9313 1 13 . 1 1 129 129 LYS N N 129 131.518 131.518 128.434 3.084 25324 9314 1 13 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.698 0.185 25324 9315 1 13 . 1 1 129 129 LYS C C 129 173.863 173.863 173.891 -0.028 25324 9316 1 13 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.578 1.157 25324 9317 1 13 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.097 -0.376 25324 9318 1 13 . 1 1 129 129 LYS H H 129 8.201 8.201 8.332 -0.131 25324 9319 1 13 . 1 1 130 130 GLY N N 130 114.030 114.030 112.621 1.409 25324 9320 1 13 . 1 1 130 130 GLY C C 130 171.951 171.951 172.084 -0.133 25324 9321 1 13 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.394 0.393 25324 9322 1 13 . 1 1 130 130 GLY H H 130 9.325 9.325 8.639 0.686 25324 9323 1 13 . 1 1 131 131 THR N N 131 120.583 120.583 117.190 3.393 25324 9324 1 13 . 1 1 131 131 THR HA H 131 4.939 4.939 5.099 -0.160 25324 9325 1 13 . 1 1 131 131 THR C C 131 173.118 173.118 172.952 0.166 25324 9326 1 13 . 1 1 131 131 THR CA C 131 61.266 61.266 60.002 1.264 25324 9327 1 13 . 1 1 131 131 THR CB C 131 70.392 70.392 71.672 -1.280 25324 9328 1 13 . 1 1 131 131 THR H H 131 8.916 8.916 8.685 0.231 25324 9329 1 13 . 1 1 132 132 LEU N N 132 130.774 130.774 129.733 1.041 25324 9330 1 13 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.984 -0.484 25324 9331 1 13 . 1 1 132 132 LEU C C 132 176.574 176.574 175.672 0.902 25324 9332 1 13 . 1 1 132 132 LEU CA C 132 56.187 56.187 54.466 1.721 25324 9333 1 13 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.819 -0.372 25324 9334 1 13 . 1 1 132 132 LEU H H 132 8.527 8.527 8.854 -0.327 25324 9335 1 14 . 1 1 3 3 LEU N N 3 123.202 123.202 123.001 0.201 25324 9336 1 14 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.836 0.321 25324 9337 1 14 . 1 1 3 3 LEU C C 3 175.786 175.786 175.107 0.679 25324 9338 1 14 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.324 -0.040 25324 9339 1 14 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.753 -0.423 25324 9340 1 14 . 1 1 3 3 LEU H H 3 8.711 8.711 8.539 0.172 25324 9341 1 14 . 1 1 4 4 TYR N N 4 120.906 120.906 124.631 -3.725 25324 9342 1 14 . 1 1 4 4 TYR HA H 4 5.024 5.024 4.991 0.033 25324 9343 1 14 . 1 1 4 4 TYR C C 4 175.953 175.953 174.637 1.316 25324 9344 1 14 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.778 -0.401 25324 9345 1 14 . 1 1 4 4 TYR CB C 4 41.655 41.655 41.599 0.056 25324 9346 1 14 . 1 1 4 4 TYR H H 4 9.142 9.142 9.384 -0.242 25324 9347 1 14 . 1 1 5 5 ASN N N 5 120.496 120.496 120.094 0.402 25324 9348 1 14 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.950 0.166 25324 9349 1 14 . 1 1 5 5 ASN C C 5 174.953 174.953 173.742 1.211 25324 9350 1 14 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.347 0.600 25324 9351 1 14 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.411 -1.520 25324 9352 1 14 . 1 1 5 5 ASN H H 5 8.787 8.787 9.057 -0.270 25324 9353 1 14 . 1 1 6 6 VAL N N 6 127.428 127.428 125.465 1.963 25324 9354 1 14 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.395 -0.033 25324 9355 1 14 . 1 1 6 6 VAL C C 6 174.955 174.955 174.754 0.201 25324 9356 1 14 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.893 0.540 25324 9357 1 14 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.788 0.543 25324 9358 1 14 . 1 1 6 6 VAL H H 6 8.806 8.806 8.033 0.773 25324 9359 1 14 . 1 1 7 7 GLU N N 7 124.355 124.355 126.939 -2.584 25324 9360 1 14 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.932 0.050 25324 9361 1 14 . 1 1 7 7 GLU C C 7 174.551 174.551 174.973 -0.422 25324 9362 1 14 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.787 -0.998 25324 9363 1 14 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.129 1.438 25324 9364 1 14 . 1 1 7 7 GLU H H 7 8.800 8.800 8.945 -0.145 25324 9365 1 14 . 1 1 8 8 ASN N N 8 116.231 116.231 120.974 -4.743 25324 9366 1 14 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.878 0.163 25324 9367 1 14 . 1 1 8 8 ASN C C 8 172.709 172.709 173.748 -1.039 25324 9368 1 14 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.635 -1.018 25324 9369 1 14 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.503 2.082 25324 9370 1 14 . 1 1 8 8 ASN H H 8 9.320 9.320 9.338 -0.018 25324 9371 1 14 . 1 1 9 9 GLN N N 9 120.762 120.762 121.929 -1.167 25324 9372 1 14 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.558 -0.384 25324 9373 1 14 . 1 1 9 9 GLN C C 9 173.454 173.454 174.362 -0.908 25324 9374 1 14 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.296 -0.336 25324 9375 1 14 . 1 1 9 9 GLN CB C 9 30.691 30.691 30.364 0.327 25324 9376 1 14 . 1 1 9 9 GLN H H 9 6.887 6.887 8.704 -1.817 25324 9377 1 14 . 1 1 10 10 TRP N N 10 127.775 127.775 124.536 3.239 25324 9378 1 14 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.078 -0.090 25324 9379 1 14 . 1 1 10 10 TRP C C 10 175.281 175.281 175.537 -0.256 25324 9380 1 14 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.408 -0.115 25324 9381 1 14 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.454 -0.712 25324 9382 1 14 . 1 1 10 10 TRP H H 10 8.518 8.518 8.136 0.382 25324 9383 1 14 . 1 1 11 11 GLY N N 11 107.838 107.838 109.081 -1.243 25324 9384 1 14 . 1 1 11 11 GLY C C 11 174.733 174.733 174.244 0.489 25324 9385 1 14 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.633 0.203 25324 9386 1 14 . 1 1 11 11 GLY H H 11 8.461 8.461 8.048 0.413 25324 9387 1 14 . 1 1 12 12 GLY N N 12 109.696 109.696 108.513 1.183 25324 9388 1 14 . 1 1 12 12 GLY C C 12 174.133 174.133 173.692 0.441 25324 9389 1 14 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.841 -1.052 25324 9390 1 14 . 1 1 12 12 GLY H H 12 8.138 8.138 7.522 0.616 25324 9391 1 14 . 1 1 13 13 SER N N 13 111.308 111.308 115.016 -3.708 25324 9392 1 14 . 1 1 13 13 SER HA H 13 4.092 4.092 4.459 -0.367 25324 9393 1 14 . 1 1 13 13 SER C C 13 175.622 175.622 175.350 0.272 25324 9394 1 14 . 1 1 13 13 SER CA C 13 60.494 60.494 59.434 1.060 25324 9395 1 14 . 1 1 13 13 SER CB C 13 63.028 63.028 63.610 -0.582 25324 9396 1 14 . 1 1 13 13 SER H H 13 8.215 8.215 8.530 -0.315 25324 9397 1 14 . 1 1 14 14 SER N N 14 115.290 115.290 116.662 -1.372 25324 9398 1 14 . 1 1 14 14 SER HA H 14 4.566 4.566 4.432 0.134 25324 9399 1 14 . 1 1 14 14 SER C C 14 173.532 173.532 174.238 -0.706 25324 9400 1 14 . 1 1 14 14 SER CA C 14 57.317 57.317 57.635 -0.318 25324 9401 1 14 . 1 1 14 14 SER CB C 14 63.230 63.230 63.782 -0.552 25324 9402 1 14 . 1 1 14 14 SER H H 14 8.213 8.213 7.895 0.318 25324 9403 1 14 . 1 1 15 15 ALA N N 15 126.470 126.470 126.755 -0.285 25324 9404 1 14 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.196 0.207 25324 9405 1 14 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.994 -0.530 25324 9406 1 14 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.150 0.079 25324 9407 1 14 . 1 1 15 15 ALA H H 15 7.308 7.308 7.582 -0.274 25324 9408 1 14 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.227 0.182 25324 9409 1 14 . 1 1 16 16 PRO C C 16 175.627 175.627 175.195 0.432 25324 9410 1 14 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.212 0.180 25324 9411 1 14 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.632 -0.495 25324 9412 1 14 . 1 1 17 17 TRP N N 17 120.228 120.228 119.825 0.403 25324 9413 1 14 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.620 -0.302 25324 9414 1 14 . 1 1 17 17 TRP C C 17 175.951 175.951 176.097 -0.146 25324 9415 1 14 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.942 -0.027 25324 9416 1 14 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.559 -1.150 25324 9417 1 14 . 1 1 17 17 TRP H H 17 8.380 8.380 8.176 0.204 25324 9418 1 14 . 1 1 18 18 ASN N N 18 120.663 120.663 123.254 -2.591 25324 9419 1 14 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.151 -0.065 25324 9420 1 14 . 1 1 18 18 ASN C C 18 174.793 174.793 174.454 0.339 25324 9421 1 14 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.642 -1.041 25324 9422 1 14 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.675 0.973 25324 9423 1 14 . 1 1 18 18 ASN H H 18 9.094 9.094 8.836 0.258 25324 9424 1 14 . 1 1 19 19 GLU N N 19 122.202 122.202 123.718 -1.516 25324 9425 1 14 . 1 1 19 19 GLU HA H 19 4.139 4.139 5.019 -0.880 25324 9426 1 14 . 1 1 19 19 GLU C C 19 176.869 176.869 176.662 0.207 25324 9427 1 14 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.303 2.297 25324 9428 1 14 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.922 -0.540 25324 9429 1 14 . 1 1 19 19 GLU H H 19 9.013 9.013 8.947 0.066 25324 9430 1 14 . 1 1 20 20 GLY N N 20 112.893 112.893 112.087 0.806 25324 9431 1 14 . 1 1 20 20 GLY C C 20 174.878 174.878 173.136 1.742 25324 9432 1 14 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.797 0.198 25324 9433 1 14 . 1 1 20 20 GLY H H 20 8.926 8.926 8.387 0.539 25324 9434 1 14 . 1 1 21 21 GLY N N 21 110.354 110.354 107.341 3.013 25324 9435 1 14 . 1 1 21 21 GLY C C 21 171.623 171.623 171.816 -0.193 25324 9436 1 14 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.373 -0.975 25324 9437 1 14 . 1 1 21 21 GLY H H 21 8.258 8.258 7.593 0.665 25324 9438 1 14 . 1 1 22 22 GLN N N 22 117.541 117.541 117.707 -0.166 25324 9439 1 14 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.911 0.766 25324 9440 1 14 . 1 1 22 22 GLN C C 22 175.957 175.957 174.357 1.600 25324 9441 1 14 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.747 0.197 25324 9442 1 14 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.069 -0.984 25324 9443 1 14 . 1 1 22 22 GLN H H 22 8.564 8.564 8.588 -0.024 25324 9444 1 14 . 1 1 23 23 TRP N N 23 127.208 127.208 122.787 4.421 25324 9445 1 14 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.050 0.149 25324 9446 1 14 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.623 -0.092 25324 9447 1 14 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.440 -0.756 25324 9448 1 14 . 1 1 23 23 TRP H H 23 9.347 9.347 9.040 0.307 25324 9449 1 14 . 1 1 24 24 GLU N N 24 123.504 123.504 120.691 2.813 25324 9450 1 14 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.183 0.325 25324 9451 1 14 . 1 1 24 24 GLU C C 24 174.222 174.222 175.088 -0.866 25324 9452 1 14 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.514 0.077 25324 9453 1 14 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.694 -2.079 25324 9454 1 14 . 1 1 24 24 GLU H H 24 9.296 9.296 8.652 0.644 25324 9455 1 14 . 1 1 25 25 ILE N N 25 123.447 123.447 126.081 -2.634 25324 9456 1 14 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.513 -0.077 25324 9457 1 14 . 1 1 25 25 ILE C C 25 175.790 175.790 174.515 1.275 25324 9458 1 14 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.223 -0.596 25324 9459 1 14 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.326 0.626 25324 9460 1 14 . 1 1 25 25 ILE H H 25 8.635 8.635 8.509 0.126 25324 9461 1 14 . 1 1 26 26 GLY N N 26 111.544 111.544 114.099 -2.555 25324 9462 1 14 . 1 1 26 26 GLY C C 26 172.122 172.122 174.906 -2.784 25324 9463 1 14 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.848 -0.770 25324 9464 1 14 . 1 1 26 26 GLY H H 26 3.381 3.381 6.738 -3.357 25324 9465 1 14 . 1 1 27 27 SER N N 27 112.279 112.279 115.723 -3.444 25324 9466 1 14 . 1 1 27 27 SER HA H 27 4.876 4.876 4.216 0.660 25324 9467 1 14 . 1 1 27 27 SER C C 27 174.113 174.113 175.254 -1.141 25324 9468 1 14 . 1 1 27 27 SER CA C 27 56.954 56.954 60.542 -3.588 25324 9469 1 14 . 1 1 27 27 SER CB C 27 64.554 64.554 63.945 0.609 25324 9470 1 14 . 1 1 27 27 SER H H 27 8.212 8.212 8.540 -0.328 25324 9471 1 14 . 1 1 28 28 ARG N N 28 120.872 120.872 120.935 -0.063 25324 9472 1 14 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.511 0.252 25324 9473 1 14 . 1 1 28 28 ARG C C 28 176.119 176.119 176.644 -0.525 25324 9474 1 14 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.725 -0.608 25324 9475 1 14 . 1 1 28 28 ARG CB C 28 31.830 31.830 31.252 0.578 25324 9476 1 14 . 1 1 28 28 ARG H H 28 7.849 7.849 8.319 -0.470 25324 9477 1 14 . 1 1 29 29 SER N N 29 118.985 118.985 118.822 0.163 25324 9478 1 14 . 1 1 29 29 SER HA H 29 4.192 4.192 4.421 -0.229 25324 9479 1 14 . 1 1 29 29 SER C C 29 174.622 174.622 174.707 -0.085 25324 9480 1 14 . 1 1 29 29 SER CA C 29 60.072 60.072 59.207 0.865 25324 9481 1 14 . 1 1 29 29 SER CB C 29 62.876 62.876 63.327 -0.451 25324 9482 1 14 . 1 1 29 29 SER H H 29 8.892 8.892 8.942 -0.050 25324 9483 1 14 . 1 1 30 30 ASP N N 30 117.632 117.632 120.670 -3.038 25324 9484 1 14 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.495 0.123 25324 9485 1 14 . 1 1 30 30 ASP C C 30 175.101 175.101 176.314 -1.213 25324 9486 1 14 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.954 -2.902 25324 9487 1 14 . 1 1 30 30 ASP CB C 30 40.523 40.523 40.881 -0.358 25324 9488 1 14 . 1 1 30 30 ASP H H 30 8.441 8.441 8.099 0.342 25324 9489 1 14 . 1 1 31 31 GLN N N 31 118.273 118.273 117.984 0.289 25324 9490 1 14 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.426 0.059 25324 9491 1 14 . 1 1 31 31 GLN C C 31 173.453 173.453 174.245 -0.792 25324 9492 1 14 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.949 -0.081 25324 9493 1 14 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.847 2.402 25324 9494 1 14 . 1 1 31 31 GLN H H 31 7.029 7.029 7.566 -0.537 25324 9495 1 14 . 1 1 32 32 ASN N N 32 120.865 120.865 120.974 -0.109 25324 9496 1 14 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.962 0.158 25324 9497 1 14 . 1 1 32 32 ASN C C 32 175.198 175.198 174.631 0.567 25324 9498 1 14 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.410 -0.541 25324 9499 1 14 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.291 -0.661 25324 9500 1 14 . 1 1 32 32 ASN H H 32 8.713 8.713 8.635 0.078 25324 9501 1 14 . 1 1 33 33 VAL N N 33 122.111 122.111 117.441 4.670 25324 9502 1 14 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.709 -1.004 25324 9503 1 14 . 1 1 33 33 VAL C C 33 174.950 174.950 175.920 -0.970 25324 9504 1 14 . 1 1 33 33 VAL CA C 33 63.847 63.847 60.635 3.212 25324 9505 1 14 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.381 -0.031 25324 9506 1 14 . 1 1 33 33 VAL H H 33 8.542 8.542 8.730 -0.188 25324 9507 1 14 . 1 1 34 34 VAL N N 34 113.282 113.282 118.402 -5.120 25324 9508 1 14 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.990 -0.345 25324 9509 1 14 . 1 1 34 34 VAL C C 34 175.574 175.574 174.842 0.732 25324 9510 1 14 . 1 1 34 34 VAL CA C 34 59.974 59.974 60.974 -1.000 25324 9511 1 14 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.704 -0.675 25324 9512 1 14 . 1 1 34 34 VAL H H 34 8.744 8.744 8.913 -0.169 25324 9513 1 14 . 1 1 35 35 ALA N N 35 122.102 122.102 121.037 1.065 25324 9514 1 14 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.307 -0.504 25324 9515 1 14 . 1 1 35 35 ALA C C 35 175.947 175.947 175.097 0.850 25324 9516 1 14 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.864 2.386 25324 9517 1 14 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.336 -0.708 25324 9518 1 14 . 1 1 35 35 ALA H H 35 7.677 7.677 7.814 -0.137 25324 9519 1 14 . 1 1 36 36 ILE N N 36 118.005 118.005 121.400 -3.395 25324 9520 1 14 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.506 -0.478 25324 9521 1 14 . 1 1 36 36 ILE C C 36 173.116 173.116 173.857 -0.741 25324 9522 1 14 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.218 0.964 25324 9523 1 14 . 1 1 36 36 ILE CB C 36 42.485 42.485 42.157 0.328 25324 9524 1 14 . 1 1 36 36 ILE H H 36 8.126 8.126 8.685 -0.559 25324 9525 1 14 . 1 1 37 37 ASN N N 37 125.632 125.632 125.978 -0.346 25324 9526 1 14 . 1 1 37 37 ASN HA H 37 5.681 5.681 6.099 -0.418 25324 9527 1 14 . 1 1 37 37 ASN C C 37 174.854 174.854 173.425 1.429 25324 9528 1 14 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.310 0.220 25324 9529 1 14 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.991 -3.138 25324 9530 1 14 . 1 1 37 37 ASN H H 37 8.577 8.577 9.120 -0.543 25324 9531 1 14 . 1 1 38 38 VAL N N 38 114.223 114.223 119.596 -5.373 25324 9532 1 14 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.892 0.311 25324 9533 1 14 . 1 1 38 38 VAL C C 38 174.854 174.854 173.126 1.728 25324 9534 1 14 . 1 1 38 38 VAL CA C 38 57.980 57.980 60.223 -2.243 25324 9535 1 14 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.699 0.345 25324 9536 1 14 . 1 1 38 38 VAL H H 38 8.874 8.874 8.816 0.058 25324 9537 1 14 . 1 1 39 39 GLU N N 39 118.277 118.277 120.816 -2.539 25324 9538 1 14 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.190 -0.108 25324 9539 1 14 . 1 1 39 39 GLU C C 39 174.548 174.548 175.277 -0.729 25324 9540 1 14 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.902 1.091 25324 9541 1 14 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.136 -0.558 25324 9542 1 14 . 1 1 39 39 GLU H H 39 8.761 8.761 9.079 -0.318 25324 9543 1 14 . 1 1 40 40 SER N N 40 114.960 114.960 119.412 -4.452 25324 9544 1 14 . 1 1 40 40 SER HA H 40 5.265 5.265 5.133 0.132 25324 9545 1 14 . 1 1 40 40 SER C C 40 175.783 175.783 174.746 1.037 25324 9546 1 14 . 1 1 40 40 SER CA C 40 55.880 55.880 56.999 -1.119 25324 9547 1 14 . 1 1 40 40 SER CB C 40 65.911 65.911 64.176 1.735 25324 9548 1 14 . 1 1 40 40 SER H H 40 8.500 8.500 8.458 0.042 25324 9549 1 14 . 1 1 41 41 GLY N N 41 117.567 117.567 108.258 9.309 25324 9550 1 14 . 1 1 41 41 GLY C C 41 174.119 174.119 173.524 0.595 25324 9551 1 14 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.238 -0.550 25324 9552 1 14 . 1 1 41 41 GLY H H 41 9.533 9.533 8.473 1.060 25324 9553 1 14 . 1 1 42 42 ASP N N 42 122.141 122.141 121.045 1.096 25324 9554 1 14 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.861 -0.061 25324 9555 1 14 . 1 1 42 42 ASP C C 42 176.121 176.121 175.484 0.637 25324 9556 1 14 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.145 -0.999 25324 9557 1 14 . 1 1 42 42 ASP CB C 42 39.354 39.354 41.740 -2.386 25324 9558 1 14 . 1 1 42 42 ASP H H 42 8.644 8.644 7.883 0.761 25324 9559 1 14 . 1 1 43 43 ASP N N 43 116.025 116.025 124.714 -8.689 25324 9560 1 14 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.342 -0.113 25324 9561 1 14 . 1 1 43 43 ASP C C 43 176.018 176.018 176.065 -0.047 25324 9562 1 14 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.355 -0.106 25324 9563 1 14 . 1 1 43 43 ASP CB C 43 38.559 38.559 40.000 -1.441 25324 9564 1 14 . 1 1 43 43 ASP H H 43 9.111 9.111 9.055 0.056 25324 9565 1 14 . 1 1 44 44 GLY N N 44 104.263 104.263 102.529 1.734 25324 9566 1 14 . 1 1 44 44 GLY C C 44 173.922 173.922 175.306 -1.384 25324 9567 1 14 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.437 -0.136 25324 9568 1 14 . 1 1 44 44 GLY H H 44 9.063 9.063 8.484 0.579 25324 9569 1 14 . 1 1 45 45 GLN N N 45 121.691 121.691 118.702 2.989 25324 9570 1 14 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.239 -0.153 25324 9571 1 14 . 1 1 45 45 GLN C C 45 176.284 176.284 175.853 0.431 25324 9572 1 14 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.190 -0.072 25324 9573 1 14 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.498 -1.824 25324 9574 1 14 . 1 1 45 45 GLN H H 45 7.356 7.356 8.093 -0.737 25324 9575 1 14 . 1 1 46 46 THR N N 46 111.843 111.843 113.548 -1.705 25324 9576 1 14 . 1 1 46 46 THR HA H 46 5.355 5.355 5.166 0.189 25324 9577 1 14 . 1 1 46 46 THR C C 46 174.451 174.451 172.480 1.971 25324 9578 1 14 . 1 1 46 46 THR CA C 46 59.644 59.644 60.453 -0.809 25324 9579 1 14 . 1 1 46 46 THR CB C 46 72.714 72.714 70.169 2.545 25324 9580 1 14 . 1 1 46 46 THR H H 46 10.123 10.123 7.398 2.725 25324 9581 1 14 . 1 1 47 47 LEU N N 47 119.302 119.302 127.947 -8.645 25324 9582 1 14 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.702 0.105 25324 9583 1 14 . 1 1 47 47 LEU C C 47 175.487 175.487 174.432 1.055 25324 9584 1 14 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.280 -0.210 25324 9585 1 14 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.655 3.348 25324 9586 1 14 . 1 1 47 47 LEU H H 47 8.364 8.364 8.833 -0.469 25324 9587 1 14 . 1 1 48 48 ASN N N 48 116.844 116.844 118.193 -1.349 25324 9588 1 14 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.718 0.011 25324 9589 1 14 . 1 1 48 48 ASN C C 48 174.460 174.460 174.582 -0.122 25324 9590 1 14 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.213 1.526 25324 9591 1 14 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.153 1.260 25324 9592 1 14 . 1 1 48 48 ASN H H 48 8.748 8.748 8.661 0.087 25324 9593 1 14 . 1 1 49 49 GLY N N 49 109.417 109.417 106.778 2.639 25324 9594 1 14 . 1 1 49 49 GLY C C 49 172.126 172.126 172.245 -0.119 25324 9595 1 14 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.265 0.226 25324 9596 1 14 . 1 1 49 49 GLY H H 49 8.744 8.744 8.696 0.048 25324 9597 1 14 . 1 1 50 50 THR N N 50 119.162 119.162 113.388 5.774 25324 9598 1 14 . 1 1 50 50 THR HA H 50 5.556 5.556 5.589 -0.033 25324 9599 1 14 . 1 1 50 50 THR C C 50 171.790 171.790 173.279 -1.489 25324 9600 1 14 . 1 1 50 50 THR CA C 50 59.371 59.371 60.054 -0.683 25324 9601 1 14 . 1 1 50 50 THR CB C 50 72.799 72.799 72.524 0.275 25324 9602 1 14 . 1 1 50 50 THR H H 50 8.799 8.799 9.112 -0.313 25324 9603 1 14 . 1 1 51 51 MET N N 51 115.232 115.232 121.385 -6.153 25324 9604 1 14 . 1 1 51 51 MET HA H 51 4.886 4.886 5.034 -0.148 25324 9605 1 14 . 1 1 51 51 MET C C 51 172.708 172.708 174.704 -1.996 25324 9606 1 14 . 1 1 51 51 MET CA C 51 54.722 54.722 54.824 -0.102 25324 9607 1 14 . 1 1 51 51 MET CB C 51 34.557 34.557 37.823 -3.266 25324 9608 1 14 . 1 1 51 51 MET H H 51 9.062 9.062 9.076 -0.014 25324 9609 1 14 . 1 1 52 52 THR N N 52 113.697 113.697 117.810 -4.113 25324 9610 1 14 . 1 1 52 52 THR HA H 52 4.682 4.682 4.743 -0.061 25324 9611 1 14 . 1 1 52 52 THR C C 52 173.952 173.952 173.536 0.416 25324 9612 1 14 . 1 1 52 52 THR CA C 52 61.395 61.395 61.279 0.116 25324 9613 1 14 . 1 1 52 52 THR CB C 52 71.734 71.734 70.836 0.898 25324 9614 1 14 . 1 1 52 52 THR H H 52 8.685 8.685 8.802 -0.117 25324 9615 1 14 . 1 1 53 53 TYR N N 53 129.086 129.086 125.831 3.255 25324 9616 1 14 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.831 -0.031 25324 9617 1 14 . 1 1 53 53 TYR C C 53 175.214 175.214 176.654 -1.440 25324 9618 1 14 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.997 0.884 25324 9619 1 14 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.554 0.958 25324 9620 1 14 . 1 1 53 53 TYR H H 53 10.112 10.112 8.742 1.370 25324 9621 1 14 . 1 1 54 54 ALA N N 54 119.947 119.947 123.757 -3.810 25324 9622 1 14 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.262 -0.260 25324 9623 1 14 . 1 1 54 54 ALA C C 54 178.285 178.285 177.641 0.644 25324 9624 1 14 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.133 0.838 25324 9625 1 14 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.608 1.109 25324 9626 1 14 . 1 1 54 54 ALA H H 54 8.704 8.704 8.360 0.344 25324 9627 1 14 . 1 1 55 55 GLY N N 55 110.940 110.940 112.237 -1.297 25324 9628 1 14 . 1 1 55 55 GLY C C 55 173.903 173.903 174.452 -0.549 25324 9629 1 14 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.105 -0.089 25324 9630 1 14 . 1 1 55 55 GLY H H 55 8.745 8.745 8.291 0.454 25324 9631 1 14 . 1 1 56 56 GLU N N 56 120.073 120.073 120.820 -0.747 25324 9632 1 14 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.740 -0.031 25324 9633 1 14 . 1 1 56 56 GLU C C 56 175.906 175.906 176.478 -0.572 25324 9634 1 14 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.158 -0.735 25324 9635 1 14 . 1 1 56 56 GLU CB C 56 32.824 32.824 31.846 0.978 25324 9636 1 14 . 1 1 56 56 GLU H H 56 8.039 8.039 7.725 0.314 25324 9637 1 14 . 1 1 57 57 GLY N N 57 105.298 105.298 108.153 -2.855 25324 9638 1 14 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.572 0.230 25324 9639 1 14 . 1 1 57 57 GLY H H 57 7.937 7.937 8.256 -0.319 25324 9640 1 14 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.784 0.150 25324 9641 1 14 . 1 1 58 58 PRO C C 58 177.785 177.785 176.478 1.307 25324 9642 1 14 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.110 0.022 25324 9643 1 14 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.341 -0.501 25324 9644 1 14 . 1 1 59 59 ILE N N 59 117.386 117.386 117.678 -0.292 25324 9645 1 14 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.663 0.325 25324 9646 1 14 . 1 1 59 59 ILE C C 59 175.688 175.688 174.949 0.739 25324 9647 1 14 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.110 0.433 25324 9648 1 14 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.604 0.684 25324 9649 1 14 . 1 1 59 59 ILE H H 59 9.600 9.600 8.928 0.672 25324 9650 1 14 . 1 1 60 60 GLY N N 60 107.164 107.164 107.441 -0.277 25324 9651 1 14 . 1 1 60 60 GLY C C 60 173.787 173.787 172.651 1.136 25324 9652 1 14 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.212 2.023 25324 9653 1 14 . 1 1 60 60 GLY H H 60 8.957 8.957 8.759 0.198 25324 9654 1 14 . 1 1 61 61 PHE N N 61 124.597 124.597 124.821 -0.224 25324 9655 1 14 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.495 -0.272 25324 9656 1 14 . 1 1 61 61 PHE C C 61 173.126 173.126 173.023 0.103 25324 9657 1 14 . 1 1 61 61 PHE CA C 61 56.861 56.861 55.373 1.488 25324 9658 1 14 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.214 0.003 25324 9659 1 14 . 1 1 61 61 PHE H H 61 8.788 8.788 9.198 -0.410 25324 9660 1 14 . 1 1 62 62 ARG N N 62 129.706 129.706 127.194 2.512 25324 9661 1 14 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.166 -0.034 25324 9662 1 14 . 1 1 62 62 ARG C C 62 172.456 172.456 173.232 -0.776 25324 9663 1 14 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.874 1.079 25324 9664 1 14 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.371 -1.501 25324 9665 1 14 . 1 1 62 62 ARG H H 62 8.405 8.405 9.201 -0.796 25324 9666 1 14 . 1 1 63 63 ALA N N 63 122.744 122.744 128.544 -5.800 25324 9667 1 14 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.601 -0.256 25324 9668 1 14 . 1 1 63 63 ALA C C 63 176.120 176.120 175.545 0.575 25324 9669 1 14 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.111 -0.192 25324 9670 1 14 . 1 1 63 63 ALA CB C 63 24.773 24.773 23.023 1.750 25324 9671 1 14 . 1 1 63 63 ALA H H 63 8.628 8.628 8.698 -0.070 25324 9672 1 14 . 1 1 64 64 THR N N 64 116.855 116.855 117.588 -0.733 25324 9673 1 14 . 1 1 64 64 THR HA H 64 4.848 4.848 5.276 -0.428 25324 9674 1 14 . 1 1 64 64 THR C C 64 172.957 172.957 173.557 -0.600 25324 9675 1 14 . 1 1 64 64 THR CA C 64 61.211 61.211 61.089 0.122 25324 9676 1 14 . 1 1 64 64 THR CB C 64 71.064 71.064 71.797 -0.733 25324 9677 1 14 . 1 1 64 64 THR H H 64 8.315 8.315 8.518 -0.203 25324 9678 1 14 . 1 1 65 65 LEU N N 65 129.360 129.360 129.776 -0.416 25324 9679 1 14 . 1 1 65 65 LEU HA H 65 3.362 3.362 4.184 -0.822 25324 9680 1 14 . 1 1 65 65 LEU C C 65 176.459 176.459 176.038 0.421 25324 9681 1 14 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.884 0.803 25324 9682 1 14 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.209 -0.498 25324 9683 1 14 . 1 1 65 65 LEU H H 65 8.877 8.877 8.979 -0.102 25324 9684 1 14 . 1 1 66 66 LEU N N 66 128.683 128.683 127.509 1.174 25324 9685 1 14 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.541 -0.165 25324 9686 1 14 . 1 1 66 66 LEU C C 66 177.621 177.621 176.871 0.750 25324 9687 1 14 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.096 -0.396 25324 9688 1 14 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.564 -0.262 25324 9689 1 14 . 1 1 66 66 LEU H H 66 9.320 9.320 8.817 0.503 25324 9690 1 14 . 1 1 67 67 GLY N N 67 105.361 105.361 104.872 0.489 25324 9691 1 14 . 1 1 67 67 GLY C C 67 173.618 173.618 173.197 0.421 25324 9692 1 14 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.197 -0.830 25324 9693 1 14 . 1 1 67 67 GLY H H 67 6.639 6.639 7.403 -0.764 25324 9694 1 14 . 1 1 68 68 ASN N N 68 121.848 121.848 117.552 4.296 25324 9695 1 14 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.246 0.085 25324 9696 1 14 . 1 1 68 68 ASN C C 68 174.316 174.316 175.406 -1.090 25324 9697 1 14 . 1 1 68 68 ASN CA C 68 54.552 54.552 54.348 0.204 25324 9698 1 14 . 1 1 68 68 ASN CB C 68 37.165 37.165 37.175 -0.010 25324 9699 1 14 . 1 1 68 68 ASN H H 68 9.236 9.236 8.742 0.494 25324 9700 1 14 . 1 1 69 69 ASN N N 69 109.509 109.509 108.971 0.538 25324 9701 1 14 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.090 -0.010 25324 9702 1 14 . 1 1 69 69 ASN C C 69 171.456 171.456 173.968 -2.512 25324 9703 1 14 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.490 1.260 25324 9704 1 14 . 1 1 69 69 ASN CB C 69 37.306 37.306 38.096 -0.790 25324 9705 1 14 . 1 1 69 69 ASN H H 69 8.651 8.651 8.680 -0.029 25324 9706 1 14 . 1 1 70 70 SER N N 70 113.479 113.479 114.658 -1.179 25324 9707 1 14 . 1 1 70 70 SER HA H 70 5.437 5.437 5.273 0.164 25324 9708 1 14 . 1 1 70 70 SER C C 70 173.750 173.750 173.447 0.303 25324 9709 1 14 . 1 1 70 70 SER CA C 70 57.139 57.139 58.203 -1.064 25324 9710 1 14 . 1 1 70 70 SER CB C 70 63.818 63.818 64.163 -0.345 25324 9711 1 14 . 1 1 70 70 SER H H 70 7.693 7.693 7.364 0.329 25324 9712 1 14 . 1 1 71 71 TYR N N 71 123.132 123.132 124.294 -1.162 25324 9713 1 14 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.048 0.095 25324 9714 1 14 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.609 0.039 25324 9715 1 14 . 1 1 71 71 TYR CB C 71 42.445 42.445 41.766 0.679 25324 9716 1 14 . 1 1 71 71 TYR H H 71 9.326 9.326 9.536 -0.210 25324 9717 1 14 . 1 1 72 72 GLU N N 72 122.396 122.396 122.886 -0.490 25324 9718 1 14 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.765 0.041 25324 9719 1 14 . 1 1 72 72 GLU C C 72 175.698 175.698 175.489 0.209 25324 9720 1 14 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.675 -0.508 25324 9721 1 14 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.510 -1.326 25324 9722 1 14 . 1 1 72 72 GLU H H 72 8.624 8.624 9.188 -0.564 25324 9723 1 14 . 1 1 73 73 VAL N N 73 128.513 128.513 128.352 0.161 25324 9724 1 14 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.717 -0.518 25324 9725 1 14 . 1 1 73 73 VAL C C 73 175.369 175.369 174.904 0.465 25324 9726 1 14 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.697 -0.217 25324 9727 1 14 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.241 0.092 25324 9728 1 14 . 1 1 73 73 VAL H H 73 8.564 8.564 9.295 -0.731 25324 9729 1 14 . 1 1 74 74 GLU N N 74 124.842 124.842 127.477 -2.635 25324 9730 1 14 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.178 -0.091 25324 9731 1 14 . 1 1 74 74 GLU C C 74 174.415 174.415 175.019 -0.604 25324 9732 1 14 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.984 -0.647 25324 9733 1 14 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.386 1.771 25324 9734 1 14 . 1 1 74 74 GLU H H 74 9.011 9.011 9.417 -0.406 25324 9735 1 14 . 1 1 75 75 ASN N N 75 116.136 116.136 122.399 -6.263 25324 9736 1 14 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.568 0.571 25324 9737 1 14 . 1 1 75 75 ASN C C 75 172.703 172.703 173.844 -1.141 25324 9738 1 14 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.921 -0.096 25324 9739 1 14 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.044 3.852 25324 9740 1 14 . 1 1 75 75 ASN H H 75 9.424 9.424 9.227 0.197 25324 9741 1 14 . 1 1 76 76 GLN N N 76 120.762 120.762 122.709 -1.947 25324 9742 1 14 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.367 -0.327 25324 9743 1 14 . 1 1 76 76 GLN C C 76 173.113 173.113 173.974 -0.861 25324 9744 1 14 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.258 -0.035 25324 9745 1 14 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.814 -0.467 25324 9746 1 14 . 1 1 76 76 GLN H H 76 7.106 7.106 8.956 -1.850 25324 9747 1 14 . 1 1 77 77 TRP N N 77 125.598 125.598 124.378 1.220 25324 9748 1 14 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.066 0.086 25324 9749 1 14 . 1 1 77 77 TRP C C 77 175.502 175.502 175.845 -0.343 25324 9750 1 14 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.785 -1.021 25324 9751 1 14 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.947 -0.948 25324 9752 1 14 . 1 1 77 77 TRP H H 77 8.181 8.181 8.022 0.159 25324 9753 1 14 . 1 1 78 78 GLY N N 78 107.901 107.901 108.079 -0.178 25324 9754 1 14 . 1 1 78 78 GLY C C 78 174.611 174.611 174.121 0.490 25324 9755 1 14 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.136 -0.234 25324 9756 1 14 . 1 1 78 78 GLY H H 78 8.778 8.778 8.861 -0.083 25324 9757 1 14 . 1 1 79 79 GLY N N 79 109.844 109.844 107.212 2.632 25324 9758 1 14 . 1 1 79 79 GLY C C 79 173.782 173.782 172.243 1.539 25324 9759 1 14 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.228 -0.435 25324 9760 1 14 . 1 1 79 79 GLY H H 79 8.198 8.198 7.739 0.459 25324 9761 1 14 . 1 1 80 80 ASP N N 80 115.837 115.837 118.994 -3.157 25324 9762 1 14 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.366 -0.125 25324 9763 1 14 . 1 1 80 80 ASP C C 80 177.285 177.285 176.883 0.402 25324 9764 1 14 . 1 1 80 80 ASP CA C 80 56.183 56.183 54.444 1.739 25324 9765 1 14 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.633 -1.111 25324 9766 1 14 . 1 1 80 80 ASP H H 80 8.132 8.132 8.211 -0.079 25324 9767 1 14 . 1 1 81 81 SER N N 81 112.690 112.690 116.561 -3.871 25324 9768 1 14 . 1 1 81 81 SER HA H 81 4.513 4.513 3.859 0.654 25324 9769 1 14 . 1 1 81 81 SER C C 81 173.684 173.684 173.579 0.105 25324 9770 1 14 . 1 1 81 81 SER CA C 81 57.232 57.232 59.853 -2.621 25324 9771 1 14 . 1 1 81 81 SER CB C 81 63.170 63.170 62.836 0.334 25324 9772 1 14 . 1 1 81 81 SER H H 81 8.179 8.179 8.573 -0.394 25324 9773 1 14 . 1 1 82 82 ALA N N 82 126.310 126.310 124.887 1.423 25324 9774 1 14 . 1 1 82 82 ALA HA H 82 4.403 4.403 3.993 0.410 25324 9775 1 14 . 1 1 82 82 ALA CA C 82 50.466 50.466 52.156 -1.690 25324 9776 1 14 . 1 1 82 82 ALA CB C 82 18.198 18.198 17.912 0.286 25324 9777 1 14 . 1 1 82 82 ALA H H 82 7.274 7.274 7.803 -0.529 25324 9778 1 14 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.374 -0.001 25324 9779 1 14 . 1 1 83 83 PRO C C 83 175.378 175.378 175.660 -0.282 25324 9780 1 14 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.657 -0.330 25324 9781 1 14 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.130 0.034 25324 9782 1 14 . 1 1 84 84 TRP N N 84 120.106 120.106 121.051 -0.945 25324 9783 1 14 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.501 -0.230 25324 9784 1 14 . 1 1 84 84 TRP C C 84 176.358 176.358 175.671 0.687 25324 9785 1 14 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.747 0.199 25324 9786 1 14 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.489 -0.773 25324 9787 1 14 . 1 1 84 84 TRP H H 84 8.329 8.329 8.108 0.221 25324 9788 1 14 . 1 1 85 85 HIS N N 85 118.543 118.543 121.237 -2.694 25324 9789 1 14 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.911 0.007 25324 9790 1 14 . 1 1 85 85 HIS C C 85 174.950 174.950 174.799 0.151 25324 9791 1 14 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.252 -1.784 25324 9792 1 14 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.848 -1.175 25324 9793 1 14 . 1 1 85 85 HIS H H 85 9.204 9.204 8.914 0.290 25324 9794 1 14 . 1 1 86 86 SER N N 86 117.803 117.803 118.561 -0.758 25324 9795 1 14 . 1 1 86 86 SER HA H 86 4.412 4.412 4.225 0.187 25324 9796 1 14 . 1 1 86 86 SER C C 86 175.691 175.691 174.449 1.242 25324 9797 1 14 . 1 1 86 86 SER CA C 86 60.257 60.257 59.727 0.530 25324 9798 1 14 . 1 1 86 86 SER CB C 86 63.015 63.015 63.730 -0.715 25324 9799 1 14 . 1 1 86 86 SER H H 86 9.168 9.168 8.941 0.227 25324 9800 1 14 . 1 1 87 87 GLY N N 87 115.773 115.773 112.241 3.532 25324 9801 1 14 . 1 1 87 87 GLY C C 87 174.288 174.288 173.587 0.701 25324 9802 1 14 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.810 -0.109 25324 9803 1 14 . 1 1 87 87 GLY H H 87 9.284 9.284 9.116 0.168 25324 9804 1 14 . 1 1 88 88 GLY N N 88 109.162 109.162 108.368 0.794 25324 9805 1 14 . 1 1 88 88 GLY C C 88 171.120 171.120 171.908 -0.788 25324 9806 1 14 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.046 -0.452 25324 9807 1 14 . 1 1 88 88 GLY H H 88 8.054 8.054 8.080 -0.026 25324 9808 1 14 . 1 1 89 89 ASN N N 89 117.048 117.048 120.411 -3.363 25324 9809 1 14 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.899 0.139 25324 9810 1 14 . 1 1 89 89 ASN C C 89 175.287 175.287 174.427 0.860 25324 9811 1 14 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.279 -1.414 25324 9812 1 14 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.672 -2.067 25324 9813 1 14 . 1 1 89 89 ASN H H 89 8.516 8.516 8.173 0.343 25324 9814 1 14 . 1 1 90 90 TRP N N 90 125.844 125.844 122.299 3.545 25324 9815 1 14 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.163 0.090 25324 9816 1 14 . 1 1 90 90 TRP C C 90 175.278 175.278 175.109 0.169 25324 9817 1 14 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.372 -0.104 25324 9818 1 14 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.184 -0.225 25324 9819 1 14 . 1 1 90 90 TRP H H 90 9.282 9.282 9.275 0.007 25324 9820 1 14 . 1 1 91 91 ILE N N 91 123.134 123.134 120.869 2.265 25324 9821 1 14 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.059 0.387 25324 9822 1 14 . 1 1 91 91 ILE C C 91 175.489 175.489 175.381 0.108 25324 9823 1 14 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.711 0.115 25324 9824 1 14 . 1 1 91 91 ILE CB C 91 39.676 39.676 39.424 0.252 25324 9825 1 14 . 1 1 91 91 ILE H H 91 9.318 9.318 8.843 0.475 25324 9826 1 14 . 1 1 92 92 LEU N N 92 123.452 123.452 128.730 -5.278 25324 9827 1 14 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.589 0.353 25324 9828 1 14 . 1 1 92 92 LEU C C 92 173.620 173.620 174.212 -0.592 25324 9829 1 14 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.696 -1.440 25324 9830 1 14 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.442 1.066 25324 9831 1 14 . 1 1 92 92 LEU H H 92 8.463 8.463 9.147 -0.684 25324 9832 1 14 . 1 1 93 93 GLY N N 93 103.987 103.987 108.157 -4.170 25324 9833 1 14 . 1 1 93 93 GLY C C 93 172.284 172.284 174.153 -1.869 25324 9834 1 14 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.621 -2.121 25324 9835 1 14 . 1 1 93 93 GLY H H 93 2.937 2.937 6.800 -3.863 25324 9836 1 14 . 1 1 94 94 SER N N 94 110.274 110.274 117.788 -7.514 25324 9837 1 14 . 1 1 94 94 SER HA H 94 4.711 4.711 4.985 -0.274 25324 9838 1 14 . 1 1 94 94 SER C C 94 174.784 174.784 175.564 -0.780 25324 9839 1 14 . 1 1 94 94 SER CA C 94 56.555 56.555 59.129 -2.574 25324 9840 1 14 . 1 1 94 94 SER CB C 94 65.051 65.051 64.615 0.437 25324 9841 1 14 . 1 1 94 94 SER H H 94 7.919 7.919 9.771 -1.852 25324 9842 1 14 . 1 1 95 95 ARG N N 95 123.020 123.020 121.175 1.845 25324 9843 1 14 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.328 0.344 25324 9844 1 14 . 1 1 95 95 ARG C C 95 176.120 176.120 176.173 -0.053 25324 9845 1 14 . 1 1 95 95 ARG CA C 95 55.374 55.374 56.062 -0.688 25324 9846 1 14 . 1 1 95 95 ARG CB C 95 31.848 31.848 30.131 1.717 25324 9847 1 14 . 1 1 95 95 ARG H H 95 9.148 9.148 7.773 1.375 25324 9848 1 14 . 1 1 96 96 GLU N N 96 120.357 120.357 118.687 1.670 25324 9849 1 14 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.115 0.167 25324 9850 1 14 . 1 1 96 96 GLU C C 96 176.278 176.278 176.610 -0.332 25324 9851 1 14 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.850 -2.320 25324 9852 1 14 . 1 1 96 96 GLU CB C 96 30.153 30.153 27.936 2.217 25324 9853 1 14 . 1 1 96 96 GLU H H 96 8.610 8.610 8.691 -0.081 25324 9854 1 14 . 1 1 97 97 ASN N N 97 117.678 117.678 118.615 -0.937 25324 9855 1 14 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.791 -0.179 25324 9856 1 14 . 1 1 97 97 ASN C C 97 173.949 173.949 174.894 -0.945 25324 9857 1 14 . 1 1 97 97 ASN CA C 97 53.015 53.015 53.756 -0.741 25324 9858 1 14 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.489 -0.323 25324 9859 1 14 . 1 1 97 97 ASN H H 97 8.533 8.533 8.198 0.335 25324 9860 1 14 . 1 1 98 98 GLN N N 98 118.592 118.592 118.581 0.011 25324 9861 1 14 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.348 0.012 25324 9862 1 14 . 1 1 98 98 GLN C C 98 173.116 173.116 174.688 -1.572 25324 9863 1 14 . 1 1 98 98 GLN CA C 98 55.628 55.628 56.417 -0.789 25324 9864 1 14 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.611 0.258 25324 9865 1 14 . 1 1 98 98 GLN H H 98 7.663 7.663 7.458 0.205 25324 9866 1 14 . 1 1 99 99 ASN N N 99 122.855 122.855 115.599 7.256 25324 9867 1 14 . 1 1 99 99 ASN HA H 99 5.135 5.135 4.492 0.643 25324 9868 1 14 . 1 1 99 99 ASN C C 99 175.287 175.287 174.372 0.915 25324 9869 1 14 . 1 1 99 99 ASN CA C 99 52.990 52.990 54.398 -1.408 25324 9870 1 14 . 1 1 99 99 ASN CB C 99 40.491 40.491 38.181 2.311 25324 9871 1 14 . 1 1 99 99 ASN H H 99 8.759 8.759 8.166 0.593 25324 9872 1 14 . 1 1 100 100 VAL N N 100 121.385 121.385 120.598 0.787 25324 9873 1 14 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.737 0.011 25324 9874 1 14 . 1 1 100 100 VAL C C 100 174.956 174.956 176.675 -1.719 25324 9875 1 14 . 1 1 100 100 VAL CA C 100 63.843 63.843 64.085 -0.242 25324 9876 1 14 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.683 0.760 25324 9877 1 14 . 1 1 100 100 VAL H H 100 8.717 8.717 8.040 0.677 25324 9878 1 14 . 1 1 101 101 VAL N N 101 112.736 112.736 122.288 -9.552 25324 9879 1 14 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.393 0.252 25324 9880 1 14 . 1 1 101 101 VAL C C 101 175.577 175.577 174.300 1.277 25324 9881 1 14 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.527 -1.564 25324 9882 1 14 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.592 -0.551 25324 9883 1 14 . 1 1 101 101 VAL H H 101 8.802 8.802 8.954 -0.152 25324 9884 1 14 . 1 1 102 102 ALA N N 102 122.104 122.104 120.267 1.837 25324 9885 1 14 . 1 1 102 102 ALA HA H 102 4.807 4.807 4.987 -0.180 25324 9886 1 14 . 1 1 102 102 ALA C C 102 176.046 176.046 174.994 1.052 25324 9887 1 14 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.882 2.373 25324 9888 1 14 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.413 -0.788 25324 9889 1 14 . 1 1 102 102 ALA H H 102 7.677 7.677 7.761 -0.084 25324 9890 1 14 . 1 1 103 103 ILE N N 103 118.218 118.218 120.768 -2.550 25324 9891 1 14 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.440 -0.413 25324 9892 1 14 . 1 1 103 103 ILE C C 103 173.118 173.118 174.001 -0.883 25324 9893 1 14 . 1 1 103 103 ILE CA C 103 62.227 62.227 59.480 2.747 25324 9894 1 14 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.405 1.066 25324 9895 1 14 . 1 1 103 103 ILE H H 103 8.102 8.102 8.419 -0.317 25324 9896 1 14 . 1 1 104 104 ASN N N 104 125.938 125.938 126.863 -0.925 25324 9897 1 14 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.240 0.446 25324 9898 1 14 . 1 1 104 104 ASN C C 104 174.870 174.870 173.518 1.352 25324 9899 1 14 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.404 0.149 25324 9900 1 14 . 1 1 104 104 ASN CB C 104 38.852 38.852 39.962 -1.110 25324 9901 1 14 . 1 1 104 104 ASN H H 104 8.668 8.668 9.163 -0.495 25324 9902 1 14 . 1 1 105 105 VAL N N 105 114.631 114.631 119.467 -4.836 25324 9903 1 14 . 1 1 105 105 VAL HA H 105 5.205 5.205 4.977 0.228 25324 9904 1 14 . 1 1 105 105 VAL C C 105 174.788 174.788 173.485 1.303 25324 9905 1 14 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.363 -2.384 25324 9906 1 14 . 1 1 105 105 VAL CB C 105 36.040 36.040 36.018 0.022 25324 9907 1 14 . 1 1 105 105 VAL H H 105 8.933 8.933 8.857 0.076 25324 9908 1 14 . 1 1 106 106 GLU N N 106 118.347 118.347 126.866 -8.519 25324 9909 1 14 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.235 -0.155 25324 9910 1 14 . 1 1 106 106 GLU C C 106 174.777 174.777 175.053 -0.276 25324 9911 1 14 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.544 -0.577 25324 9912 1 14 . 1 1 106 106 GLU CB C 106 33.643 33.643 31.865 1.778 25324 9913 1 14 . 1 1 106 106 GLU H H 106 8.814 8.814 8.585 0.229 25324 9914 1 14 . 1 1 107 107 SER N N 107 115.335 115.335 120.562 -5.227 25324 9915 1 14 . 1 1 107 107 SER HA H 107 5.266 5.266 4.851 0.415 25324 9916 1 14 . 1 1 107 107 SER C C 107 175.787 175.787 172.576 3.211 25324 9917 1 14 . 1 1 107 107 SER CA C 107 55.888 55.888 57.971 -2.083 25324 9918 1 14 . 1 1 107 107 SER CB C 107 65.921 65.921 67.105 -1.184 25324 9919 1 14 . 1 1 107 107 SER H H 107 8.576 8.576 9.417 -0.841 25324 9920 1 14 . 1 1 108 108 GLY N N 108 117.567 117.567 108.924 8.643 25324 9921 1 14 . 1 1 108 108 GLY C C 108 173.959 173.959 174.079 -0.120 25324 9922 1 14 . 1 1 108 108 GLY CA C 108 44.677 44.677 44.900 -0.223 25324 9923 1 14 . 1 1 108 108 GLY H H 108 9.532 9.532 8.450 1.082 25324 9924 1 14 . 1 1 109 109 ASP N N 109 122.108 122.108 122.055 0.053 25324 9925 1 14 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.460 0.341 25324 9926 1 14 . 1 1 109 109 ASP C C 109 176.203 176.203 176.646 -0.443 25324 9927 1 14 . 1 1 109 109 ASP CA C 109 52.134 52.134 56.240 -4.106 25324 9928 1 14 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.229 -1.887 25324 9929 1 14 . 1 1 109 109 ASP H H 109 8.605 8.605 8.628 -0.023 25324 9930 1 14 . 1 1 110 110 ASP N N 110 116.197 116.197 117.422 -1.225 25324 9931 1 14 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.684 -0.462 25324 9932 1 14 . 1 1 110 110 ASP C C 110 175.951 175.951 175.629 0.322 25324 9933 1 14 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.160 2.038 25324 9934 1 14 . 1 1 110 110 ASP CB C 110 38.630 38.630 41.105 -2.475 25324 9935 1 14 . 1 1 110 110 ASP H H 110 9.087 9.087 7.843 1.244 25324 9936 1 14 . 1 1 111 111 GLY N N 111 103.841 103.841 108.166 -4.325 25324 9937 1 14 . 1 1 111 111 GLY C C 111 173.924 173.924 175.367 -1.443 25324 9938 1 14 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.717 -0.554 25324 9939 1 14 . 1 1 111 111 GLY H H 111 8.930 8.930 8.309 0.621 25324 9940 1 14 . 1 1 112 112 GLN N N 112 121.626 121.626 117.385 4.241 25324 9941 1 14 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.037 0.033 25324 9942 1 14 . 1 1 112 112 GLN C C 112 176.431 176.431 175.533 0.898 25324 9943 1 14 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.404 -0.131 25324 9944 1 14 . 1 1 112 112 GLN CB C 112 27.693 27.693 28.945 -1.252 25324 9945 1 14 . 1 1 112 112 GLN H H 112 7.351 7.351 8.575 -1.224 25324 9946 1 14 . 1 1 113 113 THR N N 113 112.322 112.322 106.799 5.523 25324 9947 1 14 . 1 1 113 113 THR HA H 113 5.331 5.331 5.341 -0.010 25324 9948 1 14 . 1 1 113 113 THR C C 113 174.452 174.452 173.381 1.071 25324 9949 1 14 . 1 1 113 113 THR CA C 113 59.739 59.739 59.208 0.531 25324 9950 1 14 . 1 1 113 113 THR CB C 113 71.773 71.773 71.672 0.101 25324 9951 1 14 . 1 1 113 113 THR H H 113 10.053 10.053 7.558 2.495 25324 9952 1 14 . 1 1 114 114 LEU N N 114 122.083 122.083 123.607 -1.524 25324 9953 1 14 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.771 -0.190 25324 9954 1 14 . 1 1 114 114 LEU C C 114 175.113 175.113 175.009 0.104 25324 9955 1 14 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.465 -0.561 25324 9956 1 14 . 1 1 114 114 LEU CB C 114 47.033 47.033 44.529 2.504 25324 9957 1 14 . 1 1 114 114 LEU H H 114 8.978 8.978 8.913 0.065 25324 9958 1 14 . 1 1 115 115 ASN N N 115 118.846 118.846 121.445 -2.599 25324 9959 1 14 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.984 -0.214 25324 9960 1 14 . 1 1 115 115 ASN C C 115 174.788 174.788 175.037 -0.249 25324 9961 1 14 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.825 0.517 25324 9962 1 14 . 1 1 115 115 ASN CB C 115 43.414 43.414 43.139 0.275 25324 9963 1 14 . 1 1 115 115 ASN H H 115 8.837 8.837 8.869 -0.032 25324 9964 1 14 . 1 1 116 116 GLY N N 116 109.661 109.661 108.779 0.882 25324 9965 1 14 . 1 1 116 116 GLY C C 116 172.452 172.452 172.541 -0.089 25324 9966 1 14 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.268 0.203 25324 9967 1 14 . 1 1 116 116 GLY H H 116 8.625 8.625 8.944 -0.319 25324 9968 1 14 . 1 1 117 117 THR N N 117 120.009 120.009 114.801 5.208 25324 9969 1 14 . 1 1 117 117 THR HA H 117 5.556 5.556 5.776 -0.220 25324 9970 1 14 . 1 1 117 117 THR C C 117 171.619 171.619 173.492 -1.873 25324 9971 1 14 . 1 1 117 117 THR CA C 117 59.373 59.373 60.032 -0.659 25324 9972 1 14 . 1 1 117 117 THR CB C 117 72.777 72.777 72.724 0.053 25324 9973 1 14 . 1 1 117 117 THR H H 117 8.911 8.911 9.067 -0.156 25324 9974 1 14 . 1 1 118 118 MET N N 118 115.550 115.550 117.694 -2.144 25324 9975 1 14 . 1 1 118 118 MET HA H 118 4.889 4.889 5.263 -0.374 25324 9976 1 14 . 1 1 118 118 MET C C 118 172.707 172.707 174.145 -1.438 25324 9977 1 14 . 1 1 118 118 MET CA C 118 54.714 54.714 54.588 0.126 25324 9978 1 14 . 1 1 118 118 MET CB C 118 33.663 33.663 37.468 -3.805 25324 9979 1 14 . 1 1 118 118 MET H H 118 9.159 9.159 9.387 -0.228 25324 9980 1 14 . 1 1 119 119 THR N N 119 113.716 113.716 116.055 -2.339 25324 9981 1 14 . 1 1 119 119 THR HA H 119 4.682 4.682 4.909 -0.227 25324 9982 1 14 . 1 1 119 119 THR C C 119 173.952 173.952 173.360 0.592 25324 9983 1 14 . 1 1 119 119 THR CA C 119 61.395 61.395 61.469 -0.074 25324 9984 1 14 . 1 1 119 119 THR CB C 119 71.746 71.746 71.928 -0.182 25324 9985 1 14 . 1 1 119 119 THR H H 119 8.685 8.685 8.698 -0.013 25324 9986 1 14 . 1 1 120 120 TYR N N 120 129.153 129.153 125.406 3.747 25324 9987 1 14 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.938 -0.138 25324 9988 1 14 . 1 1 120 120 TYR C C 120 175.214 175.214 175.973 -0.759 25324 9989 1 14 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.704 1.173 25324 9990 1 14 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.526 -0.025 25324 9991 1 14 . 1 1 120 120 TYR H H 120 10.107 10.107 8.885 1.222 25324 9992 1 14 . 1 1 121 121 ALA N N 121 119.947 119.947 123.713 -3.766 25324 9993 1 14 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.313 -0.309 25324 9994 1 14 . 1 1 121 121 ALA C C 121 178.456 178.456 177.771 0.685 25324 9995 1 14 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.733 0.223 25324 9996 1 14 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.927 -0.217 25324 9997 1 14 . 1 1 121 121 ALA H H 121 8.704 8.704 8.290 0.414 25324 9998 1 14 . 1 1 122 122 GLY N N 122 111.186 111.186 111.077 0.109 25324 9999 1 14 . 1 1 122 122 GLY C C 122 173.949 173.949 174.349 -0.400 25324 10000 1 14 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.721 -0.719 25324 10001 1 14 . 1 1 122 122 GLY H H 122 8.792 8.792 8.724 0.068 25324 10002 1 14 . 1 1 123 123 GLU N N 123 120.099 120.099 119.434 0.665 25324 10003 1 14 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.707 -0.002 25324 10004 1 14 . 1 1 123 123 GLU C C 123 175.912 175.912 175.867 0.045 25324 10005 1 14 . 1 1 123 123 GLU CA C 123 54.414 54.414 55.092 -0.677 25324 10006 1 14 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.525 0.259 25324 10007 1 14 . 1 1 123 123 GLU H H 123 8.072 8.072 7.871 0.201 25324 10008 1 14 . 1 1 124 124 GLY N N 124 105.303 105.303 108.167 -2.864 25324 10009 1 14 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.425 0.377 25324 10010 1 14 . 1 1 124 124 GLY H H 124 7.939 7.939 8.346 -0.407 25324 10011 1 14 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.856 0.079 25324 10012 1 14 . 1 1 125 125 PRO C C 125 177.788 177.788 176.517 1.271 25324 10013 1 14 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.125 0.006 25324 10014 1 14 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.250 -0.391 25324 10015 1 14 . 1 1 126 126 ILE N N 126 117.387 117.387 118.342 -0.955 25324 10016 1 14 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.705 0.194 25324 10017 1 14 . 1 1 126 126 ILE C C 126 175.625 175.625 174.987 0.638 25324 10018 1 14 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.099 0.354 25324 10019 1 14 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.745 0.803 25324 10020 1 14 . 1 1 126 126 ILE H H 126 9.599 9.599 8.944 0.655 25324 10021 1 14 . 1 1 127 127 GLY N N 127 106.753 106.753 108.078 -1.325 25324 10022 1 14 . 1 1 127 127 GLY C C 127 173.627 173.627 172.855 0.772 25324 10023 1 14 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.605 1.678 25324 10024 1 14 . 1 1 127 127 GLY H H 127 8.840 8.840 8.814 0.026 25324 10025 1 14 . 1 1 128 128 PHE N N 128 124.826 124.826 126.770 -1.944 25324 10026 1 14 . 1 1 128 128 PHE HA H 128 4.944 4.944 4.829 0.115 25324 10027 1 14 . 1 1 128 128 PHE C C 128 173.087 173.087 173.172 -0.085 25324 10028 1 14 . 1 1 128 128 PHE CA C 128 57.009 57.009 57.243 -0.234 25324 10029 1 14 . 1 1 128 128 PHE CB C 128 43.160 43.160 42.907 0.253 25324 10030 1 14 . 1 1 128 128 PHE H H 128 8.924 8.924 9.246 -0.322 25324 10031 1 14 . 1 1 129 129 LYS N N 129 131.518 131.518 128.637 2.881 25324 10032 1 14 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.723 0.160 25324 10033 1 14 . 1 1 129 129 LYS C C 129 173.863 173.863 174.107 -0.244 25324 10034 1 14 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.542 1.193 25324 10035 1 14 . 1 1 129 129 LYS CB C 129 34.721 34.721 34.883 -0.161 25324 10036 1 14 . 1 1 129 129 LYS H H 129 8.201 8.201 8.438 -0.237 25324 10037 1 14 . 1 1 130 130 GLY N N 130 114.030 114.030 113.631 0.399 25324 10038 1 14 . 1 1 130 130 GLY C C 130 171.951 171.951 172.710 -0.759 25324 10039 1 14 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.693 0.094 25324 10040 1 14 . 1 1 130 130 GLY H H 130 9.325 9.325 8.765 0.560 25324 10041 1 14 . 1 1 131 131 THR N N 131 120.583 120.583 121.955 -1.372 25324 10042 1 14 . 1 1 131 131 THR HA H 131 4.939 4.939 4.936 0.003 25324 10043 1 14 . 1 1 131 131 THR C C 131 173.118 173.118 174.133 -1.015 25324 10044 1 14 . 1 1 131 131 THR CA C 131 61.266 61.266 61.224 0.042 25324 10045 1 14 . 1 1 131 131 THR CB C 131 70.392 70.392 72.305 -1.913 25324 10046 1 14 . 1 1 131 131 THR H H 131 8.916 8.916 9.016 -0.100 25324 10047 1 14 . 1 1 132 132 LEU N N 132 130.774 130.774 128.008 2.766 25324 10048 1 14 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.857 -0.357 25324 10049 1 14 . 1 1 132 132 LEU C C 132 176.574 176.574 177.194 -0.620 25324 10050 1 14 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.981 0.206 25324 10051 1 14 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.771 0.676 25324 10052 1 14 . 1 1 132 132 LEU H H 132 8.527 8.527 8.436 0.091 25324 10053 1 15 . 1 1 3 3 LEU N N 3 123.202 123.202 122.165 1.037 25324 10054 1 15 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.260 -0.103 25324 10055 1 15 . 1 1 3 3 LEU C C 3 175.786 175.786 175.095 0.691 25324 10056 1 15 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.644 0.640 25324 10057 1 15 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.836 -0.506 25324 10058 1 15 . 1 1 3 3 LEU H H 3 8.711 8.711 8.495 0.216 25324 10059 1 15 . 1 1 4 4 TYR N N 4 120.906 120.906 124.579 -3.673 25324 10060 1 15 . 1 1 4 4 TYR HA H 4 5.024 5.024 4.939 0.085 25324 10061 1 15 . 1 1 4 4 TYR C C 4 175.953 175.953 175.161 0.792 25324 10062 1 15 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.272 0.105 25324 10063 1 15 . 1 1 4 4 TYR CB C 4 41.655 41.655 41.903 -0.248 25324 10064 1 15 . 1 1 4 4 TYR H H 4 9.142 9.142 9.581 -0.439 25324 10065 1 15 . 1 1 5 5 ASN N N 5 120.496 120.496 120.110 0.386 25324 10066 1 15 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.786 0.330 25324 10067 1 15 . 1 1 5 5 ASN C C 5 174.953 174.953 173.971 0.982 25324 10068 1 15 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.932 -0.985 25324 10069 1 15 . 1 1 5 5 ASN CB C 5 38.891 38.891 39.805 -0.914 25324 10070 1 15 . 1 1 5 5 ASN H H 5 8.787 8.787 8.961 -0.174 25324 10071 1 15 . 1 1 6 6 VAL N N 6 127.428 127.428 122.403 5.025 25324 10072 1 15 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.317 0.045 25324 10073 1 15 . 1 1 6 6 VAL C C 6 174.955 174.955 174.653 0.302 25324 10074 1 15 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.737 -0.304 25324 10075 1 15 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.226 0.105 25324 10076 1 15 . 1 1 6 6 VAL H H 6 8.806 8.806 7.934 0.872 25324 10077 1 15 . 1 1 7 7 GLU N N 7 124.355 124.355 126.795 -2.440 25324 10078 1 15 . 1 1 7 7 GLU HA H 7 4.982 4.982 5.180 -0.198 25324 10079 1 15 . 1 1 7 7 GLU C C 7 174.551 174.551 175.103 -0.552 25324 10080 1 15 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.791 -1.002 25324 10081 1 15 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.395 1.172 25324 10082 1 15 . 1 1 7 7 GLU H H 7 8.800 8.800 9.241 -0.441 25324 10083 1 15 . 1 1 8 8 ASN N N 8 116.231 116.231 122.315 -6.084 25324 10084 1 15 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.909 0.132 25324 10085 1 15 . 1 1 8 8 ASN C C 8 172.709 172.709 173.617 -0.908 25324 10086 1 15 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.554 -0.937 25324 10087 1 15 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.030 2.555 25324 10088 1 15 . 1 1 8 8 ASN H H 8 9.320 9.320 9.511 -0.191 25324 10089 1 15 . 1 1 9 9 GLN N N 9 120.762 120.762 122.047 -1.285 25324 10090 1 15 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.866 -0.692 25324 10091 1 15 . 1 1 9 9 GLN C C 9 173.454 173.454 174.463 -1.009 25324 10092 1 15 . 1 1 9 9 GLN CA C 9 53.960 53.960 53.741 0.219 25324 10093 1 15 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.483 -0.792 25324 10094 1 15 . 1 1 9 9 GLN H H 9 6.887 6.887 8.690 -1.803 25324 10095 1 15 . 1 1 10 10 TRP N N 10 127.775 127.775 127.597 0.178 25324 10096 1 15 . 1 1 10 10 TRP HA H 10 4.988 4.988 4.586 0.402 25324 10097 1 15 . 1 1 10 10 TRP C C 10 175.281 175.281 177.415 -2.134 25324 10098 1 15 . 1 1 10 10 TRP CA C 10 56.293 56.293 58.844 -2.551 25324 10099 1 15 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.880 -1.138 25324 10100 1 15 . 1 1 10 10 TRP H H 10 8.518 8.518 9.278 -0.760 25324 10101 1 15 . 1 1 11 11 GLY N N 11 107.838 107.838 110.591 -2.753 25324 10102 1 15 . 1 1 11 11 GLY C C 11 174.733 174.733 174.659 0.074 25324 10103 1 15 . 1 1 11 11 GLY CA C 11 44.836 44.836 45.143 -0.307 25324 10104 1 15 . 1 1 11 11 GLY H H 11 8.461 8.461 8.939 -0.478 25324 10105 1 15 . 1 1 12 12 GLY N N 12 109.696 109.696 109.083 0.613 25324 10106 1 15 . 1 1 12 12 GLY C C 12 174.133 174.133 173.972 0.161 25324 10107 1 15 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.955 -1.166 25324 10108 1 15 . 1 1 12 12 GLY H H 12 8.138 8.138 7.946 0.192 25324 10109 1 15 . 1 1 13 13 SER N N 13 111.308 111.308 114.092 -2.784 25324 10110 1 15 . 1 1 13 13 SER HA H 13 4.092 4.092 4.496 -0.404 25324 10111 1 15 . 1 1 13 13 SER C C 13 175.622 175.622 173.969 1.653 25324 10112 1 15 . 1 1 13 13 SER CA C 13 60.494 60.494 57.287 3.207 25324 10113 1 15 . 1 1 13 13 SER CB C 13 63.028 63.028 65.421 -2.393 25324 10114 1 15 . 1 1 13 13 SER H H 13 8.215 8.215 7.282 0.933 25324 10115 1 15 . 1 1 14 14 SER N N 14 115.290 115.290 116.265 -0.975 25324 10116 1 15 . 1 1 14 14 SER HA H 14 4.566 4.566 4.183 0.383 25324 10117 1 15 . 1 1 14 14 SER C C 14 173.532 173.532 173.385 0.147 25324 10118 1 15 . 1 1 14 14 SER CA C 14 57.317 57.317 58.756 -1.439 25324 10119 1 15 . 1 1 14 14 SER CB C 14 63.230 63.230 62.085 1.145 25324 10120 1 15 . 1 1 14 14 SER H H 14 8.213 8.213 8.458 -0.245 25324 10121 1 15 . 1 1 15 15 ALA N N 15 126.470 126.470 122.671 3.799 25324 10122 1 15 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.550 -0.147 25324 10123 1 15 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.530 -0.066 25324 10124 1 15 . 1 1 15 15 ALA CB C 15 18.229 18.229 19.981 -1.752 25324 10125 1 15 . 1 1 15 15 ALA H H 15 7.308 7.308 7.598 -0.290 25324 10126 1 15 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.453 -0.044 25324 10127 1 15 . 1 1 16 16 PRO C C 16 175.627 175.627 175.930 -0.303 25324 10128 1 15 . 1 1 16 16 PRO CA C 16 62.392 62.392 61.994 0.398 25324 10129 1 15 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.505 -0.368 25324 10130 1 15 . 1 1 17 17 TRP N N 17 120.228 120.228 120.886 -0.658 25324 10131 1 15 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.853 -0.535 25324 10132 1 15 . 1 1 17 17 TRP C C 17 175.951 175.951 176.388 -0.437 25324 10133 1 15 . 1 1 17 17 TRP CA C 17 56.915 56.915 57.182 -0.267 25324 10134 1 15 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.479 -1.070 25324 10135 1 15 . 1 1 17 17 TRP H H 17 8.380 8.380 8.287 0.093 25324 10136 1 15 . 1 1 18 18 ASN N N 18 120.663 120.663 122.264 -1.601 25324 10137 1 15 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.175 -0.089 25324 10138 1 15 . 1 1 18 18 ASN C C 18 174.793 174.793 174.139 0.654 25324 10139 1 15 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.217 -0.616 25324 10140 1 15 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.970 1.678 25324 10141 1 15 . 1 1 18 18 ASN H H 18 9.094 9.094 9.412 -0.318 25324 10142 1 15 . 1 1 19 19 GLU N N 19 122.202 122.202 123.159 -0.957 25324 10143 1 15 . 1 1 19 19 GLU HA H 19 4.139 4.139 5.117 -0.978 25324 10144 1 15 . 1 1 19 19 GLU C C 19 176.869 176.869 176.502 0.367 25324 10145 1 15 . 1 1 19 19 GLU CA C 19 58.600 58.600 55.418 3.182 25324 10146 1 15 . 1 1 19 19 GLU CB C 19 29.382 29.382 30.870 -1.488 25324 10147 1 15 . 1 1 19 19 GLU H H 19 9.013 9.013 8.833 0.180 25324 10148 1 15 . 1 1 20 20 GLY N N 20 112.893 112.893 112.767 0.126 25324 10149 1 15 . 1 1 20 20 GLY C C 20 174.878 174.878 173.173 1.705 25324 10150 1 15 . 1 1 20 20 GLY CA C 20 44.995 44.995 45.468 -0.472 25324 10151 1 15 . 1 1 20 20 GLY H H 20 8.926 8.926 8.748 0.178 25324 10152 1 15 . 1 1 21 21 GLY N N 21 110.354 110.354 107.498 2.856 25324 10153 1 15 . 1 1 21 21 GLY C C 21 171.623 171.623 171.886 -0.263 25324 10154 1 15 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.692 -1.294 25324 10155 1 15 . 1 1 21 21 GLY H H 21 8.258 8.258 7.882 0.376 25324 10156 1 15 . 1 1 22 22 GLN N N 22 117.541 117.541 117.154 0.387 25324 10157 1 15 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.859 0.818 25324 10158 1 15 . 1 1 22 22 GLN C C 22 175.957 175.957 174.138 1.819 25324 10159 1 15 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.872 0.072 25324 10160 1 15 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.362 -1.277 25324 10161 1 15 . 1 1 22 22 GLN H H 22 8.564 8.564 8.526 0.038 25324 10162 1 15 . 1 1 23 23 TRP N N 23 127.208 127.208 122.548 4.660 25324 10163 1 15 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.090 0.109 25324 10164 1 15 . 1 1 23 23 TRP CA C 23 54.531 54.531 53.974 0.556 25324 10165 1 15 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.434 -0.752 25324 10166 1 15 . 1 1 23 23 TRP H H 23 9.347 9.347 8.901 0.446 25324 10167 1 15 . 1 1 24 24 GLU N N 24 123.504 123.504 121.745 1.759 25324 10168 1 15 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.487 0.021 25324 10169 1 15 . 1 1 24 24 GLU C C 24 174.222 174.222 175.358 -1.136 25324 10170 1 15 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.025 0.566 25324 10171 1 15 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.546 -1.931 25324 10172 1 15 . 1 1 24 24 GLU H H 24 9.296 9.296 8.598 0.698 25324 10173 1 15 . 1 1 25 25 ILE N N 25 123.447 123.447 127.009 -3.562 25324 10174 1 15 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.195 0.241 25324 10175 1 15 . 1 1 25 25 ILE C C 25 175.790 175.790 174.506 1.284 25324 10176 1 15 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.002 -0.375 25324 10177 1 15 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.592 0.360 25324 10178 1 15 . 1 1 25 25 ILE H H 25 8.635 8.635 8.889 -0.254 25324 10179 1 15 . 1 1 26 26 GLY N N 26 111.544 111.544 113.433 -1.889 25324 10180 1 15 . 1 1 26 26 GLY C C 26 172.122 172.122 175.524 -3.402 25324 10181 1 15 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.911 -0.834 25324 10182 1 15 . 1 1 26 26 GLY H H 26 3.381 3.381 7.816 -4.435 25324 10183 1 15 . 1 1 27 27 SER N N 27 112.279 112.279 114.859 -2.580 25324 10184 1 15 . 1 1 27 27 SER HA H 27 4.876 4.876 4.156 0.720 25324 10185 1 15 . 1 1 27 27 SER C C 27 174.113 174.113 176.218 -2.105 25324 10186 1 15 . 1 1 27 27 SER CA C 27 56.954 56.954 61.072 -4.118 25324 10187 1 15 . 1 1 27 27 SER CB C 27 64.554 64.554 63.148 1.407 25324 10188 1 15 . 1 1 27 27 SER H H 27 8.212 8.212 8.589 -0.377 25324 10189 1 15 . 1 1 28 28 ARG N N 28 120.872 120.872 121.555 -0.683 25324 10190 1 15 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.183 0.580 25324 10191 1 15 . 1 1 28 28 ARG C C 28 176.119 176.119 177.302 -1.183 25324 10192 1 15 . 1 1 28 28 ARG CA C 28 55.117 55.117 58.333 -3.216 25324 10193 1 15 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.461 1.369 25324 10194 1 15 . 1 1 28 28 ARG H H 28 7.849 7.849 8.801 -0.952 25324 10195 1 15 . 1 1 29 29 SER N N 29 118.985 118.985 110.885 8.100 25324 10196 1 15 . 1 1 29 29 SER HA H 29 4.192 4.192 4.261 -0.069 25324 10197 1 15 . 1 1 29 29 SER C C 29 174.622 174.622 174.077 0.545 25324 10198 1 15 . 1 1 29 29 SER CA C 29 60.072 60.072 59.886 0.186 25324 10199 1 15 . 1 1 29 29 SER CB C 29 62.876 62.876 61.728 1.148 25324 10200 1 15 . 1 1 29 29 SER H H 29 8.892 8.892 8.778 0.114 25324 10201 1 15 . 1 1 30 30 ASP N N 30 117.632 117.632 120.444 -2.812 25324 10202 1 15 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.534 0.084 25324 10203 1 15 . 1 1 30 30 ASP C C 30 175.101 175.101 175.848 -0.747 25324 10204 1 15 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.623 -2.571 25324 10205 1 15 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.170 -0.647 25324 10206 1 15 . 1 1 30 30 ASP H H 30 8.441 8.441 8.121 0.320 25324 10207 1 15 . 1 1 31 31 GLN N N 31 118.273 118.273 117.751 0.522 25324 10208 1 15 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.468 0.017 25324 10209 1 15 . 1 1 31 31 GLN C C 31 173.453 173.453 174.181 -0.728 25324 10210 1 15 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.996 -0.128 25324 10211 1 15 . 1 1 31 31 GLN CB C 31 33.249 33.249 31.292 1.957 25324 10212 1 15 . 1 1 31 31 GLN H H 31 7.029 7.029 7.674 -0.645 25324 10213 1 15 . 1 1 32 32 ASN N N 32 120.865 120.865 120.340 0.525 25324 10214 1 15 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.929 0.191 25324 10215 1 15 . 1 1 32 32 ASN C C 32 175.198 175.198 174.947 0.251 25324 10216 1 15 . 1 1 32 32 ASN CA C 32 51.869 51.869 53.166 -1.296 25324 10217 1 15 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.103 -0.473 25324 10218 1 15 . 1 1 32 32 ASN H H 32 8.713 8.713 8.619 0.094 25324 10219 1 15 . 1 1 33 33 VAL N N 33 122.111 122.111 121.405 0.706 25324 10220 1 15 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.034 -0.329 25324 10221 1 15 . 1 1 33 33 VAL C C 33 174.950 174.950 176.325 -1.375 25324 10222 1 15 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.700 1.147 25324 10223 1 15 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.910 0.440 25324 10224 1 15 . 1 1 33 33 VAL H H 33 8.542 8.542 8.570 -0.028 25324 10225 1 15 . 1 1 34 34 VAL N N 34 113.282 113.282 121.518 -8.236 25324 10226 1 15 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.375 0.270 25324 10227 1 15 . 1 1 34 34 VAL C C 34 175.574 175.574 175.261 0.313 25324 10228 1 15 . 1 1 34 34 VAL CA C 34 59.974 59.974 62.035 -2.061 25324 10229 1 15 . 1 1 34 34 VAL CB C 34 33.029 33.029 32.771 0.258 25324 10230 1 15 . 1 1 34 34 VAL H H 34 8.744 8.744 8.847 -0.103 25324 10231 1 15 . 1 1 35 35 ALA N N 35 122.102 122.102 121.618 0.484 25324 10232 1 15 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.230 -0.427 25324 10233 1 15 . 1 1 35 35 ALA C C 35 175.947 175.947 175.066 0.881 25324 10234 1 15 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.454 2.796 25324 10235 1 15 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.480 -0.852 25324 10236 1 15 . 1 1 35 35 ALA H H 35 7.677 7.677 7.845 -0.168 25324 10237 1 15 . 1 1 36 36 ILE N N 36 118.005 118.005 121.073 -3.068 25324 10238 1 15 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.341 -0.313 25324 10239 1 15 . 1 1 36 36 ILE C C 36 173.116 173.116 173.884 -0.768 25324 10240 1 15 . 1 1 36 36 ILE CA C 36 62.182 62.182 60.845 1.337 25324 10241 1 15 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.478 1.007 25324 10242 1 15 . 1 1 36 36 ILE H H 36 8.126 8.126 8.986 -0.860 25324 10243 1 15 . 1 1 37 37 ASN N N 37 125.632 125.632 126.231 -0.599 25324 10244 1 15 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.935 -0.254 25324 10245 1 15 . 1 1 37 37 ASN C C 37 174.854 174.854 174.007 0.847 25324 10246 1 15 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.505 0.025 25324 10247 1 15 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.010 -2.156 25324 10248 1 15 . 1 1 37 37 ASN H H 37 8.577 8.577 8.852 -0.275 25324 10249 1 15 . 1 1 38 38 VAL N N 38 114.223 114.223 116.655 -2.432 25324 10250 1 15 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.943 0.260 25324 10251 1 15 . 1 1 38 38 VAL C C 38 174.854 174.854 173.442 1.412 25324 10252 1 15 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.722 -1.742 25324 10253 1 15 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.764 0.280 25324 10254 1 15 . 1 1 38 38 VAL H H 38 8.874 8.874 8.700 0.174 25324 10255 1 15 . 1 1 39 39 GLU N N 39 118.277 118.277 122.438 -4.161 25324 10256 1 15 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.387 -0.305 25324 10257 1 15 . 1 1 39 39 GLU C C 39 174.548 174.548 175.498 -0.950 25324 10258 1 15 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.029 0.964 25324 10259 1 15 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.610 -1.032 25324 10260 1 15 . 1 1 39 39 GLU H H 39 8.761 8.761 9.265 -0.504 25324 10261 1 15 . 1 1 40 40 SER N N 40 114.960 114.960 120.133 -5.173 25324 10262 1 15 . 1 1 40 40 SER HA H 40 5.265 5.265 5.115 0.150 25324 10263 1 15 . 1 1 40 40 SER C C 40 175.783 175.783 175.319 0.464 25324 10264 1 15 . 1 1 40 40 SER CA C 40 55.880 55.880 57.211 -1.331 25324 10265 1 15 . 1 1 40 40 SER CB C 40 65.911 65.911 63.755 2.156 25324 10266 1 15 . 1 1 40 40 SER H H 40 8.500 8.500 8.686 -0.186 25324 10267 1 15 . 1 1 41 41 GLY N N 41 117.567 117.567 108.689 8.878 25324 10268 1 15 . 1 1 41 41 GLY C C 41 174.119 174.119 174.388 -0.269 25324 10269 1 15 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.253 -0.565 25324 10270 1 15 . 1 1 41 41 GLY H H 41 9.533 9.533 8.407 1.126 25324 10271 1 15 . 1 1 42 42 ASP N N 42 122.141 122.141 119.729 2.412 25324 10272 1 15 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.874 -0.074 25324 10273 1 15 . 1 1 42 42 ASP C C 42 176.121 176.121 175.893 0.228 25324 10274 1 15 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.220 -1.074 25324 10275 1 15 . 1 1 42 42 ASP CB C 42 39.354 39.354 43.241 -3.887 25324 10276 1 15 . 1 1 42 42 ASP H H 42 8.644 8.644 7.650 0.994 25324 10277 1 15 . 1 1 43 43 ASP N N 43 116.025 116.025 120.337 -4.312 25324 10278 1 15 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.496 -0.267 25324 10279 1 15 . 1 1 43 43 ASP C C 43 176.018 176.018 176.578 -0.560 25324 10280 1 15 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.322 0.927 25324 10281 1 15 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.538 0.021 25324 10282 1 15 . 1 1 43 43 ASP H H 43 9.111 9.111 8.723 0.388 25324 10283 1 15 . 1 1 44 44 GLY N N 44 104.263 104.263 108.894 -4.631 25324 10284 1 15 . 1 1 44 44 GLY C C 44 173.922 173.922 175.456 -1.534 25324 10285 1 15 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.909 -0.608 25324 10286 1 15 . 1 1 44 44 GLY H H 44 9.063 9.063 8.181 0.882 25324 10287 1 15 . 1 1 45 45 GLN N N 45 121.691 121.691 118.251 3.440 25324 10288 1 15 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.271 -0.185 25324 10289 1 15 . 1 1 45 45 GLN C C 45 176.284 176.284 175.439 0.845 25324 10290 1 15 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.141 -0.022 25324 10291 1 15 . 1 1 45 45 GLN CB C 45 27.674 27.674 28.803 -1.129 25324 10292 1 15 . 1 1 45 45 GLN H H 45 7.356 7.356 8.711 -1.355 25324 10293 1 15 . 1 1 46 46 THR N N 46 111.843 111.843 109.860 1.983 25324 10294 1 15 . 1 1 46 46 THR HA H 46 5.355 5.355 5.231 0.124 25324 10295 1 15 . 1 1 46 46 THR C C 46 174.451 174.451 173.531 0.920 25324 10296 1 15 . 1 1 46 46 THR CA C 46 59.644 59.644 60.244 -0.600 25324 10297 1 15 . 1 1 46 46 THR CB C 46 72.714 72.714 70.445 2.269 25324 10298 1 15 . 1 1 46 46 THR H H 46 10.123 10.123 7.668 2.455 25324 10299 1 15 . 1 1 47 47 LEU N N 47 119.302 119.302 126.256 -6.954 25324 10300 1 15 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.642 0.165 25324 10301 1 15 . 1 1 47 47 LEU C C 47 175.487 175.487 174.855 0.632 25324 10302 1 15 . 1 1 47 47 LEU CA C 47 53.070 53.070 54.047 -0.977 25324 10303 1 15 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.534 3.469 25324 10304 1 15 . 1 1 47 47 LEU H H 47 8.364 8.364 8.732 -0.368 25324 10305 1 15 . 1 1 48 48 ASN N N 48 116.844 116.844 120.542 -3.698 25324 10306 1 15 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.894 -0.165 25324 10307 1 15 . 1 1 48 48 ASN C C 48 174.460 174.460 174.847 -0.387 25324 10308 1 15 . 1 1 48 48 ASN CA C 48 52.739 52.739 52.093 0.646 25324 10309 1 15 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.487 0.926 25324 10310 1 15 . 1 1 48 48 ASN H H 48 8.748 8.748 8.891 -0.143 25324 10311 1 15 . 1 1 49 49 GLY N N 49 109.417 109.417 109.729 -0.312 25324 10312 1 15 . 1 1 49 49 GLY C C 49 172.126 172.126 172.098 0.028 25324 10313 1 15 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.234 0.257 25324 10314 1 15 . 1 1 49 49 GLY H H 49 8.744 8.744 9.022 -0.278 25324 10315 1 15 . 1 1 50 50 THR N N 50 119.162 119.162 117.336 1.826 25324 10316 1 15 . 1 1 50 50 THR HA H 50 5.556 5.556 5.542 0.014 25324 10317 1 15 . 1 1 50 50 THR C C 50 171.790 171.790 173.498 -1.708 25324 10318 1 15 . 1 1 50 50 THR CA C 50 59.371 59.371 61.816 -2.445 25324 10319 1 15 . 1 1 50 50 THR CB C 50 72.799 72.799 71.951 0.848 25324 10320 1 15 . 1 1 50 50 THR H H 50 8.799 8.799 8.862 -0.063 25324 10321 1 15 . 1 1 51 51 MET N N 51 115.232 115.232 124.839 -9.607 25324 10322 1 15 . 1 1 51 51 MET HA H 51 4.886 4.886 5.007 -0.121 25324 10323 1 15 . 1 1 51 51 MET C C 51 172.708 172.708 174.985 -2.277 25324 10324 1 15 . 1 1 51 51 MET CA C 51 54.722 54.722 54.811 -0.089 25324 10325 1 15 . 1 1 51 51 MET CB C 51 34.557 34.557 36.785 -2.228 25324 10326 1 15 . 1 1 51 51 MET H H 51 9.062 9.062 9.200 -0.138 25324 10327 1 15 . 1 1 52 52 THR N N 52 113.697 113.697 116.953 -3.256 25324 10328 1 15 . 1 1 52 52 THR HA H 52 4.682 4.682 4.841 -0.159 25324 10329 1 15 . 1 1 52 52 THR C C 52 173.952 173.952 173.654 0.298 25324 10330 1 15 . 1 1 52 52 THR CA C 52 61.395 61.395 61.624 -0.229 25324 10331 1 15 . 1 1 52 52 THR CB C 52 71.734 71.734 70.749 0.985 25324 10332 1 15 . 1 1 52 52 THR H H 52 8.685 8.685 8.742 -0.057 25324 10333 1 15 . 1 1 53 53 TYR N N 53 129.086 129.086 126.060 3.026 25324 10334 1 15 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.903 -0.103 25324 10335 1 15 . 1 1 53 53 TYR C C 53 175.214 175.214 176.382 -1.168 25324 10336 1 15 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.710 1.171 25324 10337 1 15 . 1 1 53 53 TYR CB C 53 40.512 40.512 40.287 0.225 25324 10338 1 15 . 1 1 53 53 TYR H H 53 10.112 10.112 8.716 1.396 25324 10339 1 15 . 1 1 54 54 ALA N N 54 119.947 119.947 123.753 -3.806 25324 10340 1 15 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.177 -0.175 25324 10341 1 15 . 1 1 54 54 ALA C C 54 178.285 178.285 178.008 0.277 25324 10342 1 15 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.455 0.516 25324 10343 1 15 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.815 0.902 25324 10344 1 15 . 1 1 54 54 ALA H H 54 8.704 8.704 8.590 0.114 25324 10345 1 15 . 1 1 55 55 GLY N N 55 110.940 110.940 112.103 -1.163 25324 10346 1 15 . 1 1 55 55 GLY C C 55 173.903 173.903 174.167 -0.264 25324 10347 1 15 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.134 -0.118 25324 10348 1 15 . 1 1 55 55 GLY H H 55 8.745 8.745 8.604 0.141 25324 10349 1 15 . 1 1 56 56 GLU N N 56 120.073 120.073 120.136 -0.063 25324 10350 1 15 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.722 -0.013 25324 10351 1 15 . 1 1 56 56 GLU C C 56 175.906 175.906 176.518 -0.612 25324 10352 1 15 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.098 -0.675 25324 10353 1 15 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.233 0.591 25324 10354 1 15 . 1 1 56 56 GLU H H 56 8.039 8.039 7.904 0.135 25324 10355 1 15 . 1 1 57 57 GLY N N 57 105.298 105.298 108.689 -3.391 25324 10356 1 15 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.668 0.134 25324 10357 1 15 . 1 1 57 57 GLY H H 57 7.937 7.937 8.306 -0.369 25324 10358 1 15 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.933 0.001 25324 10359 1 15 . 1 1 58 58 PRO C C 58 177.785 177.785 176.470 1.315 25324 10360 1 15 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.056 0.076 25324 10361 1 15 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.327 -0.487 25324 10362 1 15 . 1 1 59 59 ILE N N 59 117.386 117.386 118.225 -0.839 25324 10363 1 15 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.757 0.231 25324 10364 1 15 . 1 1 59 59 ILE C C 59 175.688 175.688 175.287 0.401 25324 10365 1 15 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.017 0.526 25324 10366 1 15 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.824 0.464 25324 10367 1 15 . 1 1 59 59 ILE H H 59 9.600 9.600 8.956 0.644 25324 10368 1 15 . 1 1 60 60 GLY N N 60 107.164 107.164 108.460 -1.296 25324 10369 1 15 . 1 1 60 60 GLY C C 60 173.787 173.787 172.574 1.213 25324 10370 1 15 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.386 1.849 25324 10371 1 15 . 1 1 60 60 GLY H H 60 8.957 8.957 8.519 0.438 25324 10372 1 15 . 1 1 61 61 PHE N N 61 124.597 124.597 125.892 -1.295 25324 10373 1 15 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.441 -0.218 25324 10374 1 15 . 1 1 61 61 PHE C C 61 173.126 173.126 173.391 -0.265 25324 10375 1 15 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.385 0.476 25324 10376 1 15 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.218 -0.001 25324 10377 1 15 . 1 1 61 61 PHE H H 61 8.788 8.788 9.207 -0.419 25324 10378 1 15 . 1 1 62 62 ARG N N 62 129.706 129.706 128.085 1.621 25324 10379 1 15 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.141 -0.009 25324 10380 1 15 . 1 1 62 62 ARG C C 62 172.456 172.456 172.941 -0.485 25324 10381 1 15 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.114 0.840 25324 10382 1 15 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.244 -1.374 25324 10383 1 15 . 1 1 62 62 ARG H H 62 8.405 8.405 8.452 -0.047 25324 10384 1 15 . 1 1 63 63 ALA N N 63 122.744 122.744 128.867 -6.123 25324 10385 1 15 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.338 0.007 25324 10386 1 15 . 1 1 63 63 ALA C C 63 176.120 176.120 175.578 0.542 25324 10387 1 15 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.090 -0.171 25324 10388 1 15 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.962 1.812 25324 10389 1 15 . 1 1 63 63 ALA H H 63 8.628 8.628 8.828 -0.200 25324 10390 1 15 . 1 1 64 64 THR N N 64 116.855 116.855 118.174 -1.319 25324 10391 1 15 . 1 1 64 64 THR HA H 64 4.848 4.848 5.077 -0.229 25324 10392 1 15 . 1 1 64 64 THR C C 64 172.957 172.957 173.610 -0.653 25324 10393 1 15 . 1 1 64 64 THR CA C 64 61.211 61.211 61.224 -0.013 25324 10394 1 15 . 1 1 64 64 THR CB C 64 71.064 71.064 71.344 -0.280 25324 10395 1 15 . 1 1 64 64 THR H H 64 8.315 8.315 8.515 -0.200 25324 10396 1 15 . 1 1 65 65 LEU N N 65 129.360 129.360 129.591 -0.231 25324 10397 1 15 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.817 -0.455 25324 10398 1 15 . 1 1 65 65 LEU C C 65 176.459 176.459 176.537 -0.078 25324 10399 1 15 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.579 1.108 25324 10400 1 15 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.712 -0.001 25324 10401 1 15 . 1 1 65 65 LEU H H 65 8.877 8.877 8.997 -0.120 25324 10402 1 15 . 1 1 66 66 LEU N N 66 128.683 128.683 128.204 0.479 25324 10403 1 15 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.128 0.248 25324 10404 1 15 . 1 1 66 66 LEU C C 66 177.621 177.621 177.864 -0.243 25324 10405 1 15 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.487 -1.787 25324 10406 1 15 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.198 0.104 25324 10407 1 15 . 1 1 66 66 LEU H H 66 9.320 9.320 9.081 0.239 25324 10408 1 15 . 1 1 67 67 GLY N N 67 105.361 105.361 104.587 0.774 25324 10409 1 15 . 1 1 67 67 GLY C C 67 173.618 173.618 174.438 -0.820 25324 10410 1 15 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.892 -1.525 25324 10411 1 15 . 1 1 67 67 GLY H H 67 6.639 6.639 8.159 -1.520 25324 10412 1 15 . 1 1 68 68 ASN N N 68 121.848 121.848 118.947 2.901 25324 10413 1 15 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.755 -0.424 25324 10414 1 15 . 1 1 68 68 ASN C C 68 174.316 174.316 174.996 -0.680 25324 10415 1 15 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.327 3.225 25324 10416 1 15 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.352 -1.187 25324 10417 1 15 . 1 1 68 68 ASN H H 68 9.236 9.236 8.274 0.962 25324 10418 1 15 . 1 1 69 69 ASN N N 69 109.509 109.509 112.296 -2.787 25324 10419 1 15 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.186 -0.106 25324 10420 1 15 . 1 1 69 69 ASN C C 69 171.456 171.456 173.877 -2.421 25324 10421 1 15 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.891 0.859 25324 10422 1 15 . 1 1 69 69 ASN CB C 69 37.306 37.306 36.808 0.498 25324 10423 1 15 . 1 1 69 69 ASN H H 69 8.651 8.651 8.620 0.031 25324 10424 1 15 . 1 1 70 70 SER N N 70 113.479 113.479 114.041 -0.562 25324 10425 1 15 . 1 1 70 70 SER HA H 70 5.437 5.437 5.461 -0.024 25324 10426 1 15 . 1 1 70 70 SER C C 70 173.750 173.750 173.011 0.739 25324 10427 1 15 . 1 1 70 70 SER CA C 70 57.139 57.139 57.358 -0.219 25324 10428 1 15 . 1 1 70 70 SER CB C 70 63.818 63.818 65.240 -1.422 25324 10429 1 15 . 1 1 70 70 SER H H 70 7.693 7.693 7.363 0.330 25324 10430 1 15 . 1 1 71 71 TYR N N 71 123.132 123.132 124.929 -1.797 25324 10431 1 15 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.278 -0.135 25324 10432 1 15 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.252 0.396 25324 10433 1 15 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.023 0.422 25324 10434 1 15 . 1 1 71 71 TYR H H 71 9.326 9.326 9.611 -0.285 25324 10435 1 15 . 1 1 72 72 GLU N N 72 122.396 122.396 123.412 -1.016 25324 10436 1 15 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.597 0.209 25324 10437 1 15 . 1 1 72 72 GLU C C 72 175.698 175.698 175.263 0.435 25324 10438 1 15 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.921 -0.754 25324 10439 1 15 . 1 1 72 72 GLU CB C 72 30.184 30.184 30.686 -0.502 25324 10440 1 15 . 1 1 72 72 GLU H H 72 8.624 8.624 9.075 -0.451 25324 10441 1 15 . 1 1 73 73 VAL N N 73 128.513 128.513 128.286 0.227 25324 10442 1 15 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.466 -0.267 25324 10443 1 15 . 1 1 73 73 VAL C C 73 175.369 175.369 174.578 0.791 25324 10444 1 15 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.900 0.580 25324 10445 1 15 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.775 -0.442 25324 10446 1 15 . 1 1 73 73 VAL H H 73 8.564 8.564 9.183 -0.619 25324 10447 1 15 . 1 1 74 74 GLU N N 74 124.842 124.842 126.358 -1.516 25324 10448 1 15 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.179 -0.092 25324 10449 1 15 . 1 1 74 74 GLU C C 74 174.415 174.415 174.903 -0.488 25324 10450 1 15 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.783 -0.446 25324 10451 1 15 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.301 1.856 25324 10452 1 15 . 1 1 74 74 GLU H H 74 9.011 9.011 8.939 0.072 25324 10453 1 15 . 1 1 75 75 ASN N N 75 116.136 116.136 122.102 -5.966 25324 10454 1 15 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.809 0.330 25324 10455 1 15 . 1 1 75 75 ASN C C 75 172.703 172.703 174.021 -1.318 25324 10456 1 15 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.634 0.191 25324 10457 1 15 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.265 3.631 25324 10458 1 15 . 1 1 75 75 ASN H H 75 9.424 9.424 9.114 0.310 25324 10459 1 15 . 1 1 76 76 GLN N N 76 120.762 120.762 122.254 -1.492 25324 10460 1 15 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.482 -0.442 25324 10461 1 15 . 1 1 76 76 GLN C C 76 173.113 173.113 174.198 -1.085 25324 10462 1 15 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.364 -0.141 25324 10463 1 15 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.831 -0.483 25324 10464 1 15 . 1 1 76 76 GLN H H 76 7.106 7.106 8.773 -1.667 25324 10465 1 15 . 1 1 77 77 TRP N N 77 125.598 125.598 124.391 1.207 25324 10466 1 15 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.078 0.074 25324 10467 1 15 . 1 1 77 77 TRP C C 77 175.502 175.502 175.647 -0.145 25324 10468 1 15 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.822 -1.058 25324 10469 1 15 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.834 -0.834 25324 10470 1 15 . 1 1 77 77 TRP H H 77 8.181 8.181 8.069 0.112 25324 10471 1 15 . 1 1 78 78 GLY N N 78 107.901 107.901 108.503 -0.602 25324 10472 1 15 . 1 1 78 78 GLY C C 78 174.611 174.611 174.384 0.227 25324 10473 1 15 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.915 -0.013 25324 10474 1 15 . 1 1 78 78 GLY H H 78 8.778 8.778 8.803 -0.025 25324 10475 1 15 . 1 1 79 79 GLY N N 79 109.844 109.844 107.840 2.004 25324 10476 1 15 . 1 1 79 79 GLY C C 79 173.782 173.782 173.723 0.059 25324 10477 1 15 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.529 -0.736 25324 10478 1 15 . 1 1 79 79 GLY H H 79 8.198 8.198 7.392 0.806 25324 10479 1 15 . 1 1 80 80 ASP N N 80 115.837 115.837 120.407 -4.570 25324 10480 1 15 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.315 -0.074 25324 10481 1 15 . 1 1 80 80 ASP C C 80 177.285 177.285 176.671 0.614 25324 10482 1 15 . 1 1 80 80 ASP CA C 80 56.183 56.183 56.531 -0.348 25324 10483 1 15 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.978 -0.455 25324 10484 1 15 . 1 1 80 80 ASP H H 80 8.132 8.132 8.663 -0.531 25324 10485 1 15 . 1 1 81 81 SER N N 81 112.690 112.690 113.975 -1.285 25324 10486 1 15 . 1 1 81 81 SER HA H 81 4.513 4.513 4.398 0.115 25324 10487 1 15 . 1 1 81 81 SER C C 81 173.684 173.684 174.018 -0.334 25324 10488 1 15 . 1 1 81 81 SER CA C 81 57.232 57.232 58.347 -1.115 25324 10489 1 15 . 1 1 81 81 SER CB C 81 63.170 63.170 63.240 -0.070 25324 10490 1 15 . 1 1 81 81 SER H H 81 8.179 8.179 8.059 0.120 25324 10491 1 15 . 1 1 82 82 ALA N N 82 126.310 126.310 125.572 0.738 25324 10492 1 15 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.447 -0.044 25324 10493 1 15 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.418 0.048 25324 10494 1 15 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.606 -0.408 25324 10495 1 15 . 1 1 82 82 ALA H H 82 7.274 7.274 7.191 0.083 25324 10496 1 15 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.278 0.095 25324 10497 1 15 . 1 1 83 83 PRO C C 83 175.378 175.378 175.315 0.063 25324 10498 1 15 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.117 0.210 25324 10499 1 15 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.375 -0.211 25324 10500 1 15 . 1 1 84 84 TRP N N 84 120.106 120.106 117.629 2.477 25324 10501 1 15 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.459 -0.188 25324 10502 1 15 . 1 1 84 84 TRP C C 84 176.358 176.358 175.924 0.434 25324 10503 1 15 . 1 1 84 84 TRP CA C 84 56.946 56.946 57.026 -0.080 25324 10504 1 15 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.633 -0.917 25324 10505 1 15 . 1 1 84 84 TRP H H 84 8.329 8.329 8.024 0.305 25324 10506 1 15 . 1 1 85 85 HIS N N 85 118.543 118.543 120.803 -2.260 25324 10507 1 15 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.850 0.068 25324 10508 1 15 . 1 1 85 85 HIS C C 85 174.950 174.950 174.972 -0.022 25324 10509 1 15 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.983 -1.514 25324 10510 1 15 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.588 -0.915 25324 10511 1 15 . 1 1 85 85 HIS H H 85 9.204 9.204 9.072 0.132 25324 10512 1 15 . 1 1 86 86 SER N N 86 117.803 117.803 118.106 -0.303 25324 10513 1 15 . 1 1 86 86 SER HA H 86 4.412 4.412 4.290 0.122 25324 10514 1 15 . 1 1 86 86 SER C C 86 175.691 175.691 174.950 0.741 25324 10515 1 15 . 1 1 86 86 SER CA C 86 60.257 60.257 58.947 1.310 25324 10516 1 15 . 1 1 86 86 SER CB C 86 63.015 63.015 62.770 0.245 25324 10517 1 15 . 1 1 86 86 SER H H 86 9.168 9.168 8.762 0.406 25324 10518 1 15 . 1 1 87 87 GLY N N 87 115.773 115.773 114.076 1.697 25324 10519 1 15 . 1 1 87 87 GLY C C 87 174.288 174.288 174.379 -0.091 25324 10520 1 15 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.970 -0.269 25324 10521 1 15 . 1 1 87 87 GLY H H 87 9.284 9.284 8.790 0.494 25324 10522 1 15 . 1 1 88 88 GLY N N 88 109.162 109.162 109.654 -0.492 25324 10523 1 15 . 1 1 88 88 GLY C C 88 171.120 171.120 172.002 -0.882 25324 10524 1 15 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.795 -0.201 25324 10525 1 15 . 1 1 88 88 GLY H H 88 8.054 8.054 8.121 -0.067 25324 10526 1 15 . 1 1 89 89 ASN N N 89 117.048 117.048 120.147 -3.099 25324 10527 1 15 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.955 0.083 25324 10528 1 15 . 1 1 89 89 ASN C C 89 175.287 175.287 174.945 0.342 25324 10529 1 15 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.180 -1.315 25324 10530 1 15 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.353 -1.748 25324 10531 1 15 . 1 1 89 89 ASN H H 89 8.516 8.516 8.592 -0.076 25324 10532 1 15 . 1 1 90 90 TRP N N 90 125.844 125.844 122.938 2.906 25324 10533 1 15 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.313 -0.060 25324 10534 1 15 . 1 1 90 90 TRP C C 90 175.278 175.278 175.286 -0.008 25324 10535 1 15 . 1 1 90 90 TRP CA C 90 54.268 54.268 55.260 -0.992 25324 10536 1 15 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.997 -1.039 25324 10537 1 15 . 1 1 90 90 TRP H H 90 9.282 9.282 9.404 -0.122 25324 10538 1 15 . 1 1 91 91 ILE N N 91 123.134 123.134 121.727 1.407 25324 10539 1 15 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.877 0.569 25324 10540 1 15 . 1 1 91 91 ILE C C 91 175.489 175.489 175.171 0.318 25324 10541 1 15 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.971 -0.145 25324 10542 1 15 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.997 0.679 25324 10543 1 15 . 1 1 91 91 ILE H H 91 9.318 9.318 8.646 0.672 25324 10544 1 15 . 1 1 92 92 LEU N N 92 123.452 123.452 128.670 -5.218 25324 10545 1 15 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.608 0.334 25324 10546 1 15 . 1 1 92 92 LEU C C 92 173.620 173.620 174.468 -0.848 25324 10547 1 15 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.634 -1.378 25324 10548 1 15 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.376 1.132 25324 10549 1 15 . 1 1 92 92 LEU H H 92 8.463 8.463 8.811 -0.348 25324 10550 1 15 . 1 1 93 93 GLY N N 93 103.987 103.987 107.438 -3.451 25324 10551 1 15 . 1 1 93 93 GLY C C 93 172.284 172.284 174.404 -2.120 25324 10552 1 15 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.529 -2.029 25324 10553 1 15 . 1 1 93 93 GLY H H 93 2.937 2.937 7.504 -4.567 25324 10554 1 15 . 1 1 94 94 SER N N 94 110.274 110.274 118.906 -8.632 25324 10555 1 15 . 1 1 94 94 SER HA H 94 4.711 4.711 4.796 -0.085 25324 10556 1 15 . 1 1 94 94 SER C C 94 174.784 174.784 174.111 0.673 25324 10557 1 15 . 1 1 94 94 SER CA C 94 56.555 56.555 58.865 -2.310 25324 10558 1 15 . 1 1 94 94 SER CB C 94 65.051 65.051 63.809 1.242 25324 10559 1 15 . 1 1 94 94 SER H H 94 7.919 7.919 9.001 -1.082 25324 10560 1 15 . 1 1 95 95 ARG N N 95 123.020 123.020 119.852 3.168 25324 10561 1 15 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.667 0.005 25324 10562 1 15 . 1 1 95 95 ARG C C 95 176.120 176.120 176.851 -0.731 25324 10563 1 15 . 1 1 95 95 ARG CA C 95 55.374 55.374 53.987 1.387 25324 10564 1 15 . 1 1 95 95 ARG CB C 95 31.848 31.848 32.314 -0.466 25324 10565 1 15 . 1 1 95 95 ARG H H 95 9.148 9.148 7.727 1.421 25324 10566 1 15 . 1 1 96 96 GLU N N 96 120.357 120.357 123.822 -3.465 25324 10567 1 15 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.053 0.229 25324 10568 1 15 . 1 1 96 96 GLU C C 96 176.278 176.278 176.002 0.276 25324 10569 1 15 . 1 1 96 96 GLU CA C 96 56.530 56.530 59.045 -2.515 25324 10570 1 15 . 1 1 96 96 GLU CB C 96 30.153 30.153 30.041 0.112 25324 10571 1 15 . 1 1 96 96 GLU H H 96 8.610 8.610 8.901 -0.291 25324 10572 1 15 . 1 1 97 97 ASN N N 97 117.678 117.678 116.114 1.564 25324 10573 1 15 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.884 -0.272 25324 10574 1 15 . 1 1 97 97 ASN C C 97 173.949 173.949 173.860 0.089 25324 10575 1 15 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.842 0.173 25324 10576 1 15 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.420 -0.254 25324 10577 1 15 . 1 1 97 97 ASN H H 97 8.533 8.533 8.196 0.337 25324 10578 1 15 . 1 1 98 98 GLN N N 98 118.592 118.592 120.530 -1.938 25324 10579 1 15 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.518 -0.158 25324 10580 1 15 . 1 1 98 98 GLN C C 98 173.116 173.116 173.482 -0.366 25324 10581 1 15 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.436 0.192 25324 10582 1 15 . 1 1 98 98 GLN CB C 98 30.869 30.869 30.767 0.102 25324 10583 1 15 . 1 1 98 98 GLN H H 98 7.663 7.663 7.721 -0.058 25324 10584 1 15 . 1 1 99 99 ASN N N 99 122.855 122.855 122.748 0.107 25324 10585 1 15 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.008 0.127 25324 10586 1 15 . 1 1 99 99 ASN C C 99 175.287 175.287 175.212 0.075 25324 10587 1 15 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.356 0.634 25324 10588 1 15 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.428 0.063 25324 10589 1 15 . 1 1 99 99 ASN H H 99 8.759 8.759 8.634 0.125 25324 10590 1 15 . 1 1 100 100 VAL N N 100 121.385 121.385 117.394 3.991 25324 10591 1 15 . 1 1 100 100 VAL HA H 100 3.748 3.748 4.109 -0.361 25324 10592 1 15 . 1 1 100 100 VAL C C 100 174.956 174.956 175.874 -0.918 25324 10593 1 15 . 1 1 100 100 VAL CA C 100 63.843 63.843 62.224 1.619 25324 10594 1 15 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.686 0.757 25324 10595 1 15 . 1 1 100 100 VAL H H 100 8.717 8.717 8.030 0.687 25324 10596 1 15 . 1 1 101 101 VAL N N 101 112.736 112.736 116.534 -3.798 25324 10597 1 15 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.438 0.207 25324 10598 1 15 . 1 1 101 101 VAL C C 101 175.577 175.577 174.841 0.736 25324 10599 1 15 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.282 -1.319 25324 10600 1 15 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.346 -0.305 25324 10601 1 15 . 1 1 101 101 VAL H H 101 8.802 8.802 8.902 -0.100 25324 10602 1 15 . 1 1 102 102 ALA N N 102 122.104 122.104 121.726 0.378 25324 10603 1 15 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.227 -0.420 25324 10604 1 15 . 1 1 102 102 ALA C C 102 176.046 176.046 174.950 1.096 25324 10605 1 15 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.979 2.275 25324 10606 1 15 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.442 -0.817 25324 10607 1 15 . 1 1 102 102 ALA H H 102 7.677 7.677 7.768 -0.091 25324 10608 1 15 . 1 1 103 103 ILE N N 103 118.218 118.218 121.315 -3.097 25324 10609 1 15 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.295 -0.268 25324 10610 1 15 . 1 1 103 103 ILE C C 103 173.118 173.118 173.712 -0.594 25324 10611 1 15 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.856 1.371 25324 10612 1 15 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.847 0.624 25324 10613 1 15 . 1 1 103 103 ILE H H 103 8.102 8.102 8.568 -0.466 25324 10614 1 15 . 1 1 104 104 ASN N N 104 125.938 125.938 126.798 -0.860 25324 10615 1 15 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.451 0.235 25324 10616 1 15 . 1 1 104 104 ASN C C 104 174.870 174.870 173.679 1.191 25324 10617 1 15 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.061 0.492 25324 10618 1 15 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.126 -1.274 25324 10619 1 15 . 1 1 104 104 ASN H H 104 8.668 8.668 9.077 -0.409 25324 10620 1 15 . 1 1 105 105 VAL N N 105 114.631 114.631 119.304 -4.673 25324 10621 1 15 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.041 0.164 25324 10622 1 15 . 1 1 105 105 VAL C C 105 174.788 174.788 173.310 1.478 25324 10623 1 15 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.336 -2.357 25324 10624 1 15 . 1 1 105 105 VAL CB C 105 36.040 36.040 36.191 -0.152 25324 10625 1 15 . 1 1 105 105 VAL H H 105 8.933 8.933 8.866 0.067 25324 10626 1 15 . 1 1 106 106 GLU N N 106 118.347 118.347 122.620 -4.273 25324 10627 1 15 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.298 -0.218 25324 10628 1 15 . 1 1 106 106 GLU C C 106 174.777 174.777 174.733 0.044 25324 10629 1 15 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.797 0.170 25324 10630 1 15 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.276 -0.633 25324 10631 1 15 . 1 1 106 106 GLU H H 106 8.814 8.814 8.628 0.186 25324 10632 1 15 . 1 1 107 107 SER N N 107 115.335 115.335 119.127 -3.792 25324 10633 1 15 . 1 1 107 107 SER HA H 107 5.266 5.266 4.881 0.385 25324 10634 1 15 . 1 1 107 107 SER C C 107 175.787 175.787 175.135 0.652 25324 10635 1 15 . 1 1 107 107 SER CA C 107 55.888 55.888 56.630 -0.742 25324 10636 1 15 . 1 1 107 107 SER CB C 107 65.921 65.921 64.600 1.321 25324 10637 1 15 . 1 1 107 107 SER H H 107 8.576 8.576 8.339 0.237 25324 10638 1 15 . 1 1 108 108 GLY N N 108 117.567 117.567 113.597 3.970 25324 10639 1 15 . 1 1 108 108 GLY C C 108 173.959 173.959 174.346 -0.387 25324 10640 1 15 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.308 -0.631 25324 10641 1 15 . 1 1 108 108 GLY H H 108 9.532 9.532 8.753 0.779 25324 10642 1 15 . 1 1 109 109 ASP N N 109 122.108 122.108 120.278 1.830 25324 10643 1 15 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.917 -0.116 25324 10644 1 15 . 1 1 109 109 ASP C C 109 176.203 176.203 175.986 0.217 25324 10645 1 15 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.889 -0.755 25324 10646 1 15 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.906 -3.564 25324 10647 1 15 . 1 1 109 109 ASP H H 109 8.605 8.605 7.622 0.983 25324 10648 1 15 . 1 1 110 110 ASP N N 110 116.197 116.197 120.618 -4.421 25324 10649 1 15 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.551 -0.329 25324 10650 1 15 . 1 1 110 110 ASP C C 110 175.951 175.951 176.457 -0.506 25324 10651 1 15 . 1 1 110 110 ASP CA C 110 55.198 55.198 54.692 0.506 25324 10652 1 15 . 1 1 110 110 ASP CB C 110 38.630 38.630 39.240 -0.610 25324 10653 1 15 . 1 1 110 110 ASP H H 110 9.087 9.087 8.725 0.362 25324 10654 1 15 . 1 1 111 111 GLY N N 111 103.841 103.841 108.338 -4.497 25324 10655 1 15 . 1 1 111 111 GLY C C 111 173.924 173.924 174.859 -0.935 25324 10656 1 15 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.766 -0.603 25324 10657 1 15 . 1 1 111 111 GLY H H 111 8.930 8.930 8.064 0.866 25324 10658 1 15 . 1 1 112 112 GLN N N 112 121.626 121.626 118.435 3.191 25324 10659 1 15 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.132 -0.062 25324 10660 1 15 . 1 1 112 112 GLN C C 112 176.431 176.431 175.750 0.681 25324 10661 1 15 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.651 -0.379 25324 10662 1 15 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.363 -1.670 25324 10663 1 15 . 1 1 112 112 GLN H H 112 7.351 7.351 8.402 -1.051 25324 10664 1 15 . 1 1 113 113 THR N N 113 112.322 112.322 109.957 2.365 25324 10665 1 15 . 1 1 113 113 THR HA H 113 5.331 5.331 5.032 0.299 25324 10666 1 15 . 1 1 113 113 THR C C 113 174.452 174.452 173.062 1.390 25324 10667 1 15 . 1 1 113 113 THR CA C 113 59.739 59.739 60.050 -0.311 25324 10668 1 15 . 1 1 113 113 THR CB C 113 71.773 71.773 70.394 1.379 25324 10669 1 15 . 1 1 113 113 THR H H 113 10.053 10.053 7.563 2.490 25324 10670 1 15 . 1 1 114 114 LEU N N 114 122.083 122.083 128.490 -6.407 25324 10671 1 15 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.628 -0.047 25324 10672 1 15 . 1 1 114 114 LEU C C 114 175.113 175.113 173.904 1.209 25324 10673 1 15 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.776 -0.871 25324 10674 1 15 . 1 1 114 114 LEU CB C 114 47.033 47.033 44.949 2.084 25324 10675 1 15 . 1 1 114 114 LEU H H 114 8.978 8.978 9.012 -0.034 25324 10676 1 15 . 1 1 115 115 ASN N N 115 118.846 118.846 122.066 -3.220 25324 10677 1 15 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.628 0.142 25324 10678 1 15 . 1 1 115 115 ASN C C 115 174.788 174.788 174.412 0.376 25324 10679 1 15 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.148 1.194 25324 10680 1 15 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.023 1.391 25324 10681 1 15 . 1 1 115 115 ASN H H 115 8.837 8.837 7.875 0.962 25324 10682 1 15 . 1 1 116 116 GLY N N 116 109.661 109.661 105.832 3.829 25324 10683 1 15 . 1 1 116 116 GLY C C 116 172.452 172.452 172.872 -0.420 25324 10684 1 15 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.041 0.430 25324 10685 1 15 . 1 1 116 116 GLY H H 116 8.625 8.625 8.596 0.029 25324 10686 1 15 . 1 1 117 117 THR N N 117 120.009 120.009 114.320 5.689 25324 10687 1 15 . 1 1 117 117 THR HA H 117 5.556 5.556 5.428 0.128 25324 10688 1 15 . 1 1 117 117 THR C C 117 171.619 171.619 173.096 -1.477 25324 10689 1 15 . 1 1 117 117 THR CA C 117 59.373 59.373 60.301 -0.928 25324 10690 1 15 . 1 1 117 117 THR CB C 117 72.777 72.777 72.910 -0.133 25324 10691 1 15 . 1 1 117 117 THR H H 117 8.911 8.911 8.959 -0.048 25324 10692 1 15 . 1 1 118 118 MET N N 118 115.550 115.550 117.233 -1.683 25324 10693 1 15 . 1 1 118 118 MET HA H 118 4.889 4.889 4.918 -0.029 25324 10694 1 15 . 1 1 118 118 MET C C 118 172.707 172.707 173.550 -0.843 25324 10695 1 15 . 1 1 118 118 MET CA C 118 54.714 54.714 54.946 -0.232 25324 10696 1 15 . 1 1 118 118 MET CB C 118 33.663 33.663 36.448 -2.785 25324 10697 1 15 . 1 1 118 118 MET H H 118 9.159 9.159 9.335 -0.176 25324 10698 1 15 . 1 1 119 119 THR N N 119 113.716 113.716 116.782 -3.066 25324 10699 1 15 . 1 1 119 119 THR HA H 119 4.682 4.682 5.151 -0.469 25324 10700 1 15 . 1 1 119 119 THR C C 119 173.952 173.952 173.527 0.425 25324 10701 1 15 . 1 1 119 119 THR CA C 119 61.395 61.395 61.449 -0.054 25324 10702 1 15 . 1 1 119 119 THR CB C 119 71.746 71.746 71.548 0.198 25324 10703 1 15 . 1 1 119 119 THR H H 119 8.685 8.685 8.712 -0.027 25324 10704 1 15 . 1 1 120 120 TYR N N 120 129.153 129.153 125.123 4.030 25324 10705 1 15 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.741 0.059 25324 10706 1 15 . 1 1 120 120 TYR C C 120 175.214 175.214 177.494 -2.280 25324 10707 1 15 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.794 0.083 25324 10708 1 15 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.453 1.049 25324 10709 1 15 . 1 1 120 120 TYR H H 120 10.107 10.107 8.123 1.984 25324 10710 1 15 . 1 1 121 121 ALA N N 121 119.947 119.947 125.269 -5.322 25324 10711 1 15 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.147 -0.143 25324 10712 1 15 . 1 1 121 121 ALA C C 121 178.456 178.456 177.311 1.145 25324 10713 1 15 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.364 -0.408 25324 10714 1 15 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.869 -0.159 25324 10715 1 15 . 1 1 121 121 ALA H H 121 8.704 8.704 8.817 -0.113 25324 10716 1 15 . 1 1 122 122 GLY N N 122 111.186 111.186 104.128 7.058 25324 10717 1 15 . 1 1 122 122 GLY C C 122 173.949 173.949 173.951 -0.002 25324 10718 1 15 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.148 -0.146 25324 10719 1 15 . 1 1 122 122 GLY H H 122 8.792 8.792 8.427 0.365 25324 10720 1 15 . 1 1 123 123 GLU N N 123 120.099 120.099 121.276 -1.177 25324 10721 1 15 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.642 0.063 25324 10722 1 15 . 1 1 123 123 GLU C C 123 175.912 175.912 176.707 -0.795 25324 10723 1 15 . 1 1 123 123 GLU CA C 123 54.414 54.414 56.004 -1.590 25324 10724 1 15 . 1 1 123 123 GLU CB C 123 32.784 32.784 31.390 1.394 25324 10725 1 15 . 1 1 123 123 GLU H H 123 8.072 8.072 7.783 0.289 25324 10726 1 15 . 1 1 124 124 GLY N N 124 105.303 105.303 108.173 -2.870 25324 10727 1 15 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.291 -0.489 25324 10728 1 15 . 1 1 124 124 GLY H H 124 7.939 7.939 7.561 0.378 25324 10729 1 15 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.881 0.054 25324 10730 1 15 . 1 1 125 125 PRO C C 125 177.788 177.788 176.133 1.655 25324 10731 1 15 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.051 0.080 25324 10732 1 15 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.090 0.769 25324 10733 1 15 . 1 1 126 126 ILE N N 126 117.387 117.387 119.713 -2.326 25324 10734 1 15 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.598 0.301 25324 10735 1 15 . 1 1 126 126 ILE C C 126 175.625 175.625 174.657 0.968 25324 10736 1 15 . 1 1 126 126 ILE CA C 126 59.453 59.453 58.758 0.695 25324 10737 1 15 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.472 1.076 25324 10738 1 15 . 1 1 126 126 ILE H H 126 9.599 9.599 8.742 0.857 25324 10739 1 15 . 1 1 127 127 GLY N N 127 106.753 106.753 107.918 -1.165 25324 10740 1 15 . 1 1 127 127 GLY C C 127 173.627 173.627 172.658 0.969 25324 10741 1 15 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.411 1.872 25324 10742 1 15 . 1 1 127 127 GLY H H 127 8.840 8.840 8.476 0.364 25324 10743 1 15 . 1 1 128 128 PHE N N 128 124.826 124.826 125.203 -0.377 25324 10744 1 15 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.547 -0.603 25324 10745 1 15 . 1 1 128 128 PHE C C 128 173.087 173.087 173.113 -0.026 25324 10746 1 15 . 1 1 128 128 PHE CA C 128 57.009 57.009 55.589 1.420 25324 10747 1 15 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.423 -0.264 25324 10748 1 15 . 1 1 128 128 PHE H H 128 8.924 8.924 8.822 0.102 25324 10749 1 15 . 1 1 129 129 LYS N N 129 131.518 131.518 127.826 3.692 25324 10750 1 15 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.670 0.213 25324 10751 1 15 . 1 1 129 129 LYS C C 129 173.863 173.863 173.758 0.105 25324 10752 1 15 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.473 1.262 25324 10753 1 15 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.892 -1.171 25324 10754 1 15 . 1 1 129 129 LYS H H 129 8.201 8.201 9.087 -0.886 25324 10755 1 15 . 1 1 130 130 GLY N N 130 114.030 114.030 112.641 1.389 25324 10756 1 15 . 1 1 130 130 GLY C C 130 171.951 171.951 172.002 -0.051 25324 10757 1 15 . 1 1 130 130 GLY CA C 130 43.787 43.787 44.413 -0.626 25324 10758 1 15 . 1 1 130 130 GLY H H 130 9.325 9.325 8.677 0.648 25324 10759 1 15 . 1 1 131 131 THR N N 131 120.583 120.583 120.308 0.275 25324 10760 1 15 . 1 1 131 131 THR HA H 131 4.939 4.939 5.124 -0.185 25324 10761 1 15 . 1 1 131 131 THR C C 131 173.118 173.118 173.701 -0.583 25324 10762 1 15 . 1 1 131 131 THR CA C 131 61.266 61.266 61.269 -0.003 25324 10763 1 15 . 1 1 131 131 THR CB C 131 70.392 70.392 71.809 -1.417 25324 10764 1 15 . 1 1 131 131 THR H H 131 8.916 8.916 7.986 0.930 25324 10765 1 15 . 1 1 132 132 LEU N N 132 130.774 130.774 130.039 0.735 25324 10766 1 15 . 1 1 132 132 LEU HA H 132 3.500 3.500 4.057 -0.557 25324 10767 1 15 . 1 1 132 132 LEU C C 132 176.574 176.574 176.054 0.520 25324 10768 1 15 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.284 0.903 25324 10769 1 15 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.812 -0.365 25324 10770 1 15 . 1 1 132 132 LEU H H 132 8.527 8.527 8.575 -0.048 25324 10771 1 16 . 1 1 3 3 LEU N N 3 123.202 123.202 124.084 -0.882 25324 10772 1 16 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.991 0.166 25324 10773 1 16 . 1 1 3 3 LEU C C 3 175.786 175.786 175.032 0.754 25324 10774 1 16 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.757 0.527 25324 10775 1 16 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.424 -0.094 25324 10776 1 16 . 1 1 3 3 LEU H H 3 8.711 8.711 8.469 0.242 25324 10777 1 16 . 1 1 4 4 TYR N N 4 120.906 120.906 124.542 -3.636 25324 10778 1 16 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.055 -0.031 25324 10779 1 16 . 1 1 4 4 TYR C C 4 175.953 175.953 175.117 0.836 25324 10780 1 16 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.010 0.367 25324 10781 1 16 . 1 1 4 4 TYR CB C 4 41.655 41.655 41.987 -0.332 25324 10782 1 16 . 1 1 4 4 TYR H H 4 9.142 9.142 9.157 -0.015 25324 10783 1 16 . 1 1 5 5 ASN N N 5 120.496 120.496 119.877 0.619 25324 10784 1 16 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.851 0.265 25324 10785 1 16 . 1 1 5 5 ASN C C 5 174.953 174.953 173.804 1.149 25324 10786 1 16 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.789 -0.842 25324 10787 1 16 . 1 1 5 5 ASN CB C 5 38.891 38.891 39.762 -0.871 25324 10788 1 16 . 1 1 5 5 ASN H H 5 8.787 8.787 9.015 -0.228 25324 10789 1 16 . 1 1 6 6 VAL N N 6 127.428 127.428 122.291 5.137 25324 10790 1 16 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.482 -0.120 25324 10791 1 16 . 1 1 6 6 VAL C C 6 174.955 174.955 174.738 0.217 25324 10792 1 16 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.889 0.544 25324 10793 1 16 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.569 0.762 25324 10794 1 16 . 1 1 6 6 VAL H H 6 8.806 8.806 7.812 0.994 25324 10795 1 16 . 1 1 7 7 GLU N N 7 124.355 124.355 126.339 -1.984 25324 10796 1 16 . 1 1 7 7 GLU HA H 7 4.982 4.982 5.208 -0.226 25324 10797 1 16 . 1 1 7 7 GLU C C 7 174.551 174.551 174.965 -0.414 25324 10798 1 16 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.569 -0.780 25324 10799 1 16 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.410 1.157 25324 10800 1 16 . 1 1 7 7 GLU H H 7 8.800 8.800 8.897 -0.097 25324 10801 1 16 . 1 1 8 8 ASN N N 8 116.231 116.231 121.951 -5.720 25324 10802 1 16 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.872 0.169 25324 10803 1 16 . 1 1 8 8 ASN C C 8 172.709 172.709 173.572 -0.863 25324 10804 1 16 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.327 -0.710 25324 10805 1 16 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.934 2.651 25324 10806 1 16 . 1 1 8 8 ASN H H 8 9.320 9.320 9.258 0.062 25324 10807 1 16 . 1 1 9 9 GLN N N 9 120.762 120.762 123.506 -2.744 25324 10808 1 16 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.346 -0.172 25324 10809 1 16 . 1 1 9 9 GLN C C 9 173.454 173.454 173.823 -0.369 25324 10810 1 16 . 1 1 9 9 GLN CA C 9 53.960 53.960 53.955 0.005 25324 10811 1 16 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.140 -0.449 25324 10812 1 16 . 1 1 9 9 GLN H H 9 6.887 6.887 8.429 -1.542 25324 10813 1 16 . 1 1 10 10 TRP N N 10 127.775 127.775 124.320 3.455 25324 10814 1 16 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.097 -0.109 25324 10815 1 16 . 1 1 10 10 TRP C C 10 175.281 175.281 175.782 -0.501 25324 10816 1 16 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.480 -0.188 25324 10817 1 16 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.398 -1.656 25324 10818 1 16 . 1 1 10 10 TRP H H 10 8.518 8.518 7.887 0.631 25324 10819 1 16 . 1 1 11 11 GLY N N 11 107.838 107.838 109.859 -2.021 25324 10820 1 16 . 1 1 11 11 GLY C C 11 174.733 174.733 173.962 0.771 25324 10821 1 16 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.948 -0.112 25324 10822 1 16 . 1 1 11 11 GLY H H 11 8.461 8.461 8.812 -0.351 25324 10823 1 16 . 1 1 12 12 GLY N N 12 109.696 109.696 107.541 2.155 25324 10824 1 16 . 1 1 12 12 GLY C C 12 174.133 174.133 175.057 -0.924 25324 10825 1 16 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.343 -0.554 25324 10826 1 16 . 1 1 12 12 GLY H H 12 8.138 8.138 7.656 0.482 25324 10827 1 16 . 1 1 13 13 SER N N 13 111.308 111.308 115.128 -3.820 25324 10828 1 16 . 1 1 13 13 SER HA H 13 4.092 4.092 4.107 -0.015 25324 10829 1 16 . 1 1 13 13 SER C C 13 175.622 175.622 175.251 0.371 25324 10830 1 16 . 1 1 13 13 SER CA C 13 60.494 60.494 60.782 -0.288 25324 10831 1 16 . 1 1 13 13 SER CB C 13 63.028 63.028 63.229 -0.201 25324 10832 1 16 . 1 1 13 13 SER H H 13 8.215 8.215 8.670 -0.455 25324 10833 1 16 . 1 1 14 14 SER N N 14 115.290 115.290 114.997 0.293 25324 10834 1 16 . 1 1 14 14 SER HA H 14 4.566 4.566 4.428 0.138 25324 10835 1 16 . 1 1 14 14 SER C C 14 173.532 173.532 173.474 0.058 25324 10836 1 16 . 1 1 14 14 SER CA C 14 57.317 57.317 58.976 -1.659 25324 10837 1 16 . 1 1 14 14 SER CB C 14 63.230 63.230 63.339 -0.109 25324 10838 1 16 . 1 1 14 14 SER H H 14 8.213 8.213 8.097 0.116 25324 10839 1 16 . 1 1 15 15 ALA N N 15 126.470 126.470 124.362 2.108 25324 10840 1 16 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.564 -0.161 25324 10841 1 16 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.562 0.902 25324 10842 1 16 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.732 -0.503 25324 10843 1 16 . 1 1 15 15 ALA H H 15 7.308 7.308 7.376 -0.068 25324 10844 1 16 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.340 0.069 25324 10845 1 16 . 1 1 16 16 PRO C C 16 175.627 175.627 175.488 0.139 25324 10846 1 16 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.096 0.296 25324 10847 1 16 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.527 -0.390 25324 10848 1 16 . 1 1 17 17 TRP N N 17 120.228 120.228 119.910 0.318 25324 10849 1 16 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.502 -0.184 25324 10850 1 16 . 1 1 17 17 TRP C C 17 175.951 175.951 176.059 -0.108 25324 10851 1 16 . 1 1 17 17 TRP CA C 17 56.915 56.915 57.131 -0.216 25324 10852 1 16 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.086 -0.677 25324 10853 1 16 . 1 1 17 17 TRP H H 17 8.380 8.380 8.191 0.189 25324 10854 1 16 . 1 1 18 18 ASN N N 18 120.663 120.663 121.988 -1.325 25324 10855 1 16 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.029 0.057 25324 10856 1 16 . 1 1 18 18 ASN C C 18 174.793 174.793 173.900 0.893 25324 10857 1 16 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.441 -0.840 25324 10858 1 16 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.173 1.475 25324 10859 1 16 . 1 1 18 18 ASN H H 18 9.094 9.094 8.750 0.344 25324 10860 1 16 . 1 1 19 19 GLU N N 19 122.202 122.202 121.929 0.273 25324 10861 1 16 . 1 1 19 19 GLU HA H 19 4.139 4.139 5.143 -1.004 25324 10862 1 16 . 1 1 19 19 GLU C C 19 176.869 176.869 176.319 0.550 25324 10863 1 16 . 1 1 19 19 GLU CA C 19 58.600 58.600 55.169 3.431 25324 10864 1 16 . 1 1 19 19 GLU CB C 19 29.382 29.382 31.531 -2.149 25324 10865 1 16 . 1 1 19 19 GLU H H 19 9.013 9.013 8.681 0.332 25324 10866 1 16 . 1 1 20 20 GLY N N 20 112.893 112.893 111.808 1.085 25324 10867 1 16 . 1 1 20 20 GLY C C 20 174.878 174.878 173.101 1.777 25324 10868 1 16 . 1 1 20 20 GLY CA C 20 44.995 44.995 45.435 -0.440 25324 10869 1 16 . 1 1 20 20 GLY H H 20 8.926 8.926 8.681 0.245 25324 10870 1 16 . 1 1 21 21 GLY N N 21 110.354 110.354 107.293 3.061 25324 10871 1 16 . 1 1 21 21 GLY C C 21 171.623 171.623 171.936 -0.313 25324 10872 1 16 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.522 -1.124 25324 10873 1 16 . 1 1 21 21 GLY H H 21 8.258 8.258 7.930 0.328 25324 10874 1 16 . 1 1 22 22 GLN N N 22 117.541 117.541 117.471 0.070 25324 10875 1 16 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.883 0.794 25324 10876 1 16 . 1 1 22 22 GLN C C 22 175.957 175.957 174.208 1.749 25324 10877 1 16 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.864 0.080 25324 10878 1 16 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.338 -1.253 25324 10879 1 16 . 1 1 22 22 GLN H H 22 8.564 8.564 8.560 0.004 25324 10880 1 16 . 1 1 23 23 TRP N N 23 127.208 127.208 122.121 5.087 25324 10881 1 16 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.121 0.078 25324 10882 1 16 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.125 0.406 25324 10883 1 16 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.484 -0.801 25324 10884 1 16 . 1 1 23 23 TRP H H 23 9.347 9.347 8.948 0.399 25324 10885 1 16 . 1 1 24 24 GLU N N 24 123.504 123.504 122.130 1.374 25324 10886 1 16 . 1 1 24 24 GLU HA H 24 5.508 5.508 4.854 0.654 25324 10887 1 16 . 1 1 24 24 GLU C C 24 174.222 174.222 175.108 -0.886 25324 10888 1 16 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.381 0.210 25324 10889 1 16 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.888 -1.273 25324 10890 1 16 . 1 1 24 24 GLU H H 24 9.296 9.296 8.599 0.697 25324 10891 1 16 . 1 1 25 25 ILE N N 25 123.447 123.447 126.735 -3.288 25324 10892 1 16 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.518 -0.083 25324 10893 1 16 . 1 1 25 25 ILE C C 25 175.790 175.790 174.895 0.895 25324 10894 1 16 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.044 -0.417 25324 10895 1 16 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.543 0.409 25324 10896 1 16 . 1 1 25 25 ILE H H 25 8.635 8.635 8.515 0.120 25324 10897 1 16 . 1 1 26 26 GLY N N 26 111.544 111.544 112.805 -1.261 25324 10898 1 16 . 1 1 26 26 GLY C C 26 172.122 172.122 174.711 -2.589 25324 10899 1 16 . 1 1 26 26 GLY CA C 26 44.078 44.078 45.381 -1.303 25324 10900 1 16 . 1 1 26 26 GLY H H 26 3.381 3.381 6.744 -3.363 25324 10901 1 16 . 1 1 27 27 SER N N 27 112.279 112.279 112.567 -0.288 25324 10902 1 16 . 1 1 27 27 SER HA H 27 4.876 4.876 4.109 0.767 25324 10903 1 16 . 1 1 27 27 SER C C 27 174.113 174.113 173.564 0.549 25324 10904 1 16 . 1 1 27 27 SER CA C 27 56.954 56.954 59.344 -2.390 25324 10905 1 16 . 1 1 27 27 SER CB C 27 64.554 64.554 62.217 2.337 25324 10906 1 16 . 1 1 27 27 SER H H 27 8.212 8.212 8.235 -0.023 25324 10907 1 16 . 1 1 28 28 ARG N N 28 120.872 120.872 119.078 1.794 25324 10908 1 16 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.569 0.194 25324 10909 1 16 . 1 1 28 28 ARG C C 28 176.119 176.119 174.878 1.241 25324 10910 1 16 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.180 -0.063 25324 10911 1 16 . 1 1 28 28 ARG CB C 28 31.830 31.830 33.416 -1.586 25324 10912 1 16 . 1 1 28 28 ARG H H 28 7.849 7.849 7.714 0.135 25324 10913 1 16 . 1 1 29 29 SER N N 29 118.985 118.985 115.685 3.300 25324 10914 1 16 . 1 1 29 29 SER HA H 29 4.192 4.192 4.466 -0.274 25324 10915 1 16 . 1 1 29 29 SER C C 29 174.622 174.622 174.598 0.024 25324 10916 1 16 . 1 1 29 29 SER CA C 29 60.072 60.072 58.655 1.417 25324 10917 1 16 . 1 1 29 29 SER CB C 29 62.876 62.876 63.731 -0.855 25324 10918 1 16 . 1 1 29 29 SER H H 29 8.892 8.892 8.804 0.088 25324 10919 1 16 . 1 1 30 30 ASP N N 30 117.632 117.632 120.824 -3.192 25324 10920 1 16 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.623 -0.005 25324 10921 1 16 . 1 1 30 30 ASP C C 30 175.101 175.101 175.815 -0.714 25324 10922 1 16 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.295 -2.244 25324 10923 1 16 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.241 -0.718 25324 10924 1 16 . 1 1 30 30 ASP H H 30 8.441 8.441 8.089 0.352 25324 10925 1 16 . 1 1 31 31 GLN N N 31 118.273 118.273 117.907 0.366 25324 10926 1 16 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.608 -0.123 25324 10927 1 16 . 1 1 31 31 GLN C C 31 173.453 173.453 174.355 -0.902 25324 10928 1 16 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.985 -0.117 25324 10929 1 16 . 1 1 31 31 GLN CB C 31 33.249 33.249 31.304 1.945 25324 10930 1 16 . 1 1 31 31 GLN H H 31 7.029 7.029 8.161 -1.132 25324 10931 1 16 . 1 1 32 32 ASN N N 32 120.865 120.865 120.742 0.123 25324 10932 1 16 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.003 0.117 25324 10933 1 16 . 1 1 32 32 ASN C C 32 175.198 175.198 174.755 0.443 25324 10934 1 16 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.635 -0.766 25324 10935 1 16 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.403 -0.773 25324 10936 1 16 . 1 1 32 32 ASN H H 32 8.713 8.713 8.769 -0.056 25324 10937 1 16 . 1 1 33 33 VAL N N 33 122.111 122.111 117.793 4.318 25324 10938 1 16 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.441 -0.736 25324 10939 1 16 . 1 1 33 33 VAL C C 33 174.950 174.950 176.123 -1.173 25324 10940 1 16 . 1 1 33 33 VAL CA C 33 63.847 63.847 61.925 1.922 25324 10941 1 16 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.429 -0.079 25324 10942 1 16 . 1 1 33 33 VAL H H 33 8.542 8.542 8.317 0.225 25324 10943 1 16 . 1 1 34 34 VAL N N 34 113.282 113.282 117.466 -4.184 25324 10944 1 16 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.523 0.122 25324 10945 1 16 . 1 1 34 34 VAL C C 34 175.574 175.574 174.920 0.654 25324 10946 1 16 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.048 -1.074 25324 10947 1 16 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.476 -0.447 25324 10948 1 16 . 1 1 34 34 VAL H H 34 8.744 8.744 8.602 0.142 25324 10949 1 16 . 1 1 35 35 ALA N N 35 122.102 122.102 120.877 1.225 25324 10950 1 16 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.101 -0.298 25324 10951 1 16 . 1 1 35 35 ALA C C 35 175.947 175.947 175.003 0.944 25324 10952 1 16 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.068 2.183 25324 10953 1 16 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.179 -0.551 25324 10954 1 16 . 1 1 35 35 ALA H H 35 7.677 7.677 7.780 -0.103 25324 10955 1 16 . 1 1 36 36 ILE N N 36 118.005 118.005 121.968 -3.963 25324 10956 1 16 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.261 -0.233 25324 10957 1 16 . 1 1 36 36 ILE C C 36 173.116 173.116 173.600 -0.484 25324 10958 1 16 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.120 1.062 25324 10959 1 16 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.631 0.854 25324 10960 1 16 . 1 1 36 36 ILE H H 36 8.126 8.126 8.787 -0.661 25324 10961 1 16 . 1 1 37 37 ASN N N 37 125.632 125.632 126.415 -0.783 25324 10962 1 16 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.940 -0.259 25324 10963 1 16 . 1 1 37 37 ASN C C 37 174.854 174.854 173.474 1.380 25324 10964 1 16 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.143 0.387 25324 10965 1 16 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.376 -2.523 25324 10966 1 16 . 1 1 37 37 ASN H H 37 8.577 8.577 8.750 -0.173 25324 10967 1 16 . 1 1 38 38 VAL N N 38 114.223 114.223 118.122 -3.899 25324 10968 1 16 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.941 0.262 25324 10969 1 16 . 1 1 38 38 VAL C C 38 174.854 174.854 173.084 1.770 25324 10970 1 16 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.733 -1.753 25324 10971 1 16 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.807 0.237 25324 10972 1 16 . 1 1 38 38 VAL H H 38 8.874 8.874 8.866 0.008 25324 10973 1 16 . 1 1 39 39 GLU N N 39 118.277 118.277 121.920 -3.643 25324 10974 1 16 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.302 -0.220 25324 10975 1 16 . 1 1 39 39 GLU C C 39 174.548 174.548 175.678 -1.130 25324 10976 1 16 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.746 1.247 25324 10977 1 16 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.471 -0.893 25324 10978 1 16 . 1 1 39 39 GLU H H 39 8.761 8.761 9.259 -0.498 25324 10979 1 16 . 1 1 40 40 SER N N 40 114.960 114.960 120.526 -5.566 25324 10980 1 16 . 1 1 40 40 SER HA H 40 5.265 5.265 5.019 0.245 25324 10981 1 16 . 1 1 40 40 SER C C 40 175.783 175.783 174.969 0.814 25324 10982 1 16 . 1 1 40 40 SER CA C 40 55.880 55.880 57.801 -1.921 25324 10983 1 16 . 1 1 40 40 SER CB C 40 65.911 65.911 63.792 2.119 25324 10984 1 16 . 1 1 40 40 SER H H 40 8.500 8.500 8.588 -0.088 25324 10985 1 16 . 1 1 41 41 GLY N N 41 117.567 117.567 108.648 8.919 25324 10986 1 16 . 1 1 41 41 GLY C C 41 174.119 174.119 173.948 0.171 25324 10987 1 16 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.393 -0.705 25324 10988 1 16 . 1 1 41 41 GLY H H 41 9.533 9.533 8.593 0.940 25324 10989 1 16 . 1 1 42 42 ASP N N 42 122.141 122.141 121.629 0.512 25324 10990 1 16 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.932 -0.132 25324 10991 1 16 . 1 1 42 42 ASP C C 42 176.121 176.121 175.325 0.796 25324 10992 1 16 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.000 -0.854 25324 10993 1 16 . 1 1 42 42 ASP CB C 42 39.354 39.354 41.486 -2.132 25324 10994 1 16 . 1 1 42 42 ASP H H 42 8.644 8.644 7.998 0.646 25324 10995 1 16 . 1 1 43 43 ASP N N 43 116.025 116.025 124.934 -8.909 25324 10996 1 16 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.337 -0.107 25324 10997 1 16 . 1 1 43 43 ASP C C 43 176.018 176.018 176.186 -0.168 25324 10998 1 16 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.211 0.038 25324 10999 1 16 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.780 -1.221 25324 11000 1 16 . 1 1 43 43 ASP H H 43 9.111 9.111 9.088 0.023 25324 11001 1 16 . 1 1 44 44 GLY N N 44 104.263 104.263 102.512 1.751 25324 11002 1 16 . 1 1 44 44 GLY C C 44 173.922 173.922 175.888 -1.966 25324 11003 1 16 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.885 -0.584 25324 11004 1 16 . 1 1 44 44 GLY H H 44 9.063 9.063 8.778 0.285 25324 11005 1 16 . 1 1 45 45 GLN N N 45 121.691 121.691 119.607 2.084 25324 11006 1 16 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.281 -0.195 25324 11007 1 16 . 1 1 45 45 GLN C C 45 176.284 176.284 176.027 0.257 25324 11008 1 16 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.406 0.712 25324 11009 1 16 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.368 -1.694 25324 11010 1 16 . 1 1 45 45 GLN H H 45 7.356 7.356 8.551 -1.195 25324 11011 1 16 . 1 1 46 46 THR N N 46 111.843 111.843 110.106 1.737 25324 11012 1 16 . 1 1 46 46 THR HA H 46 5.355 5.355 5.434 -0.079 25324 11013 1 16 . 1 1 46 46 THR C C 46 174.451 174.451 173.456 0.995 25324 11014 1 16 . 1 1 46 46 THR CA C 46 59.644 59.644 60.129 -0.485 25324 11015 1 16 . 1 1 46 46 THR CB C 46 72.714 72.714 71.779 0.935 25324 11016 1 16 . 1 1 46 46 THR H H 46 10.123 10.123 7.492 2.631 25324 11017 1 16 . 1 1 47 47 LEU N N 47 119.302 119.302 124.035 -4.733 25324 11018 1 16 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.835 -0.028 25324 11019 1 16 . 1 1 47 47 LEU C C 47 175.487 175.487 175.044 0.443 25324 11020 1 16 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.971 -0.901 25324 11021 1 16 . 1 1 47 47 LEU CB C 47 48.003 48.003 45.201 2.802 25324 11022 1 16 . 1 1 47 47 LEU H H 47 8.364 8.364 8.959 -0.595 25324 11023 1 16 . 1 1 48 48 ASN N N 48 116.844 116.844 120.494 -3.650 25324 11024 1 16 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.995 -0.266 25324 11025 1 16 . 1 1 48 48 ASN C C 48 174.460 174.460 174.971 -0.511 25324 11026 1 16 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.681 1.058 25324 11027 1 16 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.746 0.667 25324 11028 1 16 . 1 1 48 48 ASN H H 48 8.748 8.748 9.009 -0.261 25324 11029 1 16 . 1 1 49 49 GLY N N 49 109.417 109.417 109.627 -0.210 25324 11030 1 16 . 1 1 49 49 GLY C C 49 172.126 172.126 172.243 -0.117 25324 11031 1 16 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.218 0.273 25324 11032 1 16 . 1 1 49 49 GLY H H 49 8.744 8.744 9.061 -0.317 25324 11033 1 16 . 1 1 50 50 THR N N 50 119.162 119.162 117.448 1.714 25324 11034 1 16 . 1 1 50 50 THR HA H 50 5.556 5.556 5.422 0.134 25324 11035 1 16 . 1 1 50 50 THR C C 50 171.790 171.790 172.702 -0.912 25324 11036 1 16 . 1 1 50 50 THR CA C 50 59.371 59.371 61.729 -2.358 25324 11037 1 16 . 1 1 50 50 THR CB C 50 72.799 72.799 71.977 0.822 25324 11038 1 16 . 1 1 50 50 THR H H 50 8.799 8.799 8.961 -0.162 25324 11039 1 16 . 1 1 51 51 MET N N 51 115.232 115.232 126.347 -11.115 25324 11040 1 16 . 1 1 51 51 MET HA H 51 4.886 4.886 4.995 -0.109 25324 11041 1 16 . 1 1 51 51 MET C C 51 172.708 172.708 173.709 -1.001 25324 11042 1 16 . 1 1 51 51 MET CA C 51 54.722 54.722 53.623 1.099 25324 11043 1 16 . 1 1 51 51 MET CB C 51 34.557 34.557 37.300 -2.743 25324 11044 1 16 . 1 1 51 51 MET H H 51 9.062 9.062 9.247 -0.185 25324 11045 1 16 . 1 1 52 52 THR N N 52 113.697 113.697 122.026 -8.329 25324 11046 1 16 . 1 1 52 52 THR HA H 52 4.682 4.682 4.736 -0.054 25324 11047 1 16 . 1 1 52 52 THR C C 52 173.952 173.952 173.492 0.460 25324 11048 1 16 . 1 1 52 52 THR CA C 52 61.395 61.395 61.333 0.062 25324 11049 1 16 . 1 1 52 52 THR CB C 52 71.734 71.734 71.286 0.448 25324 11050 1 16 . 1 1 52 52 THR H H 52 8.685 8.685 8.817 -0.132 25324 11051 1 16 . 1 1 53 53 TYR N N 53 129.086 129.086 125.146 3.940 25324 11052 1 16 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.571 0.229 25324 11053 1 16 . 1 1 53 53 TYR C C 53 175.214 175.214 176.490 -1.276 25324 11054 1 16 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.421 0.460 25324 11055 1 16 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.397 1.115 25324 11056 1 16 . 1 1 53 53 TYR H H 53 10.112 10.112 8.904 1.208 25324 11057 1 16 . 1 1 54 54 ALA N N 54 119.947 119.947 123.567 -3.620 25324 11058 1 16 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.244 -0.242 25324 11059 1 16 . 1 1 54 54 ALA C C 54 178.285 178.285 177.698 0.587 25324 11060 1 16 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.235 0.736 25324 11061 1 16 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.709 1.008 25324 11062 1 16 . 1 1 54 54 ALA H H 54 8.704 8.704 8.315 0.389 25324 11063 1 16 . 1 1 55 55 GLY N N 55 110.940 110.940 112.061 -1.121 25324 11064 1 16 . 1 1 55 55 GLY C C 55 173.903 173.903 174.524 -0.621 25324 11065 1 16 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.231 -0.215 25324 11066 1 16 . 1 1 55 55 GLY H H 55 8.745 8.745 8.376 0.369 25324 11067 1 16 . 1 1 56 56 GLU N N 56 120.073 120.073 120.792 -0.719 25324 11068 1 16 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.717 -0.008 25324 11069 1 16 . 1 1 56 56 GLU C C 56 175.906 175.906 176.541 -0.635 25324 11070 1 16 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.074 -0.651 25324 11071 1 16 . 1 1 56 56 GLU CB C 56 32.824 32.824 31.683 1.141 25324 11072 1 16 . 1 1 56 56 GLU H H 56 8.039 8.039 7.754 0.285 25324 11073 1 16 . 1 1 57 57 GLY N N 57 105.298 105.298 108.408 -3.110 25324 11074 1 16 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.654 0.148 25324 11075 1 16 . 1 1 57 57 GLY H H 57 7.937 7.937 8.308 -0.371 25324 11076 1 16 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.640 0.294 25324 11077 1 16 . 1 1 58 58 PRO C C 58 177.785 177.785 176.493 1.292 25324 11078 1 16 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.178 -0.046 25324 11079 1 16 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.377 -0.537 25324 11080 1 16 . 1 1 59 59 ILE N N 59 117.386 117.386 117.823 -0.437 25324 11081 1 16 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.686 0.302 25324 11082 1 16 . 1 1 59 59 ILE C C 59 175.688 175.688 175.095 0.593 25324 11083 1 16 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.152 0.391 25324 11084 1 16 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.593 0.695 25324 11085 1 16 . 1 1 59 59 ILE H H 59 9.600 9.600 8.964 0.636 25324 11086 1 16 . 1 1 60 60 GLY N N 60 107.164 107.164 107.895 -0.731 25324 11087 1 16 . 1 1 60 60 GLY C C 60 173.787 173.787 172.554 1.233 25324 11088 1 16 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.531 1.704 25324 11089 1 16 . 1 1 60 60 GLY H H 60 8.957 8.957 8.605 0.352 25324 11090 1 16 . 1 1 61 61 PHE N N 61 124.597 124.597 126.139 -1.542 25324 11091 1 16 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.643 -0.420 25324 11092 1 16 . 1 1 61 61 PHE C C 61 173.126 173.126 173.510 -0.384 25324 11093 1 16 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.192 0.669 25324 11094 1 16 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.460 -0.243 25324 11095 1 16 . 1 1 61 61 PHE H H 61 8.788 8.788 9.195 -0.407 25324 11096 1 16 . 1 1 62 62 ARG N N 62 129.706 129.706 127.408 2.298 25324 11097 1 16 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.475 -0.343 25324 11098 1 16 . 1 1 62 62 ARG C C 62 172.456 172.456 173.054 -0.598 25324 11099 1 16 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.048 0.906 25324 11100 1 16 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.428 -1.558 25324 11101 1 16 . 1 1 62 62 ARG H H 62 8.405 8.405 7.983 0.422 25324 11102 1 16 . 1 1 63 63 ALA N N 63 122.744 122.744 128.662 -5.918 25324 11103 1 16 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.336 0.009 25324 11104 1 16 . 1 1 63 63 ALA C C 63 176.120 176.120 175.547 0.573 25324 11105 1 16 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.103 -0.184 25324 11106 1 16 . 1 1 63 63 ALA CB C 63 24.773 24.773 23.012 1.761 25324 11107 1 16 . 1 1 63 63 ALA H H 63 8.628 8.628 8.768 -0.140 25324 11108 1 16 . 1 1 64 64 THR N N 64 116.855 116.855 117.474 -0.619 25324 11109 1 16 . 1 1 64 64 THR HA H 64 4.848 4.848 5.170 -0.322 25324 11110 1 16 . 1 1 64 64 THR C C 64 172.957 172.957 173.363 -0.406 25324 11111 1 16 . 1 1 64 64 THR CA C 64 61.211 61.211 61.121 0.090 25324 11112 1 16 . 1 1 64 64 THR CB C 64 71.064 71.064 71.832 -0.768 25324 11113 1 16 . 1 1 64 64 THR H H 64 8.315 8.315 8.762 -0.447 25324 11114 1 16 . 1 1 65 65 LEU N N 65 129.360 129.360 129.529 -0.169 25324 11115 1 16 . 1 1 65 65 LEU HA H 65 3.362 3.362 4.003 -0.641 25324 11116 1 16 . 1 1 65 65 LEU C C 65 176.459 176.459 176.103 0.356 25324 11117 1 16 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.333 1.354 25324 11118 1 16 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.279 0.432 25324 11119 1 16 . 1 1 65 65 LEU H H 65 8.877 8.877 8.985 -0.108 25324 11120 1 16 . 1 1 66 66 LEU N N 66 128.683 128.683 128.209 0.474 25324 11121 1 16 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.432 -0.056 25324 11122 1 16 . 1 1 66 66 LEU C C 66 177.621 177.621 176.590 1.031 25324 11123 1 16 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.432 -0.732 25324 11124 1 16 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.785 -0.483 25324 11125 1 16 . 1 1 66 66 LEU H H 66 9.320 9.320 8.871 0.449 25324 11126 1 16 . 1 1 67 67 GLY N N 67 105.361 105.361 102.863 2.498 25324 11127 1 16 . 1 1 67 67 GLY C C 67 173.618 173.618 172.772 0.846 25324 11128 1 16 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.675 -1.308 25324 11129 1 16 . 1 1 67 67 GLY H H 67 6.639 6.639 7.216 -0.577 25324 11130 1 16 . 1 1 68 68 ASN N N 68 121.848 121.848 118.152 3.696 25324 11131 1 16 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.226 0.105 25324 11132 1 16 . 1 1 68 68 ASN C C 68 174.316 174.316 174.647 -0.331 25324 11133 1 16 . 1 1 68 68 ASN CA C 68 54.552 54.552 55.722 -1.171 25324 11134 1 16 . 1 1 68 68 ASN CB C 68 37.165 37.165 37.993 -0.828 25324 11135 1 16 . 1 1 68 68 ASN H H 68 9.236 9.236 8.680 0.556 25324 11136 1 16 . 1 1 69 69 ASN N N 69 109.509 109.509 117.358 -7.849 25324 11137 1 16 . 1 1 69 69 ASN HA H 69 4.080 4.080 5.008 -0.928 25324 11138 1 16 . 1 1 69 69 ASN C C 69 171.456 171.456 173.630 -2.174 25324 11139 1 16 . 1 1 69 69 ASN CA C 69 55.750 55.750 52.962 2.788 25324 11140 1 16 . 1 1 69 69 ASN CB C 69 37.306 37.306 40.300 -2.994 25324 11141 1 16 . 1 1 69 69 ASN H H 69 8.651 8.651 8.200 0.451 25324 11142 1 16 . 1 1 70 70 SER N N 70 113.479 113.479 117.053 -3.574 25324 11143 1 16 . 1 1 70 70 SER HA H 70 5.437 5.437 5.094 0.343 25324 11144 1 16 . 1 1 70 70 SER C C 70 173.750 173.750 172.909 0.841 25324 11145 1 16 . 1 1 70 70 SER CA C 70 57.139 57.139 57.705 -0.565 25324 11146 1 16 . 1 1 70 70 SER CB C 70 63.818 63.818 64.100 -0.283 25324 11147 1 16 . 1 1 70 70 SER H H 70 7.693 7.693 8.310 -0.617 25324 11148 1 16 . 1 1 71 71 TYR N N 71 123.132 123.132 127.222 -4.090 25324 11149 1 16 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.316 -0.173 25324 11150 1 16 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.292 0.356 25324 11151 1 16 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.044 0.401 25324 11152 1 16 . 1 1 71 71 TYR H H 71 9.326 9.326 9.623 -0.297 25324 11153 1 16 . 1 1 72 72 GLU N N 72 122.396 122.396 123.167 -0.771 25324 11154 1 16 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.891 -0.085 25324 11155 1 16 . 1 1 72 72 GLU C C 72 175.698 175.698 175.145 0.553 25324 11156 1 16 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.231 -0.064 25324 11157 1 16 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.811 -1.627 25324 11158 1 16 . 1 1 72 72 GLU H H 72 8.624 8.624 9.136 -0.512 25324 11159 1 16 . 1 1 73 73 VAL N N 73 128.513 128.513 127.466 1.047 25324 11160 1 16 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.260 -0.061 25324 11161 1 16 . 1 1 73 73 VAL C C 73 175.369 175.369 174.506 0.863 25324 11162 1 16 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.707 0.773 25324 11163 1 16 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.382 0.951 25324 11164 1 16 . 1 1 73 73 VAL H H 73 8.564 8.564 9.088 -0.524 25324 11165 1 16 . 1 1 74 74 GLU N N 74 124.842 124.842 126.981 -2.139 25324 11166 1 16 . 1 1 74 74 GLU HA H 74 5.087 5.087 4.900 0.187 25324 11167 1 16 . 1 1 74 74 GLU C C 74 174.415 174.415 174.944 -0.529 25324 11168 1 16 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.934 -0.597 25324 11169 1 16 . 1 1 74 74 GLU CB C 74 35.157 35.157 32.761 2.396 25324 11170 1 16 . 1 1 74 74 GLU H H 74 9.011 9.011 8.901 0.110 25324 11171 1 16 . 1 1 75 75 ASN N N 75 116.136 116.136 122.516 -6.380 25324 11172 1 16 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.471 0.668 25324 11173 1 16 . 1 1 75 75 ASN C C 75 172.703 172.703 173.741 -1.038 25324 11174 1 16 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.758 0.067 25324 11175 1 16 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.474 3.422 25324 11176 1 16 . 1 1 75 75 ASN H H 75 9.424 9.424 9.008 0.416 25324 11177 1 16 . 1 1 76 76 GLN N N 76 120.762 120.762 121.656 -0.894 25324 11178 1 16 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.479 -0.439 25324 11179 1 16 . 1 1 76 76 GLN C C 76 173.113 173.113 173.970 -0.857 25324 11180 1 16 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.377 -0.154 25324 11181 1 16 . 1 1 76 76 GLN CB C 76 30.348 30.348 31.020 -0.672 25324 11182 1 16 . 1 1 76 76 GLN H H 76 7.106 7.106 8.821 -1.715 25324 11183 1 16 . 1 1 77 77 TRP N N 77 125.598 125.598 124.189 1.409 25324 11184 1 16 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.104 0.048 25324 11185 1 16 . 1 1 77 77 TRP C C 77 175.502 175.502 175.923 -0.421 25324 11186 1 16 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.614 -0.850 25324 11187 1 16 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.964 -0.965 25324 11188 1 16 . 1 1 77 77 TRP H H 77 8.181 8.181 8.086 0.095 25324 11189 1 16 . 1 1 78 78 GLY N N 78 107.901 107.901 107.549 0.352 25324 11190 1 16 . 1 1 78 78 GLY C C 78 174.611 174.611 174.803 -0.192 25324 11191 1 16 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.739 0.163 25324 11192 1 16 . 1 1 78 78 GLY H H 78 8.778 8.778 8.600 0.178 25324 11193 1 16 . 1 1 79 79 GLY N N 79 109.844 109.844 107.908 1.936 25324 11194 1 16 . 1 1 79 79 GLY C C 79 173.782 173.782 173.950 -0.168 25324 11195 1 16 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.607 -0.814 25324 11196 1 16 . 1 1 79 79 GLY H H 79 8.198 8.198 7.759 0.439 25324 11197 1 16 . 1 1 80 80 ASP N N 80 115.837 115.837 119.242 -3.405 25324 11198 1 16 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.365 -0.124 25324 11199 1 16 . 1 1 80 80 ASP C C 80 177.285 177.285 176.207 1.078 25324 11200 1 16 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.248 0.935 25324 11201 1 16 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.897 -0.374 25324 11202 1 16 . 1 1 80 80 ASP H H 80 8.132 8.132 8.543 -0.411 25324 11203 1 16 . 1 1 81 81 SER N N 81 112.690 112.690 115.241 -2.551 25324 11204 1 16 . 1 1 81 81 SER HA H 81 4.513 4.513 4.321 0.192 25324 11205 1 16 . 1 1 81 81 SER C C 81 173.684 173.684 173.990 -0.306 25324 11206 1 16 . 1 1 81 81 SER CA C 81 57.232 57.232 58.347 -1.115 25324 11207 1 16 . 1 1 81 81 SER CB C 81 63.170 63.170 63.077 0.093 25324 11208 1 16 . 1 1 81 81 SER H H 81 8.179 8.179 8.080 0.099 25324 11209 1 16 . 1 1 82 82 ALA N N 82 126.310 126.310 125.694 0.616 25324 11210 1 16 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.524 -0.121 25324 11211 1 16 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.805 0.661 25324 11212 1 16 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.476 -0.278 25324 11213 1 16 . 1 1 82 82 ALA H H 82 7.274 7.274 7.151 0.123 25324 11214 1 16 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.228 0.145 25324 11215 1 16 . 1 1 83 83 PRO C C 83 175.378 175.378 175.297 0.081 25324 11216 1 16 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.213 0.114 25324 11217 1 16 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.517 -0.353 25324 11218 1 16 . 1 1 84 84 TRP N N 84 120.106 120.106 117.133 2.973 25324 11219 1 16 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.373 -0.102 25324 11220 1 16 . 1 1 84 84 TRP C C 84 176.358 176.358 176.016 0.342 25324 11221 1 16 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.971 -0.025 25324 11222 1 16 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.804 -1.088 25324 11223 1 16 . 1 1 84 84 TRP H H 84 8.329 8.329 7.974 0.355 25324 11224 1 16 . 1 1 85 85 HIS N N 85 118.543 118.543 120.184 -1.641 25324 11225 1 16 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.855 0.063 25324 11226 1 16 . 1 1 85 85 HIS C C 85 174.950 174.950 174.838 0.112 25324 11227 1 16 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.922 -1.453 25324 11228 1 16 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.058 -1.385 25324 11229 1 16 . 1 1 85 85 HIS H H 85 9.204 9.204 9.088 0.116 25324 11230 1 16 . 1 1 86 86 SER N N 86 117.803 117.803 116.785 1.018 25324 11231 1 16 . 1 1 86 86 SER HA H 86 4.412 4.412 4.235 0.177 25324 11232 1 16 . 1 1 86 86 SER C C 86 175.691 175.691 174.902 0.789 25324 11233 1 16 . 1 1 86 86 SER CA C 86 60.257 60.257 58.996 1.261 25324 11234 1 16 . 1 1 86 86 SER CB C 86 63.015 63.015 63.303 -0.288 25324 11235 1 16 . 1 1 86 86 SER H H 86 9.168 9.168 8.805 0.363 25324 11236 1 16 . 1 1 87 87 GLY N N 87 115.773 115.773 110.308 5.465 25324 11237 1 16 . 1 1 87 87 GLY C C 87 174.288 174.288 173.702 0.586 25324 11238 1 16 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.278 -0.577 25324 11239 1 16 . 1 1 87 87 GLY H H 87 9.284 9.284 8.893 0.391 25324 11240 1 16 . 1 1 88 88 GLY N N 88 109.162 109.162 108.497 0.665 25324 11241 1 16 . 1 1 88 88 GLY C C 88 171.120 171.120 171.711 -0.591 25324 11242 1 16 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.003 -0.409 25324 11243 1 16 . 1 1 88 88 GLY H H 88 8.054 8.054 8.057 -0.003 25324 11244 1 16 . 1 1 89 89 ASN N N 89 117.048 117.048 120.067 -3.019 25324 11245 1 16 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.640 0.398 25324 11246 1 16 . 1 1 89 89 ASN C C 89 175.287 175.287 174.350 0.937 25324 11247 1 16 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.227 -0.362 25324 11248 1 16 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.109 -0.505 25324 11249 1 16 . 1 1 89 89 ASN H H 89 8.516 8.516 8.696 -0.180 25324 11250 1 16 . 1 1 90 90 TRP N N 90 125.844 125.844 124.987 0.857 25324 11251 1 16 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.215 0.038 25324 11252 1 16 . 1 1 90 90 TRP C C 90 175.278 175.278 175.433 -0.155 25324 11253 1 16 . 1 1 90 90 TRP CA C 90 54.268 54.268 53.803 0.465 25324 11254 1 16 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.861 0.097 25324 11255 1 16 . 1 1 90 90 TRP H H 90 9.282 9.282 9.354 -0.072 25324 11256 1 16 . 1 1 91 91 ILE N N 91 123.134 123.134 121.176 1.958 25324 11257 1 16 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.039 0.407 25324 11258 1 16 . 1 1 91 91 ILE C C 91 175.489 175.489 175.330 0.159 25324 11259 1 16 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.798 0.028 25324 11260 1 16 . 1 1 91 91 ILE CB C 91 39.676 39.676 39.117 0.559 25324 11261 1 16 . 1 1 91 91 ILE H H 91 9.318 9.318 8.635 0.683 25324 11262 1 16 . 1 1 92 92 LEU N N 92 123.452 123.452 129.003 -5.551 25324 11263 1 16 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.547 0.395 25324 11264 1 16 . 1 1 92 92 LEU C C 92 173.620 173.620 174.282 -0.662 25324 11265 1 16 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.540 -1.284 25324 11266 1 16 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.108 1.399 25324 11267 1 16 . 1 1 92 92 LEU H H 92 8.463 8.463 8.900 -0.437 25324 11268 1 16 . 1 1 93 93 GLY N N 93 103.987 103.987 108.247 -4.260 25324 11269 1 16 . 1 1 93 93 GLY C C 93 172.284 172.284 174.130 -1.846 25324 11270 1 16 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.554 -2.054 25324 11271 1 16 . 1 1 93 93 GLY H H 93 2.937 2.937 6.969 -4.032 25324 11272 1 16 . 1 1 94 94 SER N N 94 110.274 110.274 117.670 -7.396 25324 11273 1 16 . 1 1 94 94 SER HA H 94 4.711 4.711 4.844 -0.133 25324 11274 1 16 . 1 1 94 94 SER C C 94 174.784 174.784 175.220 -0.436 25324 11275 1 16 . 1 1 94 94 SER CA C 94 56.555 56.555 58.914 -2.359 25324 11276 1 16 . 1 1 94 94 SER CB C 94 65.051 65.051 64.695 0.356 25324 11277 1 16 . 1 1 94 94 SER H H 94 7.919 7.919 9.789 -1.870 25324 11278 1 16 . 1 1 95 95 ARG N N 95 123.020 123.020 122.502 0.518 25324 11279 1 16 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.386 0.286 25324 11280 1 16 . 1 1 95 95 ARG C C 95 176.120 176.120 177.240 -1.120 25324 11281 1 16 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.505 -0.131 25324 11282 1 16 . 1 1 95 95 ARG CB C 95 31.848 31.848 30.980 0.868 25324 11283 1 16 . 1 1 95 95 ARG H H 95 9.148 9.148 7.638 1.510 25324 11284 1 16 . 1 1 96 96 GLU N N 96 120.357 120.357 124.340 -3.983 25324 11285 1 16 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.049 0.233 25324 11286 1 16 . 1 1 96 96 GLU C C 96 176.278 176.278 176.240 0.038 25324 11287 1 16 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.990 -2.460 25324 11288 1 16 . 1 1 96 96 GLU CB C 96 30.153 30.153 30.062 0.091 25324 11289 1 16 . 1 1 96 96 GLU H H 96 8.610 8.610 8.890 -0.280 25324 11290 1 16 . 1 1 97 97 ASN N N 97 117.678 117.678 115.616 2.062 25324 11291 1 16 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.905 -0.293 25324 11292 1 16 . 1 1 97 97 ASN C C 97 173.949 173.949 174.523 -0.574 25324 11293 1 16 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.393 0.622 25324 11294 1 16 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.353 -0.187 25324 11295 1 16 . 1 1 97 97 ASN H H 97 8.533 8.533 8.121 0.412 25324 11296 1 16 . 1 1 98 98 GLN N N 98 118.592 118.592 118.834 -0.242 25324 11297 1 16 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.419 -0.059 25324 11298 1 16 . 1 1 98 98 GLN C C 98 173.116 173.116 173.536 -0.420 25324 11299 1 16 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.648 -0.020 25324 11300 1 16 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.916 -1.047 25324 11301 1 16 . 1 1 98 98 GLN H H 98 7.663 7.663 7.389 0.274 25324 11302 1 16 . 1 1 99 99 ASN N N 99 122.855 122.855 120.551 2.304 25324 11303 1 16 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.152 -0.017 25324 11304 1 16 . 1 1 99 99 ASN C C 99 175.287 175.287 175.453 -0.166 25324 11305 1 16 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.326 0.664 25324 11306 1 16 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.769 -0.278 25324 11307 1 16 . 1 1 99 99 ASN H H 99 8.759 8.759 8.618 0.141 25324 11308 1 16 . 1 1 100 100 VAL N N 100 121.385 121.385 116.673 4.712 25324 11309 1 16 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.871 -0.123 25324 11310 1 16 . 1 1 100 100 VAL C C 100 174.956 174.956 175.651 -0.695 25324 11311 1 16 . 1 1 100 100 VAL CA C 100 63.843 63.843 62.803 1.040 25324 11312 1 16 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.993 0.450 25324 11313 1 16 . 1 1 100 100 VAL H H 100 8.717 8.717 7.946 0.771 25324 11314 1 16 . 1 1 101 101 VAL N N 101 112.736 112.736 116.857 -4.121 25324 11315 1 16 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.490 0.155 25324 11316 1 16 . 1 1 101 101 VAL C C 101 175.577 175.577 175.013 0.564 25324 11317 1 16 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.572 -1.609 25324 11318 1 16 . 1 1 101 101 VAL CB C 101 33.041 33.041 34.076 -1.035 25324 11319 1 16 . 1 1 101 101 VAL H H 101 8.802 8.802 8.739 0.063 25324 11320 1 16 . 1 1 102 102 ALA N N 102 122.104 122.104 121.610 0.494 25324 11321 1 16 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.246 -0.439 25324 11322 1 16 . 1 1 102 102 ALA C C 102 176.046 176.046 175.005 1.041 25324 11323 1 16 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.506 2.748 25324 11324 1 16 . 1 1 102 102 ALA CB C 102 21.625 21.625 21.870 -0.245 25324 11325 1 16 . 1 1 102 102 ALA H H 102 7.677 7.677 7.741 -0.064 25324 11326 1 16 . 1 1 103 103 ILE N N 103 118.218 118.218 122.403 -4.185 25324 11327 1 16 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.421 -0.394 25324 11328 1 16 . 1 1 103 103 ILE C C 103 173.118 173.118 173.894 -0.776 25324 11329 1 16 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.560 1.667 25324 11330 1 16 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.416 1.055 25324 11331 1 16 . 1 1 103 103 ILE H H 103 8.102 8.102 8.571 -0.469 25324 11332 1 16 . 1 1 104 104 ASN N N 104 125.938 125.938 126.760 -0.822 25324 11333 1 16 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.229 0.457 25324 11334 1 16 . 1 1 104 104 ASN C C 104 174.870 174.870 173.576 1.294 25324 11335 1 16 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.479 0.074 25324 11336 1 16 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.440 -1.588 25324 11337 1 16 . 1 1 104 104 ASN H H 104 8.668 8.668 9.066 -0.398 25324 11338 1 16 . 1 1 105 105 VAL N N 105 114.631 114.631 119.776 -5.145 25324 11339 1 16 . 1 1 105 105 VAL HA H 105 5.205 5.205 4.957 0.248 25324 11340 1 16 . 1 1 105 105 VAL C C 105 174.788 174.788 173.322 1.466 25324 11341 1 16 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.330 -2.351 25324 11342 1 16 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.789 0.251 25324 11343 1 16 . 1 1 105 105 VAL H H 105 8.933 8.933 8.858 0.075 25324 11344 1 16 . 1 1 106 106 GLU N N 106 118.347 118.347 124.856 -6.509 25324 11345 1 16 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.252 -0.172 25324 11346 1 16 . 1 1 106 106 GLU C C 106 174.777 174.777 174.711 0.066 25324 11347 1 16 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.011 -0.044 25324 11348 1 16 . 1 1 106 106 GLU CB C 106 33.643 33.643 33.935 -0.292 25324 11349 1 16 . 1 1 106 106 GLU H H 106 8.814 8.814 8.624 0.190 25324 11350 1 16 . 1 1 107 107 SER N N 107 115.335 115.335 119.578 -4.243 25324 11351 1 16 . 1 1 107 107 SER HA H 107 5.266 5.266 4.835 0.431 25324 11352 1 16 . 1 1 107 107 SER C C 107 175.787 175.787 174.645 1.142 25324 11353 1 16 . 1 1 107 107 SER CA C 107 55.888 55.888 56.518 -0.630 25324 11354 1 16 . 1 1 107 107 SER CB C 107 65.921 65.921 64.839 1.082 25324 11355 1 16 . 1 1 107 107 SER H H 107 8.576 8.576 8.402 0.174 25324 11356 1 16 . 1 1 108 108 GLY N N 108 117.567 117.567 112.585 4.982 25324 11357 1 16 . 1 1 108 108 GLY C C 108 173.959 173.959 174.582 -0.623 25324 11358 1 16 . 1 1 108 108 GLY CA C 108 44.677 44.677 44.877 -0.200 25324 11359 1 16 . 1 1 108 108 GLY H H 108 9.532 9.532 8.715 0.817 25324 11360 1 16 . 1 1 109 109 ASP N N 109 122.108 122.108 121.543 0.565 25324 11361 1 16 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.790 0.011 25324 11362 1 16 . 1 1 109 109 ASP C C 109 176.203 176.203 175.697 0.506 25324 11363 1 16 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.715 -0.581 25324 11364 1 16 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.569 -3.227 25324 11365 1 16 . 1 1 109 109 ASP H H 109 8.605 8.605 7.596 1.009 25324 11366 1 16 . 1 1 110 110 ASP N N 110 116.197 116.197 117.793 -1.596 25324 11367 1 16 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.558 -0.336 25324 11368 1 16 . 1 1 110 110 ASP C C 110 175.951 175.951 176.248 -0.297 25324 11369 1 16 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.780 1.418 25324 11370 1 16 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.700 -2.070 25324 11371 1 16 . 1 1 110 110 ASP H H 110 9.087 9.087 8.553 0.534 25324 11372 1 16 . 1 1 111 111 GLY N N 111 103.841 103.841 106.919 -3.078 25324 11373 1 16 . 1 1 111 111 GLY C C 111 173.924 173.924 174.696 -0.772 25324 11374 1 16 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.121 0.042 25324 11375 1 16 . 1 1 111 111 GLY H H 111 8.930 8.930 8.387 0.543 25324 11376 1 16 . 1 1 112 112 GLN N N 112 121.626 121.626 119.817 1.809 25324 11377 1 16 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.186 -0.116 25324 11378 1 16 . 1 1 112 112 GLN C C 112 176.431 176.431 175.181 1.250 25324 11379 1 16 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.372 -0.099 25324 11380 1 16 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.358 -1.665 25324 11381 1 16 . 1 1 112 112 GLN H H 112 7.351 7.351 8.406 -1.055 25324 11382 1 16 . 1 1 113 113 THR N N 113 112.322 112.322 106.913 5.409 25324 11383 1 16 . 1 1 113 113 THR HA H 113 5.331 5.331 5.077 0.254 25324 11384 1 16 . 1 1 113 113 THR C C 113 174.452 174.452 172.382 2.070 25324 11385 1 16 . 1 1 113 113 THR CA C 113 59.739 59.739 59.559 0.180 25324 11386 1 16 . 1 1 113 113 THR CB C 113 71.773 71.773 72.211 -0.438 25324 11387 1 16 . 1 1 113 113 THR H H 113 10.053 10.053 7.720 2.333 25324 11388 1 16 . 1 1 114 114 LEU N N 114 122.083 122.083 122.588 -0.505 25324 11389 1 16 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.675 -0.094 25324 11390 1 16 . 1 1 114 114 LEU C C 114 175.113 175.113 173.667 1.446 25324 11391 1 16 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.443 -1.538 25324 11392 1 16 . 1 1 114 114 LEU CB C 114 47.033 47.033 45.701 1.332 25324 11393 1 16 . 1 1 114 114 LEU H H 114 8.978 8.978 8.771 0.207 25324 11394 1 16 . 1 1 115 115 ASN N N 115 118.846 118.846 120.948 -2.102 25324 11395 1 16 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.681 0.089 25324 11396 1 16 . 1 1 115 115 ASN C C 115 174.788 174.788 174.113 0.675 25324 11397 1 16 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.769 0.573 25324 11398 1 16 . 1 1 115 115 ASN CB C 115 43.414 43.414 41.989 1.425 25324 11399 1 16 . 1 1 115 115 ASN H H 115 8.837 8.837 8.067 0.770 25324 11400 1 16 . 1 1 116 116 GLY N N 116 109.661 109.661 105.819 3.842 25324 11401 1 16 . 1 1 116 116 GLY C C 116 172.452 172.452 172.805 -0.353 25324 11402 1 16 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.233 0.237 25324 11403 1 16 . 1 1 116 116 GLY H H 116 8.625 8.625 8.838 -0.213 25324 11404 1 16 . 1 1 117 117 THR N N 117 120.009 120.009 114.767 5.242 25324 11405 1 16 . 1 1 117 117 THR HA H 117 5.556 5.556 5.532 0.024 25324 11406 1 16 . 1 1 117 117 THR C C 117 171.619 171.619 173.253 -1.634 25324 11407 1 16 . 1 1 117 117 THR CA C 117 59.373 59.373 60.463 -1.090 25324 11408 1 16 . 1 1 117 117 THR CB C 117 72.777 72.777 72.756 0.021 25324 11409 1 16 . 1 1 117 117 THR H H 117 8.911 8.911 8.940 -0.029 25324 11410 1 16 . 1 1 118 118 MET N N 118 115.550 115.550 117.130 -1.580 25324 11411 1 16 . 1 1 118 118 MET HA H 118 4.889 4.889 5.420 -0.531 25324 11412 1 16 . 1 1 118 118 MET C C 118 172.707 172.707 173.963 -1.256 25324 11413 1 16 . 1 1 118 118 MET CA C 118 54.714 54.714 54.948 -0.234 25324 11414 1 16 . 1 1 118 118 MET CB C 118 33.663 33.663 37.242 -3.579 25324 11415 1 16 . 1 1 118 118 MET H H 118 9.159 9.159 9.408 -0.249 25324 11416 1 16 . 1 1 119 119 THR N N 119 113.716 113.716 113.936 -0.220 25324 11417 1 16 . 1 1 119 119 THR HA H 119 4.682 4.682 4.923 -0.241 25324 11418 1 16 . 1 1 119 119 THR C C 119 173.952 173.952 173.265 0.687 25324 11419 1 16 . 1 1 119 119 THR CA C 119 61.395 61.395 62.009 -0.614 25324 11420 1 16 . 1 1 119 119 THR CB C 119 71.746 71.746 72.638 -0.892 25324 11421 1 16 . 1 1 119 119 THR H H 119 8.685 8.685 8.584 0.101 25324 11422 1 16 . 1 1 120 120 TYR N N 120 129.153 129.153 123.779 5.374 25324 11423 1 16 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.997 -0.197 25324 11424 1 16 . 1 1 120 120 TYR C C 120 175.214 175.214 177.481 -2.267 25324 11425 1 16 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.582 1.295 25324 11426 1 16 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.355 0.147 25324 11427 1 16 . 1 1 120 120 TYR H H 120 10.107 10.107 9.018 1.089 25324 11428 1 16 . 1 1 121 121 ALA N N 121 119.947 119.947 123.992 -4.045 25324 11429 1 16 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.230 -0.226 25324 11430 1 16 . 1 1 121 121 ALA C C 121 178.456 178.456 177.141 1.315 25324 11431 1 16 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.019 0.937 25324 11432 1 16 . 1 1 121 121 ALA CB C 121 18.710 18.710 17.209 1.500 25324 11433 1 16 . 1 1 121 121 ALA H H 121 8.704 8.704 8.854 -0.150 25324 11434 1 16 . 1 1 122 122 GLY N N 122 111.186 111.186 106.277 4.909 25324 11435 1 16 . 1 1 122 122 GLY C C 122 173.949 173.949 173.027 0.922 25324 11436 1 16 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.148 -0.145 25324 11437 1 16 . 1 1 122 122 GLY H H 122 8.792 8.792 8.133 0.659 25324 11438 1 16 . 1 1 123 123 GLU N N 123 120.099 120.099 120.157 -0.058 25324 11439 1 16 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.687 0.018 25324 11440 1 16 . 1 1 123 123 GLU C C 123 175.912 175.912 176.135 -0.223 25324 11441 1 16 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.724 -0.310 25324 11442 1 16 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.666 0.118 25324 11443 1 16 . 1 1 123 123 GLU H H 123 8.072 8.072 7.815 0.257 25324 11444 1 16 . 1 1 124 124 GLY N N 124 105.303 105.303 109.504 -4.201 25324 11445 1 16 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.727 0.075 25324 11446 1 16 . 1 1 124 124 GLY H H 124 7.939 7.939 8.331 -0.392 25324 11447 1 16 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.514 0.421 25324 11448 1 16 . 1 1 125 125 PRO C C 125 177.788 177.788 176.138 1.650 25324 11449 1 16 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.383 -0.252 25324 11450 1 16 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.852 0.006 25324 11451 1 16 . 1 1 126 126 ILE N N 126 117.387 117.387 120.560 -3.173 25324 11452 1 16 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.744 0.155 25324 11453 1 16 . 1 1 126 126 ILE C C 126 175.625 175.625 175.163 0.462 25324 11454 1 16 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.098 0.355 25324 11455 1 16 . 1 1 126 126 ILE CB C 126 42.548 42.548 42.219 0.329 25324 11456 1 16 . 1 1 126 126 ILE H H 126 9.599 9.599 8.889 0.710 25324 11457 1 16 . 1 1 127 127 GLY N N 127 106.753 106.753 109.388 -2.635 25324 11458 1 16 . 1 1 127 127 GLY C C 127 173.627 173.627 172.712 0.915 25324 11459 1 16 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.375 1.908 25324 11460 1 16 . 1 1 127 127 GLY H H 127 8.840 8.840 8.709 0.131 25324 11461 1 16 . 1 1 128 128 PHE N N 128 124.826 124.826 125.574 -0.748 25324 11462 1 16 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.505 -0.561 25324 11463 1 16 . 1 1 128 128 PHE C C 128 173.087 173.087 173.287 -0.200 25324 11464 1 16 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.522 0.487 25324 11465 1 16 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.457 -0.297 25324 11466 1 16 . 1 1 128 128 PHE H H 128 8.924 8.924 8.967 -0.043 25324 11467 1 16 . 1 1 129 129 LYS N N 129 131.518 131.518 127.327 4.191 25324 11468 1 16 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.692 0.191 25324 11469 1 16 . 1 1 129 129 LYS C C 129 173.863 173.863 173.648 0.215 25324 11470 1 16 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.527 1.208 25324 11471 1 16 . 1 1 129 129 LYS CB C 129 34.721 34.721 36.332 -1.611 25324 11472 1 16 . 1 1 129 129 LYS H H 129 8.201 8.201 8.469 -0.268 25324 11473 1 16 . 1 1 130 130 GLY N N 130 114.030 114.030 112.462 1.568 25324 11474 1 16 . 1 1 130 130 GLY C C 130 171.951 171.951 172.057 -0.106 25324 11475 1 16 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.990 -0.203 25324 11476 1 16 . 1 1 130 130 GLY H H 130 9.325 9.325 8.788 0.537 25324 11477 1 16 . 1 1 131 131 THR N N 131 120.583 120.583 119.688 0.895 25324 11478 1 16 . 1 1 131 131 THR HA H 131 4.939 4.939 4.808 0.131 25324 11479 1 16 . 1 1 131 131 THR C C 131 173.118 173.118 173.681 -0.563 25324 11480 1 16 . 1 1 131 131 THR CA C 131 61.266 61.266 61.642 -0.376 25324 11481 1 16 . 1 1 131 131 THR CB C 131 70.392 70.392 72.296 -1.904 25324 11482 1 16 . 1 1 131 131 THR H H 131 8.916 8.916 8.273 0.643 25324 11483 1 16 . 1 1 132 132 LEU N N 132 130.774 130.774 129.808 0.966 25324 11484 1 16 . 1 1 132 132 LEU HA H 132 3.500 3.500 4.688 -1.188 25324 11485 1 16 . 1 1 132 132 LEU C C 132 176.574 176.574 176.107 0.467 25324 11486 1 16 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.231 0.956 25324 11487 1 16 . 1 1 132 132 LEU CB C 132 42.447 42.447 43.177 -0.730 25324 11488 1 16 . 1 1 132 132 LEU H H 132 8.527 8.527 8.832 -0.305 25324 11489 1 17 . 1 1 3 3 LEU N N 3 123.202 123.202 117.127 6.075 25324 11490 1 17 . 1 1 3 3 LEU HA H 3 5.157 5.157 3.979 1.178 25324 11491 1 17 . 1 1 3 3 LEU C C 3 175.786 175.786 174.101 1.685 25324 11492 1 17 . 1 1 3 3 LEU CA C 3 54.284 54.284 55.150 -0.866 25324 11493 1 17 . 1 1 3 3 LEU CB C 3 43.330 43.330 42.592 0.738 25324 11494 1 17 . 1 1 3 3 LEU H H 3 8.711 8.711 8.122 0.589 25324 11495 1 17 . 1 1 4 4 TYR N N 4 120.906 120.906 118.977 1.929 25324 11496 1 17 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.238 -0.214 25324 11497 1 17 . 1 1 4 4 TYR C C 4 175.953 175.953 175.339 0.614 25324 11498 1 17 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.297 0.079 25324 11499 1 17 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.385 -0.730 25324 11500 1 17 . 1 1 4 4 TYR H H 4 9.142 9.142 9.078 0.064 25324 11501 1 17 . 1 1 5 5 ASN N N 5 120.496 120.496 118.662 1.834 25324 11502 1 17 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.921 0.195 25324 11503 1 17 . 1 1 5 5 ASN C C 5 174.953 174.953 173.736 1.217 25324 11504 1 17 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.517 0.430 25324 11505 1 17 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.391 -1.500 25324 11506 1 17 . 1 1 5 5 ASN H H 5 8.787 8.787 8.891 -0.104 25324 11507 1 17 . 1 1 6 6 VAL N N 6 127.428 127.428 121.957 5.471 25324 11508 1 17 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.134 0.228 25324 11509 1 17 . 1 1 6 6 VAL C C 6 174.955 174.955 174.745 0.210 25324 11510 1 17 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.484 -0.051 25324 11511 1 17 . 1 1 6 6 VAL CB C 6 33.331 33.331 32.680 0.651 25324 11512 1 17 . 1 1 6 6 VAL H H 6 8.806 8.806 8.581 0.225 25324 11513 1 17 . 1 1 7 7 GLU N N 7 124.355 124.355 127.484 -3.129 25324 11514 1 17 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.956 0.026 25324 11515 1 17 . 1 1 7 7 GLU C C 7 174.551 174.551 174.879 -0.328 25324 11516 1 17 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.728 -0.939 25324 11517 1 17 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.431 2.135 25324 11518 1 17 . 1 1 7 7 GLU H H 7 8.800 8.800 8.847 -0.047 25324 11519 1 17 . 1 1 8 8 ASN N N 8 116.231 116.231 122.189 -5.958 25324 11520 1 17 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.796 0.245 25324 11521 1 17 . 1 1 8 8 ASN C C 8 172.709 172.709 173.720 -1.011 25324 11522 1 17 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.664 -1.048 25324 11523 1 17 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.398 2.187 25324 11524 1 17 . 1 1 8 8 ASN H H 8 9.320 9.320 9.344 -0.024 25324 11525 1 17 . 1 1 9 9 GLN N N 9 120.762 120.762 121.943 -1.181 25324 11526 1 17 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.633 -0.459 25324 11527 1 17 . 1 1 9 9 GLN C C 9 173.454 173.454 174.088 -0.634 25324 11528 1 17 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.511 -0.551 25324 11529 1 17 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.095 -0.404 25324 11530 1 17 . 1 1 9 9 GLN H H 9 6.887 6.887 8.840 -1.953 25324 11531 1 17 . 1 1 10 10 TRP N N 10 127.775 127.775 124.144 3.631 25324 11532 1 17 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.058 -0.070 25324 11533 1 17 . 1 1 10 10 TRP C C 10 175.281 175.281 175.400 -0.119 25324 11534 1 17 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.920 -0.627 25324 11535 1 17 . 1 1 10 10 TRP CB C 10 29.742 29.742 29.608 0.134 25324 11536 1 17 . 1 1 10 10 TRP H H 10 8.518 8.518 8.141 0.377 25324 11537 1 17 . 1 1 11 11 GLY N N 11 107.838 107.838 109.994 -2.156 25324 11538 1 17 . 1 1 11 11 GLY C C 11 174.733 174.733 175.808 -1.075 25324 11539 1 17 . 1 1 11 11 GLY CA C 11 44.836 44.836 43.656 1.180 25324 11540 1 17 . 1 1 11 11 GLY H H 11 8.461 8.461 7.982 0.479 25324 11541 1 17 . 1 1 12 12 GLY N N 12 109.696 109.696 108.494 1.202 25324 11542 1 17 . 1 1 12 12 GLY C C 12 174.133 174.133 173.960 0.173 25324 11543 1 17 . 1 1 12 12 GLY CA C 12 43.789 43.789 45.622 -1.833 25324 11544 1 17 . 1 1 12 12 GLY H H 12 8.138 8.138 8.339 -0.201 25324 11545 1 17 . 1 1 13 13 SER N N 13 111.308 111.308 115.074 -3.766 25324 11546 1 17 . 1 1 13 13 SER HA H 13 4.092 4.092 4.485 -0.393 25324 11547 1 17 . 1 1 13 13 SER C C 13 175.622 175.622 173.496 2.126 25324 11548 1 17 . 1 1 13 13 SER CA C 13 60.494 60.494 57.486 3.008 25324 11549 1 17 . 1 1 13 13 SER CB C 13 63.028 63.028 63.512 -0.484 25324 11550 1 17 . 1 1 13 13 SER H H 13 8.215 8.215 7.810 0.405 25324 11551 1 17 . 1 1 14 14 SER N N 14 115.290 115.290 115.038 0.252 25324 11552 1 17 . 1 1 14 14 SER HA H 14 4.566 4.566 4.208 0.358 25324 11553 1 17 . 1 1 14 14 SER C C 14 173.532 173.532 172.990 0.542 25324 11554 1 17 . 1 1 14 14 SER CA C 14 57.317 57.317 58.694 -1.377 25324 11555 1 17 . 1 1 14 14 SER CB C 14 63.230 63.230 62.793 0.437 25324 11556 1 17 . 1 1 14 14 SER H H 14 8.213 8.213 8.261 -0.048 25324 11557 1 17 . 1 1 15 15 ALA N N 15 126.470 126.470 124.152 2.318 25324 11558 1 17 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.477 -0.074 25324 11559 1 17 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.122 0.342 25324 11560 1 17 . 1 1 15 15 ALA CB C 15 18.229 18.229 19.240 -1.011 25324 11561 1 17 . 1 1 15 15 ALA H H 15 7.308 7.308 7.621 -0.313 25324 11562 1 17 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.291 0.118 25324 11563 1 17 . 1 1 16 16 PRO C C 16 175.627 175.627 175.443 0.184 25324 11564 1 17 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.024 0.368 25324 11565 1 17 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.775 -0.638 25324 11566 1 17 . 1 1 17 17 TRP N N 17 120.228 120.228 118.584 1.644 25324 11567 1 17 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.630 -0.312 25324 11568 1 17 . 1 1 17 17 TRP C C 17 175.951 175.951 176.283 -0.332 25324 11569 1 17 . 1 1 17 17 TRP CA C 17 56.915 56.915 57.076 -0.161 25324 11570 1 17 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.321 -0.912 25324 11571 1 17 . 1 1 17 17 TRP H H 17 8.380 8.380 8.135 0.245 25324 11572 1 17 . 1 1 18 18 ASN N N 18 120.663 120.663 122.923 -2.260 25324 11573 1 17 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.129 -0.043 25324 11574 1 17 . 1 1 18 18 ASN C C 18 174.793 174.793 174.410 0.383 25324 11575 1 17 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.108 -0.507 25324 11576 1 17 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.020 1.628 25324 11577 1 17 . 1 1 18 18 ASN H H 18 9.094 9.094 9.067 0.027 25324 11578 1 17 . 1 1 19 19 GLU N N 19 122.202 122.202 124.004 -1.802 25324 11579 1 17 . 1 1 19 19 GLU HA H 19 4.139 4.139 5.028 -0.889 25324 11580 1 17 . 1 1 19 19 GLU C C 19 176.869 176.869 176.754 0.115 25324 11581 1 17 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.120 2.480 25324 11582 1 17 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.742 -0.360 25324 11583 1 17 . 1 1 19 19 GLU H H 19 9.013 9.013 8.958 0.055 25324 11584 1 17 . 1 1 20 20 GLY N N 20 112.893 112.893 112.492 0.401 25324 11585 1 17 . 1 1 20 20 GLY C C 20 174.878 174.878 173.189 1.689 25324 11586 1 17 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.945 0.050 25324 11587 1 17 . 1 1 20 20 GLY H H 20 8.926 8.926 8.398 0.528 25324 11588 1 17 . 1 1 21 21 GLY N N 21 110.354 110.354 106.980 3.374 25324 11589 1 17 . 1 1 21 21 GLY C C 21 171.623 171.623 171.754 -0.131 25324 11590 1 17 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.493 -1.095 25324 11591 1 17 . 1 1 21 21 GLY H H 21 8.258 8.258 7.539 0.719 25324 11592 1 17 . 1 1 22 22 GLN N N 22 117.541 117.541 117.287 0.254 25324 11593 1 17 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.661 1.016 25324 11594 1 17 . 1 1 22 22 GLN C C 22 175.957 175.957 174.086 1.871 25324 11595 1 17 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.818 0.126 25324 11596 1 17 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.504 -1.419 25324 11597 1 17 . 1 1 22 22 GLN H H 22 8.564 8.564 8.547 0.017 25324 11598 1 17 . 1 1 23 23 TRP N N 23 127.208 127.208 121.377 5.831 25324 11599 1 17 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.160 0.039 25324 11600 1 17 . 1 1 23 23 TRP CA C 23 54.531 54.531 53.856 0.675 25324 11601 1 17 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.593 -0.910 25324 11602 1 17 . 1 1 23 23 TRP H H 23 9.347 9.347 8.908 0.439 25324 11603 1 17 . 1 1 24 24 GLU N N 24 123.504 123.504 121.643 1.861 25324 11604 1 17 . 1 1 24 24 GLU HA H 24 5.508 5.508 4.962 0.546 25324 11605 1 17 . 1 1 24 24 GLU C C 24 174.222 174.222 175.034 -0.812 25324 11606 1 17 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.237 0.354 25324 11607 1 17 . 1 1 24 24 GLU CB C 24 30.615 30.615 31.512 -0.897 25324 11608 1 17 . 1 1 24 24 GLU H H 24 9.296 9.296 8.733 0.563 25324 11609 1 17 . 1 1 25 25 ILE N N 25 123.447 123.447 124.649 -1.202 25324 11610 1 17 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.667 -0.231 25324 11611 1 17 . 1 1 25 25 ILE C C 25 175.790 175.790 173.994 1.796 25324 11612 1 17 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.068 -0.441 25324 11613 1 17 . 1 1 25 25 ILE CB C 25 40.952 40.952 41.977 -1.025 25324 11614 1 17 . 1 1 25 25 ILE H H 25 8.635 8.635 8.480 0.155 25324 11615 1 17 . 1 1 26 26 GLY N N 26 111.544 111.544 111.239 0.305 25324 11616 1 17 . 1 1 26 26 GLY C C 26 172.122 172.122 174.640 -2.518 25324 11617 1 17 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.819 -0.741 25324 11618 1 17 . 1 1 26 26 GLY H H 26 3.381 3.381 7.612 -4.231 25324 11619 1 17 . 1 1 27 27 SER N N 27 112.279 112.279 116.618 -4.339 25324 11620 1 17 . 1 1 27 27 SER HA H 27 4.876 4.876 4.522 0.354 25324 11621 1 17 . 1 1 27 27 SER C C 27 174.113 174.113 174.501 -0.388 25324 11622 1 17 . 1 1 27 27 SER CA C 27 56.954 56.954 58.787 -1.833 25324 11623 1 17 . 1 1 27 27 SER CB C 27 64.554 64.554 64.126 0.428 25324 11624 1 17 . 1 1 27 27 SER H H 27 8.212 8.212 8.836 -0.624 25324 11625 1 17 . 1 1 28 28 ARG N N 28 120.872 120.872 119.970 0.902 25324 11626 1 17 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.698 0.065 25324 11627 1 17 . 1 1 28 28 ARG C C 28 176.119 176.119 174.681 1.438 25324 11628 1 17 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.579 -0.462 25324 11629 1 17 . 1 1 28 28 ARG CB C 28 31.830 31.830 32.154 -0.324 25324 11630 1 17 . 1 1 28 28 ARG H H 28 7.849 7.849 7.857 -0.008 25324 11631 1 17 . 1 1 29 29 SER N N 29 118.985 118.985 116.201 2.784 25324 11632 1 17 . 1 1 29 29 SER HA H 29 4.192 4.192 4.426 -0.234 25324 11633 1 17 . 1 1 29 29 SER C C 29 174.622 174.622 175.517 -0.895 25324 11634 1 17 . 1 1 29 29 SER CA C 29 60.072 60.072 58.674 1.398 25324 11635 1 17 . 1 1 29 29 SER CB C 29 62.876 62.876 63.696 -0.820 25324 11636 1 17 . 1 1 29 29 SER H H 29 8.892 8.892 8.775 0.117 25324 11637 1 17 . 1 1 30 30 ASP N N 30 117.632 117.632 119.739 -2.107 25324 11638 1 17 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.547 0.071 25324 11639 1 17 . 1 1 30 30 ASP C C 30 175.101 175.101 176.374 -1.273 25324 11640 1 17 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.490 -2.438 25324 11641 1 17 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.050 -0.527 25324 11642 1 17 . 1 1 30 30 ASP H H 30 8.441 8.441 8.257 0.184 25324 11643 1 17 . 1 1 31 31 GLN N N 31 118.273 118.273 117.911 0.362 25324 11644 1 17 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.513 -0.028 25324 11645 1 17 . 1 1 31 31 GLN C C 31 173.453 173.453 174.390 -0.937 25324 11646 1 17 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.798 0.070 25324 11647 1 17 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.848 2.401 25324 11648 1 17 . 1 1 31 31 GLN H H 31 7.029 7.029 7.736 -0.707 25324 11649 1 17 . 1 1 32 32 ASN N N 32 120.865 120.865 119.650 1.215 25324 11650 1 17 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.917 0.203 25324 11651 1 17 . 1 1 32 32 ASN C C 32 175.198 175.198 175.163 0.035 25324 11652 1 17 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.644 -0.775 25324 11653 1 17 . 1 1 32 32 ASN CB C 32 39.630 39.630 39.956 -0.326 25324 11654 1 17 . 1 1 32 32 ASN H H 32 8.713 8.713 8.655 0.058 25324 11655 1 17 . 1 1 33 33 VAL N N 33 122.111 122.111 120.567 1.544 25324 11656 1 17 . 1 1 33 33 VAL HA H 33 3.705 3.705 3.864 -0.159 25324 11657 1 17 . 1 1 33 33 VAL C C 33 174.950 174.950 175.926 -0.976 25324 11658 1 17 . 1 1 33 33 VAL CA C 33 63.847 63.847 63.233 0.614 25324 11659 1 17 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.454 0.896 25324 11660 1 17 . 1 1 33 33 VAL H H 33 8.542 8.542 8.208 0.334 25324 11661 1 17 . 1 1 34 34 VAL N N 34 113.282 113.282 120.694 -7.412 25324 11662 1 17 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.437 0.208 25324 11663 1 17 . 1 1 34 34 VAL C C 34 175.574 175.574 174.902 0.672 25324 11664 1 17 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.783 -1.809 25324 11665 1 17 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.164 -0.135 25324 11666 1 17 . 1 1 34 34 VAL H H 34 8.744 8.744 8.129 0.615 25324 11667 1 17 . 1 1 35 35 ALA N N 35 122.102 122.102 120.963 1.139 25324 11668 1 17 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.120 -0.317 25324 11669 1 17 . 1 1 35 35 ALA C C 35 175.947 175.947 174.905 1.042 25324 11670 1 17 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.105 2.145 25324 11671 1 17 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.452 -0.824 25324 11672 1 17 . 1 1 35 35 ALA H H 35 7.677 7.677 7.858 -0.181 25324 11673 1 17 . 1 1 36 36 ILE N N 36 118.005 118.005 120.734 -2.729 25324 11674 1 17 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.239 -0.211 25324 11675 1 17 . 1 1 36 36 ILE C C 36 173.116 173.116 173.745 -0.629 25324 11676 1 17 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.178 1.004 25324 11677 1 17 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.704 0.781 25324 11678 1 17 . 1 1 36 36 ILE H H 36 8.126 8.126 8.764 -0.638 25324 11679 1 17 . 1 1 37 37 ASN N N 37 125.632 125.632 126.044 -0.412 25324 11680 1 17 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.892 -0.211 25324 11681 1 17 . 1 1 37 37 ASN C C 37 174.854 174.854 173.518 1.336 25324 11682 1 17 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.101 0.429 25324 11683 1 17 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.654 -2.801 25324 11684 1 17 . 1 1 37 37 ASN H H 37 8.577 8.577 8.720 -0.143 25324 11685 1 17 . 1 1 38 38 VAL N N 38 114.223 114.223 118.415 -4.192 25324 11686 1 17 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.893 0.310 25324 11687 1 17 . 1 1 38 38 VAL C C 38 174.854 174.854 173.324 1.530 25324 11688 1 17 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.869 -1.889 25324 11689 1 17 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.336 0.708 25324 11690 1 17 . 1 1 38 38 VAL H H 38 8.874 8.874 8.720 0.154 25324 11691 1 17 . 1 1 39 39 GLU N N 39 118.277 118.277 121.373 -3.096 25324 11692 1 17 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.314 -0.232 25324 11693 1 17 . 1 1 39 39 GLU C C 39 174.548 174.548 174.969 -0.421 25324 11694 1 17 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.221 0.772 25324 11695 1 17 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.396 -0.818 25324 11696 1 17 . 1 1 39 39 GLU H H 39 8.761 8.761 9.015 -0.254 25324 11697 1 17 . 1 1 40 40 SER N N 40 114.960 114.960 118.692 -3.732 25324 11698 1 17 . 1 1 40 40 SER HA H 40 5.265 5.265 5.056 0.209 25324 11699 1 17 . 1 1 40 40 SER C C 40 175.783 175.783 175.359 0.424 25324 11700 1 17 . 1 1 40 40 SER CA C 40 55.880 55.880 57.886 -2.006 25324 11701 1 17 . 1 1 40 40 SER CB C 40 65.911 65.911 63.911 2.000 25324 11702 1 17 . 1 1 40 40 SER H H 40 8.500 8.500 8.467 0.033 25324 11703 1 17 . 1 1 41 41 GLY N N 41 117.567 117.567 109.293 8.274 25324 11704 1 17 . 1 1 41 41 GLY C C 41 174.119 174.119 174.045 0.074 25324 11705 1 17 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.054 -0.366 25324 11706 1 17 . 1 1 41 41 GLY H H 41 9.533 9.533 8.628 0.905 25324 11707 1 17 . 1 1 42 42 ASP N N 42 122.141 122.141 120.253 1.888 25324 11708 1 17 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.814 -0.014 25324 11709 1 17 . 1 1 42 42 ASP C C 42 176.121 176.121 175.426 0.695 25324 11710 1 17 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.276 -1.129 25324 11711 1 17 . 1 1 42 42 ASP CB C 42 39.354 39.354 43.034 -3.680 25324 11712 1 17 . 1 1 42 42 ASP H H 42 8.644 8.644 7.563 1.081 25324 11713 1 17 . 1 1 43 43 ASP N N 43 116.025 116.025 120.608 -4.583 25324 11714 1 17 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.519 -0.290 25324 11715 1 17 . 1 1 43 43 ASP C C 43 176.018 176.018 176.155 -0.137 25324 11716 1 17 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.812 0.437 25324 11717 1 17 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.346 -0.788 25324 11718 1 17 . 1 1 43 43 ASP H H 43 9.111 9.111 8.656 0.455 25324 11719 1 17 . 1 1 44 44 GLY N N 44 104.263 104.263 107.163 -2.900 25324 11720 1 17 . 1 1 44 44 GLY C C 44 173.922 173.922 174.539 -0.617 25324 11721 1 17 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.355 -0.054 25324 11722 1 17 . 1 1 44 44 GLY H H 44 9.063 9.063 7.780 1.283 25324 11723 1 17 . 1 1 45 45 GLN N N 45 121.691 121.691 119.865 1.826 25324 11724 1 17 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.229 -0.143 25324 11725 1 17 . 1 1 45 45 GLN C C 45 176.284 176.284 175.706 0.578 25324 11726 1 17 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.105 0.013 25324 11727 1 17 . 1 1 45 45 GLN CB C 45 27.674 27.674 28.785 -1.111 25324 11728 1 17 . 1 1 45 45 GLN H H 45 7.356 7.356 8.530 -1.174 25324 11729 1 17 . 1 1 46 46 THR N N 46 111.843 111.843 107.090 4.753 25324 11730 1 17 . 1 1 46 46 THR HA H 46 5.355 5.355 5.312 0.043 25324 11731 1 17 . 1 1 46 46 THR C C 46 174.451 174.451 173.511 0.940 25324 11732 1 17 . 1 1 46 46 THR CA C 46 59.644 59.644 59.218 0.426 25324 11733 1 17 . 1 1 46 46 THR CB C 46 72.714 72.714 71.467 1.247 25324 11734 1 17 . 1 1 46 46 THR H H 46 10.123 10.123 7.546 2.577 25324 11735 1 17 . 1 1 47 47 LEU N N 47 119.302 119.302 124.377 -5.075 25324 11736 1 17 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.891 -0.084 25324 11737 1 17 . 1 1 47 47 LEU C C 47 175.487 175.487 174.850 0.637 25324 11738 1 17 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.837 -0.767 25324 11739 1 17 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.879 3.124 25324 11740 1 17 . 1 1 47 47 LEU H H 47 8.364 8.364 9.126 -0.762 25324 11741 1 17 . 1 1 48 48 ASN N N 48 116.844 116.844 120.543 -3.699 25324 11742 1 17 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.902 -0.173 25324 11743 1 17 . 1 1 48 48 ASN C C 48 174.460 174.460 174.710 -0.250 25324 11744 1 17 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.971 0.768 25324 11745 1 17 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.870 0.543 25324 11746 1 17 . 1 1 48 48 ASN H H 48 8.748 8.748 9.111 -0.363 25324 11747 1 17 . 1 1 49 49 GLY N N 49 109.417 109.417 109.356 0.061 25324 11748 1 17 . 1 1 49 49 GLY C C 49 172.126 172.126 172.223 -0.097 25324 11749 1 17 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.186 0.305 25324 11750 1 17 . 1 1 49 49 GLY H H 49 8.744 8.744 8.963 -0.219 25324 11751 1 17 . 1 1 50 50 THR N N 50 119.162 119.162 116.932 2.230 25324 11752 1 17 . 1 1 50 50 THR HA H 50 5.556 5.556 5.238 0.318 25324 11753 1 17 . 1 1 50 50 THR C C 50 171.790 171.790 172.532 -0.742 25324 11754 1 17 . 1 1 50 50 THR CA C 50 59.371 59.371 62.023 -2.652 25324 11755 1 17 . 1 1 50 50 THR CB C 50 72.799 72.799 71.636 1.163 25324 11756 1 17 . 1 1 50 50 THR H H 50 8.799 8.799 8.794 0.005 25324 11757 1 17 . 1 1 51 51 MET N N 51 115.232 115.232 126.348 -11.116 25324 11758 1 17 . 1 1 51 51 MET HA H 51 4.886 4.886 4.785 0.101 25324 11759 1 17 . 1 1 51 51 MET C C 51 172.708 172.708 173.787 -1.079 25324 11760 1 17 . 1 1 51 51 MET CA C 51 54.722 54.722 54.225 0.497 25324 11761 1 17 . 1 1 51 51 MET CB C 51 34.557 34.557 36.791 -2.235 25324 11762 1 17 . 1 1 51 51 MET H H 51 9.062 9.062 9.410 -0.348 25324 11763 1 17 . 1 1 52 52 THR N N 52 113.697 113.697 122.062 -8.365 25324 11764 1 17 . 1 1 52 52 THR HA H 52 4.682 4.682 5.137 -0.455 25324 11765 1 17 . 1 1 52 52 THR C C 52 173.952 173.952 173.568 0.384 25324 11766 1 17 . 1 1 52 52 THR CA C 52 61.395 61.395 61.411 -0.016 25324 11767 1 17 . 1 1 52 52 THR CB C 52 71.734 71.734 70.467 1.267 25324 11768 1 17 . 1 1 52 52 THR H H 52 8.685 8.685 8.853 -0.168 25324 11769 1 17 . 1 1 53 53 TYR N N 53 129.086 129.086 125.948 3.138 25324 11770 1 17 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.971 -0.171 25324 11771 1 17 . 1 1 53 53 TYR C C 53 175.214 175.214 175.608 -0.394 25324 11772 1 17 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.280 1.601 25324 11773 1 17 . 1 1 53 53 TYR CB C 53 40.512 40.512 41.239 -0.727 25324 11774 1 17 . 1 1 53 53 TYR H H 53 10.112 10.112 8.735 1.377 25324 11775 1 17 . 1 1 54 54 ALA N N 54 119.947 119.947 123.306 -3.359 25324 11776 1 17 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.251 -0.249 25324 11777 1 17 . 1 1 54 54 ALA C C 54 178.285 178.285 178.752 -0.467 25324 11778 1 17 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.527 0.444 25324 11779 1 17 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.645 0.072 25324 11780 1 17 . 1 1 54 54 ALA H H 54 8.704 8.704 8.550 0.154 25324 11781 1 17 . 1 1 55 55 GLY N N 55 110.940 110.940 114.151 -3.211 25324 11782 1 17 . 1 1 55 55 GLY C C 55 173.903 173.903 175.493 -1.590 25324 11783 1 17 . 1 1 55 55 GLY CA C 55 45.016 45.016 46.325 -1.309 25324 11784 1 17 . 1 1 55 55 GLY H H 55 8.745 8.745 8.647 0.098 25324 11785 1 17 . 1 1 56 56 GLU N N 56 120.073 120.073 123.142 -3.069 25324 11786 1 17 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.136 0.573 25324 11787 1 17 . 1 1 56 56 GLU C C 56 175.906 175.906 177.607 -1.701 25324 11788 1 17 . 1 1 56 56 GLU CA C 56 54.423 54.423 56.745 -2.322 25324 11789 1 17 . 1 1 56 56 GLU CB C 56 32.824 32.824 30.343 2.481 25324 11790 1 17 . 1 1 56 56 GLU H H 56 8.039 8.039 8.212 -0.173 25324 11791 1 17 . 1 1 57 57 GLY N N 57 105.298 105.298 109.218 -3.920 25324 11792 1 17 . 1 1 57 57 GLY CA C 57 43.802 43.802 44.339 -0.537 25324 11793 1 17 . 1 1 57 57 GLY H H 57 7.937 7.937 7.806 0.131 25324 11794 1 17 . 1 1 58 58 PRO HA H 58 4.934 4.934 5.222 -0.288 25324 11795 1 17 . 1 1 58 58 PRO C C 58 177.785 177.785 176.614 1.171 25324 11796 1 17 . 1 1 58 58 PRO CA C 58 63.132 63.132 62.866 0.266 25324 11797 1 17 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.585 -0.745 25324 11798 1 17 . 1 1 59 59 ILE N N 59 117.386 117.386 116.050 1.336 25324 11799 1 17 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.681 0.307 25324 11800 1 17 . 1 1 59 59 ILE C C 59 175.688 175.688 174.653 1.035 25324 11801 1 17 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.124 0.419 25324 11802 1 17 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.423 0.865 25324 11803 1 17 . 1 1 59 59 ILE H H 59 9.600 9.600 9.058 0.542 25324 11804 1 17 . 1 1 60 60 GLY N N 60 107.164 107.164 107.517 -0.353 25324 11805 1 17 . 1 1 60 60 GLY C C 60 173.787 173.787 172.424 1.363 25324 11806 1 17 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.482 1.753 25324 11807 1 17 . 1 1 60 60 GLY H H 60 8.957 8.957 8.333 0.624 25324 11808 1 17 . 1 1 61 61 PHE N N 61 124.597 124.597 125.473 -0.876 25324 11809 1 17 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.548 -0.325 25324 11810 1 17 . 1 1 61 61 PHE C C 61 173.126 173.126 173.437 -0.311 25324 11811 1 17 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.409 0.452 25324 11812 1 17 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.283 -0.066 25324 11813 1 17 . 1 1 61 61 PHE H H 61 8.788 8.788 8.976 -0.188 25324 11814 1 17 . 1 1 62 62 ARG N N 62 129.706 129.706 128.235 1.471 25324 11815 1 17 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.345 -0.213 25324 11816 1 17 . 1 1 62 62 ARG C C 62 172.456 172.456 173.189 -0.733 25324 11817 1 17 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.255 0.699 25324 11818 1 17 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.471 -1.601 25324 11819 1 17 . 1 1 62 62 ARG H H 62 8.405 8.405 8.467 -0.062 25324 11820 1 17 . 1 1 63 63 ALA N N 63 122.744 122.744 128.977 -6.233 25324 11821 1 17 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.379 -0.034 25324 11822 1 17 . 1 1 63 63 ALA C C 63 176.120 176.120 175.476 0.644 25324 11823 1 17 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.236 -0.317 25324 11824 1 17 . 1 1 63 63 ALA CB C 63 24.773 24.773 23.076 1.697 25324 11825 1 17 . 1 1 63 63 ALA H H 63 8.628 8.628 9.106 -0.478 25324 11826 1 17 . 1 1 64 64 THR N N 64 116.855 116.855 117.543 -0.688 25324 11827 1 17 . 1 1 64 64 THR HA H 64 4.848 4.848 5.203 -0.355 25324 11828 1 17 . 1 1 64 64 THR C C 64 172.957 172.957 173.585 -0.628 25324 11829 1 17 . 1 1 64 64 THR CA C 64 61.211 61.211 61.040 0.171 25324 11830 1 17 . 1 1 64 64 THR CB C 64 71.064 71.064 72.019 -0.955 25324 11831 1 17 . 1 1 64 64 THR H H 64 8.315 8.315 8.675 -0.360 25324 11832 1 17 . 1 1 65 65 LEU N N 65 129.360 129.360 128.784 0.576 25324 11833 1 17 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.896 -0.534 25324 11834 1 17 . 1 1 65 65 LEU C C 65 176.459 176.459 176.334 0.125 25324 11835 1 17 . 1 1 65 65 LEU CA C 65 55.687 55.687 55.606 0.081 25324 11836 1 17 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.028 -0.317 25324 11837 1 17 . 1 1 65 65 LEU H H 65 8.877 8.877 8.790 0.087 25324 11838 1 17 . 1 1 66 66 LEU N N 66 128.683 128.683 128.408 0.275 25324 11839 1 17 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.167 0.209 25324 11840 1 17 . 1 1 66 66 LEU C C 66 177.621 177.621 177.315 0.306 25324 11841 1 17 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.334 -1.633 25324 11842 1 17 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.693 -0.391 25324 11843 1 17 . 1 1 66 66 LEU H H 66 9.320 9.320 8.685 0.635 25324 11844 1 17 . 1 1 67 67 GLY N N 67 105.361 105.361 104.400 0.961 25324 11845 1 17 . 1 1 67 67 GLY C C 67 173.618 173.618 173.003 0.615 25324 11846 1 17 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.364 -1.997 25324 11847 1 17 . 1 1 67 67 GLY H H 67 6.639 6.639 7.798 -1.159 25324 11848 1 17 . 1 1 68 68 ASN N N 68 121.848 121.848 119.501 2.347 25324 11849 1 17 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.693 -0.362 25324 11850 1 17 . 1 1 68 68 ASN C C 68 174.316 174.316 174.593 -0.277 25324 11851 1 17 . 1 1 68 68 ASN CA C 68 54.552 54.552 52.710 1.842 25324 11852 1 17 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.258 -2.093 25324 11853 1 17 . 1 1 68 68 ASN H H 68 9.236 9.236 7.645 1.591 25324 11854 1 17 . 1 1 69 69 ASN N N 69 109.509 109.509 118.780 -9.271 25324 11855 1 17 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.210 -0.130 25324 11856 1 17 . 1 1 69 69 ASN C C 69 171.456 171.456 174.644 -3.188 25324 11857 1 17 . 1 1 69 69 ASN CA C 69 55.750 55.750 56.312 -0.562 25324 11858 1 17 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.637 -0.331 25324 11859 1 17 . 1 1 69 69 ASN H H 69 8.651 8.651 9.131 -0.480 25324 11860 1 17 . 1 1 70 70 SER N N 70 113.479 113.479 118.194 -4.715 25324 11861 1 17 . 1 1 70 70 SER HA H 70 5.437 5.437 4.932 0.505 25324 11862 1 17 . 1 1 70 70 SER C C 70 173.750 173.750 173.628 0.122 25324 11863 1 17 . 1 1 70 70 SER CA C 70 57.139 57.139 60.085 -2.946 25324 11864 1 17 . 1 1 70 70 SER CB C 70 63.818 63.818 64.130 -0.312 25324 11865 1 17 . 1 1 70 70 SER H H 70 7.693 7.693 7.989 -0.296 25324 11866 1 17 . 1 1 71 71 TYR N N 71 123.132 123.132 123.428 -0.296 25324 11867 1 17 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.019 0.124 25324 11868 1 17 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.813 -0.166 25324 11869 1 17 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.794 -0.349 25324 11870 1 17 . 1 1 71 71 TYR H H 71 9.326 9.326 9.520 -0.194 25324 11871 1 17 . 1 1 72 72 GLU N N 72 122.396 122.396 122.518 -0.122 25324 11872 1 17 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.841 -0.035 25324 11873 1 17 . 1 1 72 72 GLU C C 72 175.698 175.698 175.159 0.539 25324 11874 1 17 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.180 -0.013 25324 11875 1 17 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.684 -1.500 25324 11876 1 17 . 1 1 72 72 GLU H H 72 8.624 8.624 9.123 -0.499 25324 11877 1 17 . 1 1 73 73 VAL N N 73 128.513 128.513 127.738 0.775 25324 11878 1 17 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.063 0.136 25324 11879 1 17 . 1 1 73 73 VAL C C 73 175.369 175.369 174.683 0.686 25324 11880 1 17 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.480 0.000 25324 11881 1 17 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.795 0.538 25324 11882 1 17 . 1 1 73 73 VAL H H 73 8.564 8.564 8.865 -0.301 25324 11883 1 17 . 1 1 74 74 GLU N N 74 124.842 124.842 125.659 -0.817 25324 11884 1 17 . 1 1 74 74 GLU HA H 74 5.087 5.087 4.881 0.206 25324 11885 1 17 . 1 1 74 74 GLU C C 74 174.415 174.415 174.895 -0.480 25324 11886 1 17 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.712 -0.375 25324 11887 1 17 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.238 1.919 25324 11888 1 17 . 1 1 74 74 GLU H H 74 9.011 9.011 8.909 0.102 25324 11889 1 17 . 1 1 75 75 ASN N N 75 116.136 116.136 120.595 -4.459 25324 11890 1 17 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.570 0.569 25324 11891 1 17 . 1 1 75 75 ASN C C 75 172.703 172.703 173.309 -0.606 25324 11892 1 17 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.375 -0.550 25324 11893 1 17 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.653 3.243 25324 11894 1 17 . 1 1 75 75 ASN H H 75 9.424 9.424 9.111 0.313 25324 11895 1 17 . 1 1 76 76 GLN N N 76 120.762 120.762 122.693 -1.931 25324 11896 1 17 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.256 -0.216 25324 11897 1 17 . 1 1 76 76 GLN C C 76 173.113 173.113 174.334 -1.221 25324 11898 1 17 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.233 -0.010 25324 11899 1 17 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.490 -0.142 25324 11900 1 17 . 1 1 76 76 GLN H H 76 7.106 7.106 8.862 -1.756 25324 11901 1 17 . 1 1 77 77 TRP N N 77 125.598 125.598 126.363 -0.765 25324 11902 1 17 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.133 0.019 25324 11903 1 17 . 1 1 77 77 TRP C C 77 175.502 175.502 174.957 0.545 25324 11904 1 17 . 1 1 77 77 TRP CA C 77 55.764 55.764 55.922 -0.158 25324 11905 1 17 . 1 1 77 77 TRP CB C 77 29.999 29.999 29.088 0.911 25324 11906 1 17 . 1 1 77 77 TRP H H 77 8.181 8.181 8.291 -0.110 25324 11907 1 17 . 1 1 78 78 GLY N N 78 107.901 107.901 107.852 0.049 25324 11908 1 17 . 1 1 78 78 GLY C C 78 174.611 174.611 175.107 -0.496 25324 11909 1 17 . 1 1 78 78 GLY CA C 78 44.902 44.902 46.879 -1.977 25324 11910 1 17 . 1 1 78 78 GLY H H 78 8.778 8.778 8.289 0.489 25324 11911 1 17 . 1 1 79 79 GLY N N 79 109.844 109.844 108.502 1.342 25324 11912 1 17 . 1 1 79 79 GLY C C 79 173.782 173.782 173.315 0.467 25324 11913 1 17 . 1 1 79 79 GLY CA C 79 43.793 43.793 45.076 -1.283 25324 11914 1 17 . 1 1 79 79 GLY H H 79 8.198 8.198 7.907 0.291 25324 11915 1 17 . 1 1 80 80 ASP N N 80 115.837 115.837 121.330 -5.493 25324 11916 1 17 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.888 -0.647 25324 11917 1 17 . 1 1 80 80 ASP C C 80 177.285 177.285 176.013 1.272 25324 11918 1 17 . 1 1 80 80 ASP CA C 80 56.183 56.183 53.772 2.411 25324 11919 1 17 . 1 1 80 80 ASP CB C 80 40.523 40.523 42.155 -1.632 25324 11920 1 17 . 1 1 80 80 ASP H H 80 8.132 8.132 8.143 -0.011 25324 11921 1 17 . 1 1 81 81 SER N N 81 112.690 112.690 122.009 -9.319 25324 11922 1 17 . 1 1 81 81 SER HA H 81 4.513 4.513 4.037 0.476 25324 11923 1 17 . 1 1 81 81 SER C C 81 173.684 173.684 173.764 -0.080 25324 11924 1 17 . 1 1 81 81 SER CA C 81 57.232 57.232 59.461 -2.229 25324 11925 1 17 . 1 1 81 81 SER CB C 81 63.170 63.170 62.907 0.263 25324 11926 1 17 . 1 1 81 81 SER H H 81 8.179 8.179 8.862 -0.683 25324 11927 1 17 . 1 1 82 82 ALA N N 82 126.310 126.310 123.092 3.218 25324 11928 1 17 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.029 0.374 25324 11929 1 17 . 1 1 82 82 ALA CA C 82 50.466 50.466 52.231 -1.765 25324 11930 1 17 . 1 1 82 82 ALA CB C 82 18.198 18.198 17.282 0.916 25324 11931 1 17 . 1 1 82 82 ALA H H 82 7.274 7.274 7.626 -0.352 25324 11932 1 17 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.220 0.153 25324 11933 1 17 . 1 1 83 83 PRO C C 83 175.378 175.378 176.149 -0.771 25324 11934 1 17 . 1 1 83 83 PRO CA C 83 62.327 62.327 63.786 -1.459 25324 11935 1 17 . 1 1 83 83 PRO CB C 83 32.164 32.164 31.700 0.464 25324 11936 1 17 . 1 1 84 84 TRP N N 84 120.106 120.106 114.994 5.112 25324 11937 1 17 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.095 0.176 25324 11938 1 17 . 1 1 84 84 TRP C C 84 176.358 176.358 174.062 2.296 25324 11939 1 17 . 1 1 84 84 TRP CA C 84 56.946 56.946 57.186 -0.240 25324 11940 1 17 . 1 1 84 84 TRP CB C 84 29.716 29.716 27.715 2.001 25324 11941 1 17 . 1 1 84 84 TRP H H 84 8.329 8.329 7.185 1.144 25324 11942 1 17 . 1 1 85 85 HIS N N 85 118.543 118.543 122.146 -3.603 25324 11943 1 17 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.907 0.011 25324 11944 1 17 . 1 1 85 85 HIS C C 85 174.950 174.950 175.102 -0.152 25324 11945 1 17 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.973 -1.504 25324 11946 1 17 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.406 -0.733 25324 11947 1 17 . 1 1 85 85 HIS H H 85 9.204 9.204 7.944 1.260 25324 11948 1 17 . 1 1 86 86 SER N N 86 117.803 117.803 118.301 -0.498 25324 11949 1 17 . 1 1 86 86 SER HA H 86 4.412 4.412 4.283 0.129 25324 11950 1 17 . 1 1 86 86 SER C C 86 175.691 175.691 174.235 1.456 25324 11951 1 17 . 1 1 86 86 SER CA C 86 60.257 60.257 59.598 0.659 25324 11952 1 17 . 1 1 86 86 SER CB C 86 63.015 63.015 63.438 -0.423 25324 11953 1 17 . 1 1 86 86 SER H H 86 9.168 9.168 8.887 0.281 25324 11954 1 17 . 1 1 87 87 GLY N N 87 115.773 115.773 110.937 4.836 25324 11955 1 17 . 1 1 87 87 GLY C C 87 174.288 174.288 173.676 0.612 25324 11956 1 17 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.868 -0.167 25324 11957 1 17 . 1 1 87 87 GLY H H 87 9.284 9.284 8.973 0.311 25324 11958 1 17 . 1 1 88 88 GLY N N 88 109.162 109.162 107.690 1.472 25324 11959 1 17 . 1 1 88 88 GLY C C 88 171.120 171.120 171.648 -0.528 25324 11960 1 17 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.932 -0.338 25324 11961 1 17 . 1 1 88 88 GLY H H 88 8.054 8.054 7.979 0.075 25324 11962 1 17 . 1 1 89 89 ASN N N 89 117.048 117.048 120.221 -3.173 25324 11963 1 17 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.581 0.457 25324 11964 1 17 . 1 1 89 89 ASN C C 89 175.287 175.287 174.740 0.547 25324 11965 1 17 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.422 -0.557 25324 11966 1 17 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.643 -1.038 25324 11967 1 17 . 1 1 89 89 ASN H H 89 8.516 8.516 8.712 -0.196 25324 11968 1 17 . 1 1 90 90 TRP N N 90 125.844 125.844 125.529 0.315 25324 11969 1 17 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.140 0.113 25324 11970 1 17 . 1 1 90 90 TRP C C 90 175.278 175.278 175.101 0.177 25324 11971 1 17 . 1 1 90 90 TRP CA C 90 54.268 54.268 53.935 0.333 25324 11972 1 17 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.203 -0.245 25324 11973 1 17 . 1 1 90 90 TRP H H 90 9.282 9.282 9.249 0.033 25324 11974 1 17 . 1 1 91 91 ILE N N 91 123.134 123.134 120.850 2.284 25324 11975 1 17 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.601 0.845 25324 11976 1 17 . 1 1 91 91 ILE C C 91 175.489 175.489 175.221 0.268 25324 11977 1 17 . 1 1 91 91 ILE CA C 91 60.826 60.826 61.114 -0.287 25324 11978 1 17 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.666 1.010 25324 11979 1 17 . 1 1 91 91 ILE H H 91 9.318 9.318 8.810 0.508 25324 11980 1 17 . 1 1 92 92 LEU N N 92 123.452 123.452 129.681 -6.229 25324 11981 1 17 . 1 1 92 92 LEU HA H 92 3.942 3.942 4.075 -0.133 25324 11982 1 17 . 1 1 92 92 LEU C C 92 173.620 173.620 174.827 -1.207 25324 11983 1 17 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.710 -1.454 25324 11984 1 17 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.964 1.544 25324 11985 1 17 . 1 1 92 92 LEU H H 92 8.463 8.463 9.157 -0.694 25324 11986 1 17 . 1 1 93 93 GLY N N 93 103.987 103.987 107.400 -3.413 25324 11987 1 17 . 1 1 93 93 GLY C C 93 172.284 172.284 174.690 -2.406 25324 11988 1 17 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.408 -1.908 25324 11989 1 17 . 1 1 93 93 GLY H H 93 2.937 2.937 7.350 -4.413 25324 11990 1 17 . 1 1 94 94 SER N N 94 110.274 110.274 117.305 -7.031 25324 11991 1 17 . 1 1 94 94 SER HA H 94 4.711 4.711 4.685 0.026 25324 11992 1 17 . 1 1 94 94 SER C C 94 174.784 174.784 174.981 -0.197 25324 11993 1 17 . 1 1 94 94 SER CA C 94 56.555 56.555 59.113 -2.558 25324 11994 1 17 . 1 1 94 94 SER CB C 94 65.051 65.051 64.336 0.715 25324 11995 1 17 . 1 1 94 94 SER H H 94 7.919 7.919 8.802 -0.883 25324 11996 1 17 . 1 1 95 95 ARG N N 95 123.020 123.020 121.933 1.087 25324 11997 1 17 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.553 0.119 25324 11998 1 17 . 1 1 95 95 ARG C C 95 176.120 176.120 176.983 -0.863 25324 11999 1 17 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.021 0.353 25324 12000 1 17 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.947 -0.099 25324 12001 1 17 . 1 1 95 95 ARG H H 95 9.148 9.148 7.805 1.343 25324 12002 1 17 . 1 1 96 96 GLU N N 96 120.357 120.357 123.018 -2.661 25324 12003 1 17 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.148 0.134 25324 12004 1 17 . 1 1 96 96 GLU C C 96 176.278 176.278 176.493 -0.215 25324 12005 1 17 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.825 -2.295 25324 12006 1 17 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.945 0.208 25324 12007 1 17 . 1 1 96 96 GLU H H 96 8.610 8.610 8.889 -0.279 25324 12008 1 17 . 1 1 97 97 ASN N N 97 117.678 117.678 116.358 1.320 25324 12009 1 17 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.845 -0.233 25324 12010 1 17 . 1 1 97 97 ASN C C 97 173.949 173.949 173.435 0.514 25324 12011 1 17 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.810 0.205 25324 12012 1 17 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.984 -0.818 25324 12013 1 17 . 1 1 97 97 ASN H H 97 8.533 8.533 8.178 0.355 25324 12014 1 17 . 1 1 98 98 GLN N N 98 118.592 118.592 119.382 -0.790 25324 12015 1 17 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.523 -0.163 25324 12016 1 17 . 1 1 98 98 GLN C C 98 173.116 173.116 173.389 -0.273 25324 12017 1 17 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.271 0.357 25324 12018 1 17 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.762 -0.893 25324 12019 1 17 . 1 1 98 98 GLN H H 98 7.663 7.663 7.645 0.018 25324 12020 1 17 . 1 1 99 99 ASN N N 99 122.855 122.855 121.834 1.021 25324 12021 1 17 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.122 0.013 25324 12022 1 17 . 1 1 99 99 ASN C C 99 175.287 175.287 175.284 0.003 25324 12023 1 17 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.172 0.818 25324 12024 1 17 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.506 -0.015 25324 12025 1 17 . 1 1 99 99 ASN H H 99 8.759 8.759 8.585 0.174 25324 12026 1 17 . 1 1 100 100 VAL N N 100 121.385 121.385 119.499 1.886 25324 12027 1 17 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.897 -0.149 25324 12028 1 17 . 1 1 100 100 VAL C C 100 174.956 174.956 176.788 -1.832 25324 12029 1 17 . 1 1 100 100 VAL CA C 100 63.843 63.843 64.156 -0.313 25324 12030 1 17 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.437 1.006 25324 12031 1 17 . 1 1 100 100 VAL H H 100 8.717 8.717 8.116 0.601 25324 12032 1 17 . 1 1 101 101 VAL N N 101 112.736 112.736 123.019 -10.283 25324 12033 1 17 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.442 0.203 25324 12034 1 17 . 1 1 101 101 VAL C C 101 175.577 175.577 174.479 1.098 25324 12035 1 17 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.627 -1.664 25324 12036 1 17 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.502 -0.461 25324 12037 1 17 . 1 1 101 101 VAL H H 101 8.802 8.802 8.784 0.018 25324 12038 1 17 . 1 1 102 102 ALA N N 102 122.104 122.104 120.568 1.536 25324 12039 1 17 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.073 -0.266 25324 12040 1 17 . 1 1 102 102 ALA C C 102 176.046 176.046 174.985 1.061 25324 12041 1 17 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.888 2.366 25324 12042 1 17 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.033 -0.408 25324 12043 1 17 . 1 1 102 102 ALA H H 102 7.677 7.677 7.615 0.062 25324 12044 1 17 . 1 1 103 103 ILE N N 103 118.218 118.218 121.749 -3.531 25324 12045 1 17 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.284 -0.257 25324 12046 1 17 . 1 1 103 103 ILE C C 103 173.118 173.118 173.824 -0.706 25324 12047 1 17 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.611 1.615 25324 12048 1 17 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.484 0.987 25324 12049 1 17 . 1 1 103 103 ILE H H 103 8.102 8.102 8.605 -0.503 25324 12050 1 17 . 1 1 104 104 ASN N N 104 125.938 125.938 126.997 -1.059 25324 12051 1 17 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.402 0.284 25324 12052 1 17 . 1 1 104 104 ASN C C 104 174.870 174.870 173.522 1.348 25324 12053 1 17 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.084 0.469 25324 12054 1 17 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.100 -1.248 25324 12055 1 17 . 1 1 104 104 ASN H H 104 8.668 8.668 8.947 -0.279 25324 12056 1 17 . 1 1 105 105 VAL N N 105 114.631 114.631 119.200 -4.569 25324 12057 1 17 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.142 0.063 25324 12058 1 17 . 1 1 105 105 VAL C C 105 174.788 174.788 173.374 1.414 25324 12059 1 17 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.082 -2.103 25324 12060 1 17 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.536 0.504 25324 12061 1 17 . 1 1 105 105 VAL H H 105 8.933 8.933 8.822 0.112 25324 12062 1 17 . 1 1 106 106 GLU N N 106 118.347 118.347 123.002 -4.655 25324 12063 1 17 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.105 -0.025 25324 12064 1 17 . 1 1 106 106 GLU C C 106 174.777 174.777 175.693 -0.916 25324 12065 1 17 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.819 0.148 25324 12066 1 17 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.099 -0.456 25324 12067 1 17 . 1 1 106 106 GLU H H 106 8.814 8.814 8.758 0.056 25324 12068 1 17 . 1 1 107 107 SER N N 107 115.335 115.335 122.670 -7.335 25324 12069 1 17 . 1 1 107 107 SER HA H 107 5.266 5.266 4.595 0.671 25324 12070 1 17 . 1 1 107 107 SER C C 107 175.787 175.787 175.886 -0.099 25324 12071 1 17 . 1 1 107 107 SER CA C 107 55.888 55.888 60.164 -4.276 25324 12072 1 17 . 1 1 107 107 SER CB C 107 65.921 65.921 63.866 2.055 25324 12073 1 17 . 1 1 107 107 SER H H 107 8.576 8.576 9.232 -0.656 25324 12074 1 17 . 1 1 108 108 GLY N N 108 117.567 117.567 106.924 10.643 25324 12075 1 17 . 1 1 108 108 GLY C C 108 173.959 173.959 173.935 0.024 25324 12076 1 17 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.294 -0.617 25324 12077 1 17 . 1 1 108 108 GLY H H 108 9.532 9.532 8.697 0.835 25324 12078 1 17 . 1 1 109 109 ASP N N 109 122.108 122.108 119.684 2.424 25324 12079 1 17 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.899 -0.098 25324 12080 1 17 . 1 1 109 109 ASP C C 109 176.203 176.203 175.096 1.107 25324 12081 1 17 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.479 -0.345 25324 12082 1 17 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.949 -3.607 25324 12083 1 17 . 1 1 109 109 ASP H H 109 8.605 8.605 7.469 1.136 25324 12084 1 17 . 1 1 110 110 ASP N N 110 116.197 116.197 119.330 -3.133 25324 12085 1 17 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.767 -0.545 25324 12086 1 17 . 1 1 110 110 ASP C C 110 175.951 175.951 176.710 -0.759 25324 12087 1 17 . 1 1 110 110 ASP CA C 110 55.198 55.198 54.086 1.112 25324 12088 1 17 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.744 -2.114 25324 12089 1 17 . 1 1 110 110 ASP H H 110 9.087 9.087 8.557 0.530 25324 12090 1 17 . 1 1 111 111 GLY N N 111 103.841 103.841 107.498 -3.657 25324 12091 1 17 . 1 1 111 111 GLY C C 111 173.924 173.924 174.943 -1.019 25324 12092 1 17 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.117 0.046 25324 12093 1 17 . 1 1 111 111 GLY H H 111 8.930 8.930 7.826 1.104 25324 12094 1 17 . 1 1 112 112 GLN N N 112 121.626 121.626 119.661 1.965 25324 12095 1 17 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.080 -0.010 25324 12096 1 17 . 1 1 112 112 GLN C C 112 176.431 176.431 175.693 0.738 25324 12097 1 17 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.855 -0.582 25324 12098 1 17 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.602 -1.909 25324 12099 1 17 . 1 1 112 112 GLN H H 112 7.351 7.351 8.108 -0.757 25324 12100 1 17 . 1 1 113 113 THR N N 113 112.322 112.322 107.962 4.360 25324 12101 1 17 . 1 1 113 113 THR HA H 113 5.331 5.331 5.255 0.076 25324 12102 1 17 . 1 1 113 113 THR C C 113 174.452 174.452 172.944 1.508 25324 12103 1 17 . 1 1 113 113 THR CA C 113 59.739 59.739 59.872 -0.133 25324 12104 1 17 . 1 1 113 113 THR CB C 113 71.773 71.773 71.625 0.148 25324 12105 1 17 . 1 1 113 113 THR H H 113 10.053 10.053 7.487 2.566 25324 12106 1 17 . 1 1 114 114 LEU N N 114 122.083 122.083 124.237 -2.154 25324 12107 1 17 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.679 -0.098 25324 12108 1 17 . 1 1 114 114 LEU C C 114 175.113 175.113 174.891 0.222 25324 12109 1 17 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.315 -1.410 25324 12110 1 17 . 1 1 114 114 LEU CB C 114 47.033 47.033 45.657 1.376 25324 12111 1 17 . 1 1 114 114 LEU H H 114 8.978 8.978 8.930 0.048 25324 12112 1 17 . 1 1 115 115 ASN N N 115 118.846 118.846 116.835 2.011 25324 12113 1 17 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.707 0.063 25324 12114 1 17 . 1 1 115 115 ASN C C 115 174.788 174.788 174.609 0.179 25324 12115 1 17 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.920 0.421 25324 12116 1 17 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.343 1.071 25324 12117 1 17 . 1 1 115 115 ASN H H 115 8.837 8.837 8.465 0.372 25324 12118 1 17 . 1 1 116 116 GLY N N 116 109.661 109.661 106.395 3.266 25324 12119 1 17 . 1 1 116 116 GLY C C 116 172.452 172.452 172.834 -0.382 25324 12120 1 17 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.233 0.238 25324 12121 1 17 . 1 1 116 116 GLY H H 116 8.625 8.625 8.945 -0.320 25324 12122 1 17 . 1 1 117 117 THR N N 117 120.009 120.009 114.406 5.603 25324 12123 1 17 . 1 1 117 117 THR HA H 117 5.556 5.556 5.653 -0.097 25324 12124 1 17 . 1 1 117 117 THR C C 117 171.619 171.619 173.096 -1.477 25324 12125 1 17 . 1 1 117 117 THR CA C 117 59.373 59.373 60.292 -0.919 25324 12126 1 17 . 1 1 117 117 THR CB C 117 72.777 72.777 72.992 -0.215 25324 12127 1 17 . 1 1 117 117 THR H H 117 8.911 8.911 9.043 -0.132 25324 12128 1 17 . 1 1 118 118 MET N N 118 115.550 115.550 117.678 -2.128 25324 12129 1 17 . 1 1 118 118 MET HA H 118 4.889 4.889 5.131 -0.242 25324 12130 1 17 . 1 1 118 118 MET C C 118 172.707 172.707 173.941 -1.234 25324 12131 1 17 . 1 1 118 118 MET CA C 118 54.714 54.714 54.485 0.229 25324 12132 1 17 . 1 1 118 118 MET CB C 118 33.663 33.663 36.826 -3.163 25324 12133 1 17 . 1 1 118 118 MET H H 118 9.159 9.159 9.264 -0.105 25324 12134 1 17 . 1 1 119 119 THR N N 119 113.716 113.716 116.681 -2.965 25324 12135 1 17 . 1 1 119 119 THR HA H 119 4.682 4.682 4.810 -0.128 25324 12136 1 17 . 1 1 119 119 THR C C 119 173.952 173.952 173.421 0.531 25324 12137 1 17 . 1 1 119 119 THR CA C 119 61.395 61.395 61.736 -0.341 25324 12138 1 17 . 1 1 119 119 THR CB C 119 71.746 71.746 71.036 0.710 25324 12139 1 17 . 1 1 119 119 THR H H 119 8.685 8.685 8.724 -0.039 25324 12140 1 17 . 1 1 120 120 TYR N N 120 129.153 129.153 126.416 2.737 25324 12141 1 17 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.675 0.125 25324 12142 1 17 . 1 1 120 120 TYR C C 120 175.214 175.214 176.111 -0.897 25324 12143 1 17 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.587 0.289 25324 12144 1 17 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.645 0.857 25324 12145 1 17 . 1 1 120 120 TYR H H 120 10.107 10.107 8.865 1.242 25324 12146 1 17 . 1 1 121 121 ALA N N 121 119.947 119.947 124.484 -4.537 25324 12147 1 17 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.283 -0.279 25324 12148 1 17 . 1 1 121 121 ALA C C 121 178.456 178.456 177.907 0.549 25324 12149 1 17 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.762 0.194 25324 12150 1 17 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.946 -0.236 25324 12151 1 17 . 1 1 121 121 ALA H H 121 8.704 8.704 8.328 0.376 25324 12152 1 17 . 1 1 122 122 GLY N N 122 111.186 111.186 110.570 0.616 25324 12153 1 17 . 1 1 122 122 GLY C C 122 173.949 173.949 173.904 0.045 25324 12154 1 17 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.408 -0.406 25324 12155 1 17 . 1 1 122 122 GLY H H 122 8.792 8.792 8.677 0.115 25324 12156 1 17 . 1 1 123 123 GLU N N 123 120.099 120.099 118.974 1.125 25324 12157 1 17 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.553 0.152 25324 12158 1 17 . 1 1 123 123 GLU C C 123 175.912 175.912 175.666 0.246 25324 12159 1 17 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.859 -0.445 25324 12160 1 17 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.496 0.288 25324 12161 1 17 . 1 1 123 123 GLU H H 123 8.072 8.072 7.761 0.311 25324 12162 1 17 . 1 1 124 124 GLY N N 124 105.303 105.303 109.176 -3.873 25324 12163 1 17 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.948 -0.146 25324 12164 1 17 . 1 1 124 124 GLY H H 124 7.939 7.939 8.505 -0.566 25324 12165 1 17 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.968 -0.033 25324 12166 1 17 . 1 1 125 125 PRO C C 125 177.788 177.788 176.513 1.275 25324 12167 1 17 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.882 0.249 25324 12168 1 17 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.591 -0.732 25324 12169 1 17 . 1 1 126 126 ILE N N 126 117.387 117.387 116.983 0.404 25324 12170 1 17 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.946 -0.047 25324 12171 1 17 . 1 1 126 126 ILE C C 126 175.625 175.625 175.530 0.095 25324 12172 1 17 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.066 0.387 25324 12173 1 17 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.429 1.119 25324 12174 1 17 . 1 1 126 126 ILE H H 126 9.599 9.599 8.953 0.646 25324 12175 1 17 . 1 1 127 127 GLY N N 127 106.753 106.753 107.635 -0.882 25324 12176 1 17 . 1 1 127 127 GLY C C 127 173.627 173.627 172.719 0.908 25324 12177 1 17 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.822 1.461 25324 12178 1 17 . 1 1 127 127 GLY H H 127 8.840 8.840 8.427 0.413 25324 12179 1 17 . 1 1 128 128 PHE N N 128 124.826 124.826 126.779 -1.953 25324 12180 1 17 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.252 -0.308 25324 12181 1 17 . 1 1 128 128 PHE C C 128 173.087 173.087 173.182 -0.095 25324 12182 1 17 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.741 0.268 25324 12183 1 17 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.623 -0.463 25324 12184 1 17 . 1 1 128 128 PHE H H 128 8.924 8.924 9.182 -0.259 25324 12185 1 17 . 1 1 129 129 LYS N N 129 131.518 131.518 126.193 5.325 25324 12186 1 17 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.820 0.063 25324 12187 1 17 . 1 1 129 129 LYS C C 129 173.863 173.863 173.604 0.259 25324 12188 1 17 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.212 1.523 25324 12189 1 17 . 1 1 129 129 LYS CB C 129 34.721 34.721 36.190 -1.468 25324 12190 1 17 . 1 1 129 129 LYS H H 129 8.201 8.201 8.245 -0.044 25324 12191 1 17 . 1 1 130 130 GLY N N 130 114.030 114.030 111.578 2.452 25324 12192 1 17 . 1 1 130 130 GLY C C 130 171.951 171.951 172.291 -0.340 25324 12193 1 17 . 1 1 130 130 GLY CA C 130 43.787 43.787 44.139 -0.352 25324 12194 1 17 . 1 1 130 130 GLY H H 130 9.325 9.325 8.836 0.489 25324 12195 1 17 . 1 1 131 131 THR N N 131 120.583 120.583 119.049 1.534 25324 12196 1 17 . 1 1 131 131 THR HA H 131 4.939 4.939 4.771 0.168 25324 12197 1 17 . 1 1 131 131 THR C C 131 173.118 173.118 173.424 -0.306 25324 12198 1 17 . 1 1 131 131 THR CA C 131 61.266 61.266 61.704 -0.438 25324 12199 1 17 . 1 1 131 131 THR CB C 131 70.392 70.392 71.896 -1.504 25324 12200 1 17 . 1 1 131 131 THR H H 131 8.916 8.916 8.090 0.826 25324 12201 1 17 . 1 1 132 132 LEU N N 132 130.774 130.774 129.992 0.782 25324 12202 1 17 . 1 1 132 132 LEU HA H 132 3.500 3.500 4.270 -0.770 25324 12203 1 17 . 1 1 132 132 LEU C C 132 176.574 176.574 175.913 0.661 25324 12204 1 17 . 1 1 132 132 LEU CA C 132 56.187 56.187 54.648 1.539 25324 12205 1 17 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.978 -0.531 25324 12206 1 17 . 1 1 132 132 LEU H H 132 8.527 8.527 8.882 -0.355 25324 12207 1 18 . 1 1 3 3 LEU N N 3 123.202 123.202 122.965 0.237 25324 12208 1 18 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.106 0.051 25324 12209 1 18 . 1 1 3 3 LEU C C 3 175.786 175.786 175.360 0.426 25324 12210 1 18 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.265 0.019 25324 12211 1 18 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.131 0.199 25324 12212 1 18 . 1 1 3 3 LEU H H 3 8.711 8.711 8.555 0.156 25324 12213 1 18 . 1 1 4 4 TYR N N 4 120.906 120.906 125.792 -4.886 25324 12214 1 18 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.100 -0.076 25324 12215 1 18 . 1 1 4 4 TYR C C 4 175.953 175.953 175.020 0.933 25324 12216 1 18 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.780 -0.403 25324 12217 1 18 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.768 -1.113 25324 12218 1 18 . 1 1 4 4 TYR H H 4 9.142 9.142 9.489 -0.347 25324 12219 1 18 . 1 1 5 5 ASN N N 5 120.496 120.496 120.099 0.397 25324 12220 1 18 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.978 0.138 25324 12221 1 18 . 1 1 5 5 ASN C C 5 174.953 174.953 173.849 1.104 25324 12222 1 18 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.638 0.309 25324 12223 1 18 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.265 -1.374 25324 12224 1 18 . 1 1 5 5 ASN H H 5 8.787 8.787 9.035 -0.248 25324 12225 1 18 . 1 1 6 6 VAL N N 6 127.428 127.428 122.774 4.654 25324 12226 1 18 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.073 0.289 25324 12227 1 18 . 1 1 6 6 VAL C C 6 174.955 174.955 174.765 0.190 25324 12228 1 18 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.257 0.176 25324 12229 1 18 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.367 -0.036 25324 12230 1 18 . 1 1 6 6 VAL H H 6 8.806 8.806 8.536 0.270 25324 12231 1 18 . 1 1 7 7 GLU N N 7 124.355 124.355 127.535 -3.180 25324 12232 1 18 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.999 -0.017 25324 12233 1 18 . 1 1 7 7 GLU C C 7 174.551 174.551 174.787 -0.236 25324 12234 1 18 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.911 -1.122 25324 12235 1 18 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.409 1.158 25324 12236 1 18 . 1 1 7 7 GLU H H 7 8.800 8.800 8.917 -0.117 25324 12237 1 18 . 1 1 8 8 ASN N N 8 116.231 116.231 120.917 -4.686 25324 12238 1 18 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.931 0.110 25324 12239 1 18 . 1 1 8 8 ASN C C 8 172.709 172.709 173.475 -0.766 25324 12240 1 18 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.425 -0.808 25324 12241 1 18 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.831 1.754 25324 12242 1 18 . 1 1 8 8 ASN H H 8 9.320 9.320 9.344 -0.024 25324 12243 1 18 . 1 1 9 9 GLN N N 9 120.762 120.762 121.433 -0.671 25324 12244 1 18 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.268 -0.094 25324 12245 1 18 . 1 1 9 9 GLN C C 9 173.454 173.454 173.567 -0.113 25324 12246 1 18 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.078 -0.118 25324 12247 1 18 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.327 -0.636 25324 12248 1 18 . 1 1 9 9 GLN H H 9 6.887 6.887 8.541 -1.654 25324 12249 1 18 . 1 1 10 10 TRP N N 10 127.775 127.775 123.521 4.254 25324 12250 1 18 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.038 -0.050 25324 12251 1 18 . 1 1 10 10 TRP C C 10 175.281 175.281 175.708 -0.427 25324 12252 1 18 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.573 -0.280 25324 12253 1 18 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.453 -1.711 25324 12254 1 18 . 1 1 10 10 TRP H H 10 8.518 8.518 7.725 0.793 25324 12255 1 18 . 1 1 11 11 GLY N N 11 107.838 107.838 109.102 -1.264 25324 12256 1 18 . 1 1 11 11 GLY C C 11 174.733 174.733 173.979 0.754 25324 12257 1 18 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.646 0.190 25324 12258 1 18 . 1 1 11 11 GLY H H 11 8.461 8.461 8.776 -0.315 25324 12259 1 18 . 1 1 12 12 GLY N N 12 109.696 109.696 106.682 3.014 25324 12260 1 18 . 1 1 12 12 GLY C C 12 174.133 174.133 174.545 -0.412 25324 12261 1 18 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.275 -0.486 25324 12262 1 18 . 1 1 12 12 GLY H H 12 8.138 8.138 7.438 0.700 25324 12263 1 18 . 1 1 13 13 SER N N 13 111.308 111.308 115.515 -4.207 25324 12264 1 18 . 1 1 13 13 SER HA H 13 4.092 4.092 4.445 -0.353 25324 12265 1 18 . 1 1 13 13 SER C C 13 175.622 175.622 175.840 -0.218 25324 12266 1 18 . 1 1 13 13 SER CA C 13 60.494 60.494 60.294 0.200 25324 12267 1 18 . 1 1 13 13 SER CB C 13 63.028 63.028 63.191 -0.164 25324 12268 1 18 . 1 1 13 13 SER H H 13 8.215 8.215 8.655 -0.440 25324 12269 1 18 . 1 1 14 14 SER N N 14 115.290 115.290 116.366 -1.076 25324 12270 1 18 . 1 1 14 14 SER HA H 14 4.566 4.566 4.285 0.281 25324 12271 1 18 . 1 1 14 14 SER C C 14 173.532 173.532 174.186 -0.654 25324 12272 1 18 . 1 1 14 14 SER CA C 14 57.317 57.317 59.708 -2.391 25324 12273 1 18 . 1 1 14 14 SER CB C 14 63.230 63.230 63.367 -0.137 25324 12274 1 18 . 1 1 14 14 SER H H 14 8.213 8.213 8.019 0.194 25324 12275 1 18 . 1 1 15 15 ALA N N 15 126.470 126.470 124.490 1.980 25324 12276 1 18 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.408 -0.005 25324 12277 1 18 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.334 1.130 25324 12278 1 18 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.326 -0.097 25324 12279 1 18 . 1 1 15 15 ALA H H 15 7.308 7.308 7.330 -0.022 25324 12280 1 18 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.290 0.119 25324 12281 1 18 . 1 1 16 16 PRO C C 16 175.627 175.627 175.530 0.097 25324 12282 1 18 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.225 0.167 25324 12283 1 18 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.648 -0.511 25324 12284 1 18 . 1 1 17 17 TRP N N 17 120.228 120.228 119.482 0.746 25324 12285 1 18 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.639 -0.321 25324 12286 1 18 . 1 1 17 17 TRP C C 17 175.951 175.951 176.310 -0.359 25324 12287 1 18 . 1 1 17 17 TRP CA C 17 56.915 56.915 57.064 -0.149 25324 12288 1 18 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.517 -1.108 25324 12289 1 18 . 1 1 17 17 TRP H H 17 8.380 8.380 8.178 0.202 25324 12290 1 18 . 1 1 18 18 ASN N N 18 120.663 120.663 121.570 -0.907 25324 12291 1 18 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.181 -0.095 25324 12292 1 18 . 1 1 18 18 ASN C C 18 174.793 174.793 174.323 0.470 25324 12293 1 18 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.361 -0.759 25324 12294 1 18 . 1 1 18 18 ASN CB C 18 42.648 42.648 42.431 0.217 25324 12295 1 18 . 1 1 18 18 ASN H H 18 9.094 9.094 8.840 0.254 25324 12296 1 18 . 1 1 19 19 GLU N N 19 122.202 122.202 121.874 0.328 25324 12297 1 18 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.435 -0.296 25324 12298 1 18 . 1 1 19 19 GLU C C 19 176.869 176.869 176.641 0.228 25324 12299 1 18 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.107 1.493 25324 12300 1 18 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.483 -0.101 25324 12301 1 18 . 1 1 19 19 GLU H H 19 9.013 9.013 8.819 0.194 25324 12302 1 18 . 1 1 20 20 GLY N N 20 112.893 112.893 110.694 2.199 25324 12303 1 18 . 1 1 20 20 GLY C C 20 174.878 174.878 173.652 1.226 25324 12304 1 18 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.147 0.848 25324 12305 1 18 . 1 1 20 20 GLY H H 20 8.926 8.926 8.991 -0.065 25324 12306 1 18 . 1 1 21 21 GLY N N 21 110.354 110.354 108.188 2.166 25324 12307 1 18 . 1 1 21 21 GLY C C 21 171.623 171.623 171.891 -0.268 25324 12308 1 18 . 1 1 21 21 GLY CA C 21 44.398 44.398 44.901 -0.503 25324 12309 1 18 . 1 1 21 21 GLY H H 21 8.258 8.258 8.055 0.203 25324 12310 1 18 . 1 1 22 22 GLN N N 22 117.541 117.541 118.736 -1.195 25324 12311 1 18 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.570 1.107 25324 12312 1 18 . 1 1 22 22 GLN C C 22 175.957 175.957 174.213 1.744 25324 12313 1 18 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.722 0.222 25324 12314 1 18 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.317 -1.232 25324 12315 1 18 . 1 1 22 22 GLN H H 22 8.564 8.564 8.307 0.257 25324 12316 1 18 . 1 1 23 23 TRP N N 23 127.208 127.208 120.629 6.579 25324 12317 1 18 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.108 0.091 25324 12318 1 18 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.653 -0.122 25324 12319 1 18 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.934 -1.251 25324 12320 1 18 . 1 1 23 23 TRP H H 23 9.347 9.347 8.913 0.434 25324 12321 1 18 . 1 1 24 24 GLU N N 24 123.504 123.504 121.055 2.449 25324 12322 1 18 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.455 0.053 25324 12323 1 18 . 1 1 24 24 GLU C C 24 174.222 174.222 175.393 -1.171 25324 12324 1 18 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.156 0.435 25324 12325 1 18 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.592 -1.976 25324 12326 1 18 . 1 1 24 24 GLU H H 24 9.296 9.296 8.593 0.703 25324 12327 1 18 . 1 1 25 25 ILE N N 25 123.447 123.447 126.629 -3.182 25324 12328 1 18 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.695 -0.259 25324 12329 1 18 . 1 1 25 25 ILE C C 25 175.790 175.790 174.457 1.333 25324 12330 1 18 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.966 -0.339 25324 12331 1 18 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.410 0.541 25324 12332 1 18 . 1 1 25 25 ILE H H 25 8.635 8.635 8.279 0.356 25324 12333 1 18 . 1 1 26 26 GLY N N 26 111.544 111.544 113.056 -1.512 25324 12334 1 18 . 1 1 26 26 GLY C C 26 172.122 172.122 174.367 -2.245 25324 12335 1 18 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.201 -0.123 25324 12336 1 18 . 1 1 26 26 GLY H H 26 3.381 3.381 6.379 -2.998 25324 12337 1 18 . 1 1 27 27 SER N N 27 112.279 112.279 119.225 -6.946 25324 12338 1 18 . 1 1 27 27 SER HA H 27 4.876 4.876 4.385 0.491 25324 12339 1 18 . 1 1 27 27 SER C C 27 174.113 174.113 175.524 -1.411 25324 12340 1 18 . 1 1 27 27 SER CA C 27 56.954 56.954 61.531 -4.577 25324 12341 1 18 . 1 1 27 27 SER CB C 27 64.554 64.554 63.958 0.596 25324 12342 1 18 . 1 1 27 27 SER H H 27 8.212 8.212 9.035 -0.823 25324 12343 1 18 . 1 1 28 28 ARG N N 28 120.872 120.872 122.131 -1.259 25324 12344 1 18 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.323 0.440 25324 12345 1 18 . 1 1 28 28 ARG C C 28 176.119 176.119 176.300 -0.181 25324 12346 1 18 . 1 1 28 28 ARG CA C 28 55.117 55.117 56.723 -1.606 25324 12347 1 18 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.939 0.890 25324 12348 1 18 . 1 1 28 28 ARG H H 28 7.849 7.849 8.714 -0.865 25324 12349 1 18 . 1 1 29 29 SER N N 29 118.985 118.985 117.636 1.349 25324 12350 1 18 . 1 1 29 29 SER HA H 29 4.192 4.192 4.580 -0.388 25324 12351 1 18 . 1 1 29 29 SER C C 29 174.622 174.622 174.667 -0.045 25324 12352 1 18 . 1 1 29 29 SER CA C 29 60.072 60.072 59.555 0.517 25324 12353 1 18 . 1 1 29 29 SER CB C 29 62.876 62.876 63.474 -0.598 25324 12354 1 18 . 1 1 29 29 SER H H 29 8.892 8.892 8.608 0.284 25324 12355 1 18 . 1 1 30 30 ASP N N 30 117.632 117.632 119.446 -1.814 25324 12356 1 18 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.673 -0.055 25324 12357 1 18 . 1 1 30 30 ASP C C 30 175.101 175.101 175.839 -0.738 25324 12358 1 18 . 1 1 30 30 ASP CA C 30 53.052 53.052 54.728 -1.676 25324 12359 1 18 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.337 -0.814 25324 12360 1 18 . 1 1 30 30 ASP H H 30 8.441 8.441 8.232 0.209 25324 12361 1 18 . 1 1 31 31 GLN N N 31 118.273 118.273 118.906 -0.633 25324 12362 1 18 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.399 0.086 25324 12363 1 18 . 1 1 31 31 GLN C C 31 173.453 173.453 174.114 -0.661 25324 12364 1 18 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.249 -0.381 25324 12365 1 18 . 1 1 31 31 GLN CB C 31 33.249 33.249 29.923 3.326 25324 12366 1 18 . 1 1 31 31 GLN H H 31 7.029 7.029 7.632 -0.603 25324 12367 1 18 . 1 1 32 32 ASN N N 32 120.865 120.865 122.960 -2.095 25324 12368 1 18 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.927 0.193 25324 12369 1 18 . 1 1 32 32 ASN C C 32 175.198 175.198 174.621 0.577 25324 12370 1 18 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.265 -0.396 25324 12371 1 18 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.648 -1.018 25324 12372 1 18 . 1 1 32 32 ASN H H 32 8.713 8.713 8.633 0.080 25324 12373 1 18 . 1 1 33 33 VAL N N 33 122.111 122.111 120.257 1.854 25324 12374 1 18 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.222 -0.517 25324 12375 1 18 . 1 1 33 33 VAL C C 33 174.950 174.950 176.263 -1.313 25324 12376 1 18 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.968 0.880 25324 12377 1 18 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.542 -0.193 25324 12378 1 18 . 1 1 33 33 VAL H H 33 8.542 8.542 8.760 -0.218 25324 12379 1 18 . 1 1 34 34 VAL N N 34 113.282 113.282 122.354 -9.072 25324 12380 1 18 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.397 0.248 25324 12381 1 18 . 1 1 34 34 VAL C C 34 175.574 175.574 174.859 0.715 25324 12382 1 18 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.770 -1.796 25324 12383 1 18 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.001 0.028 25324 12384 1 18 . 1 1 34 34 VAL H H 34 8.744 8.744 8.986 -0.242 25324 12385 1 18 . 1 1 35 35 ALA N N 35 122.102 122.102 120.883 1.219 25324 12386 1 18 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.042 -0.239 25324 12387 1 18 . 1 1 35 35 ALA C C 35 175.947 175.947 175.051 0.896 25324 12388 1 18 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.694 2.556 25324 12389 1 18 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.207 -0.579 25324 12390 1 18 . 1 1 35 35 ALA H H 35 7.677 7.677 7.793 -0.116 25324 12391 1 18 . 1 1 36 36 ILE N N 36 118.005 118.005 122.037 -4.032 25324 12392 1 18 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.257 -0.229 25324 12393 1 18 . 1 1 36 36 ILE C C 36 173.116 173.116 173.723 -0.607 25324 12394 1 18 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.166 1.016 25324 12395 1 18 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.293 1.192 25324 12396 1 18 . 1 1 36 36 ILE H H 36 8.126 8.126 8.815 -0.689 25324 12397 1 18 . 1 1 37 37 ASN N N 37 125.632 125.632 126.629 -0.997 25324 12398 1 18 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.689 -0.008 25324 12399 1 18 . 1 1 37 37 ASN C C 37 174.854 174.854 173.369 1.485 25324 12400 1 18 . 1 1 37 37 ASN CA C 37 52.530 52.530 51.938 0.592 25324 12401 1 18 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.359 -2.506 25324 12402 1 18 . 1 1 37 37 ASN H H 37 8.577 8.577 8.977 -0.400 25324 12403 1 18 . 1 1 38 38 VAL N N 38 114.223 114.223 119.591 -5.368 25324 12404 1 18 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.896 0.307 25324 12405 1 18 . 1 1 38 38 VAL C C 38 174.854 174.854 173.117 1.737 25324 12406 1 18 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.925 -1.945 25324 12407 1 18 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.253 0.791 25324 12408 1 18 . 1 1 38 38 VAL H H 38 8.874 8.874 8.756 0.118 25324 12409 1 18 . 1 1 39 39 GLU N N 39 118.277 118.277 121.848 -3.571 25324 12410 1 18 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.248 -0.166 25324 12411 1 18 . 1 1 39 39 GLU C C 39 174.548 174.548 174.986 -0.438 25324 12412 1 18 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.172 0.821 25324 12413 1 18 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.335 -0.757 25324 12414 1 18 . 1 1 39 39 GLU H H 39 8.761 8.761 8.993 -0.232 25324 12415 1 18 . 1 1 40 40 SER N N 40 114.960 114.960 119.394 -4.434 25324 12416 1 18 . 1 1 40 40 SER HA H 40 5.265 5.265 4.757 0.508 25324 12417 1 18 . 1 1 40 40 SER C C 40 175.783 175.783 175.595 0.188 25324 12418 1 18 . 1 1 40 40 SER CA C 40 55.880 55.880 58.343 -2.463 25324 12419 1 18 . 1 1 40 40 SER CB C 40 65.911 65.911 63.807 2.104 25324 12420 1 18 . 1 1 40 40 SER H H 40 8.500 8.500 8.358 0.142 25324 12421 1 18 . 1 1 41 41 GLY N N 41 117.567 117.567 113.239 4.328 25324 12422 1 18 . 1 1 41 41 GLY C C 41 174.119 174.119 174.428 -0.309 25324 12423 1 18 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.193 -0.505 25324 12424 1 18 . 1 1 41 41 GLY H H 41 9.533 9.533 8.419 1.114 25324 12425 1 18 . 1 1 42 42 ASP N N 42 122.141 122.141 121.118 1.023 25324 12426 1 18 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.969 -0.169 25324 12427 1 18 . 1 1 42 42 ASP C C 42 176.121 176.121 175.059 1.062 25324 12428 1 18 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.493 -1.347 25324 12429 1 18 . 1 1 42 42 ASP CB C 42 39.354 39.354 41.428 -2.074 25324 12430 1 18 . 1 1 42 42 ASP H H 42 8.644 8.644 7.649 0.995 25324 12431 1 18 . 1 1 43 43 ASP N N 43 116.025 116.025 121.534 -5.509 25324 12432 1 18 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.303 -0.074 25324 12433 1 18 . 1 1 43 43 ASP C C 43 176.018 176.018 176.385 -0.367 25324 12434 1 18 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.315 -0.066 25324 12435 1 18 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.797 -1.238 25324 12436 1 18 . 1 1 43 43 ASP H H 43 9.111 9.111 8.751 0.360 25324 12437 1 18 . 1 1 44 44 GLY N N 44 104.263 104.263 103.794 0.469 25324 12438 1 18 . 1 1 44 44 GLY C C 44 173.922 173.922 174.389 -0.467 25324 12439 1 18 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.191 0.110 25324 12440 1 18 . 1 1 44 44 GLY H H 44 9.063 9.063 8.434 0.629 25324 12441 1 18 . 1 1 45 45 GLN N N 45 121.691 121.691 121.553 0.138 25324 12442 1 18 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.214 -0.128 25324 12443 1 18 . 1 1 45 45 GLN C C 45 176.284 176.284 175.447 0.837 25324 12444 1 18 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.739 0.379 25324 12445 1 18 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.844 -2.170 25324 12446 1 18 . 1 1 45 45 GLN H H 45 7.356 7.356 8.388 -1.032 25324 12447 1 18 . 1 1 46 46 THR N N 46 111.843 111.843 107.690 4.153 25324 12448 1 18 . 1 1 46 46 THR HA H 46 5.355 5.355 5.458 -0.103 25324 12449 1 18 . 1 1 46 46 THR C C 46 174.451 174.451 173.331 1.120 25324 12450 1 18 . 1 1 46 46 THR CA C 46 59.644 59.644 59.331 0.313 25324 12451 1 18 . 1 1 46 46 THR CB C 46 72.714 72.714 71.976 0.738 25324 12452 1 18 . 1 1 46 46 THR H H 46 10.123 10.123 7.388 2.735 25324 12453 1 18 . 1 1 47 47 LEU N N 47 119.302 119.302 123.126 -3.824 25324 12454 1 18 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.816 -0.009 25324 12455 1 18 . 1 1 47 47 LEU C C 47 175.487 175.487 174.928 0.559 25324 12456 1 18 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.854 -0.784 25324 12457 1 18 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.820 3.183 25324 12458 1 18 . 1 1 47 47 LEU H H 47 8.364 8.364 8.955 -0.591 25324 12459 1 18 . 1 1 48 48 ASN N N 48 116.844 116.844 120.498 -3.654 25324 12460 1 18 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.055 -0.326 25324 12461 1 18 . 1 1 48 48 ASN C C 48 174.460 174.460 174.778 -0.318 25324 12462 1 18 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.810 0.929 25324 12463 1 18 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.857 0.556 25324 12464 1 18 . 1 1 48 48 ASN H H 48 8.748 8.748 8.871 -0.123 25324 12465 1 18 . 1 1 49 49 GLY N N 49 109.417 109.417 109.643 -0.226 25324 12466 1 18 . 1 1 49 49 GLY C C 49 172.126 172.126 172.166 -0.040 25324 12467 1 18 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.243 0.248 25324 12468 1 18 . 1 1 49 49 GLY H H 49 8.744 8.744 8.836 -0.092 25324 12469 1 18 . 1 1 50 50 THR N N 50 119.162 119.162 117.308 1.854 25324 12470 1 18 . 1 1 50 50 THR HA H 50 5.556 5.556 5.463 0.093 25324 12471 1 18 . 1 1 50 50 THR C C 50 171.790 171.790 172.766 -0.976 25324 12472 1 18 . 1 1 50 50 THR CA C 50 59.371 59.371 62.129 -2.757 25324 12473 1 18 . 1 1 50 50 THR CB C 50 72.799 72.799 71.952 0.847 25324 12474 1 18 . 1 1 50 50 THR H H 50 8.799 8.799 8.868 -0.069 25324 12475 1 18 . 1 1 51 51 MET N N 51 115.232 115.232 126.604 -11.372 25324 12476 1 18 . 1 1 51 51 MET HA H 51 4.886 4.886 5.095 -0.209 25324 12477 1 18 . 1 1 51 51 MET C C 51 172.708 172.708 173.585 -0.877 25324 12478 1 18 . 1 1 51 51 MET CA C 51 54.722 54.722 53.663 1.059 25324 12479 1 18 . 1 1 51 51 MET CB C 51 34.557 34.557 37.394 -2.837 25324 12480 1 18 . 1 1 51 51 MET H H 51 9.062 9.062 9.467 -0.405 25324 12481 1 18 . 1 1 52 52 THR N N 52 113.697 113.697 122.453 -8.756 25324 12482 1 18 . 1 1 52 52 THR HA H 52 4.682 4.682 4.765 -0.083 25324 12483 1 18 . 1 1 52 52 THR C C 52 173.952 173.952 173.411 0.541 25324 12484 1 18 . 1 1 52 52 THR CA C 52 61.395 61.395 61.163 0.232 25324 12485 1 18 . 1 1 52 52 THR CB C 52 71.734 71.734 71.250 0.484 25324 12486 1 18 . 1 1 52 52 THR H H 52 8.685 8.685 8.854 -0.169 25324 12487 1 18 . 1 1 53 53 TYR N N 53 129.086 129.086 125.308 3.778 25324 12488 1 18 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.783 0.017 25324 12489 1 18 . 1 1 53 53 TYR C C 53 175.214 175.214 176.433 -1.219 25324 12490 1 18 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.214 0.667 25324 12491 1 18 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.746 0.766 25324 12492 1 18 . 1 1 53 53 TYR H H 53 10.112 10.112 8.980 1.132 25324 12493 1 18 . 1 1 54 54 ALA N N 54 119.947 119.947 123.883 -3.936 25324 12494 1 18 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.253 -0.251 25324 12495 1 18 . 1 1 54 54 ALA C C 54 178.285 178.285 177.807 0.478 25324 12496 1 18 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.268 0.703 25324 12497 1 18 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.961 0.756 25324 12498 1 18 . 1 1 54 54 ALA H H 54 8.704 8.704 8.624 0.080 25324 12499 1 18 . 1 1 55 55 GLY N N 55 110.940 110.940 112.195 -1.255 25324 12500 1 18 . 1 1 55 55 GLY C C 55 173.903 173.903 174.256 -0.353 25324 12501 1 18 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.195 -0.179 25324 12502 1 18 . 1 1 55 55 GLY H H 55 8.745 8.745 8.532 0.213 25324 12503 1 18 . 1 1 56 56 GLU N N 56 120.073 120.073 120.009 0.064 25324 12504 1 18 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.628 0.081 25324 12505 1 18 . 1 1 56 56 GLU C C 56 175.906 175.906 175.991 -0.085 25324 12506 1 18 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.066 -0.644 25324 12507 1 18 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.275 0.549 25324 12508 1 18 . 1 1 56 56 GLU H H 56 8.039 8.039 7.805 0.234 25324 12509 1 18 . 1 1 57 57 GLY N N 57 105.298 105.298 108.864 -3.566 25324 12510 1 18 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.835 -0.033 25324 12511 1 18 . 1 1 57 57 GLY H H 57 7.937 7.937 8.459 -0.522 25324 12512 1 18 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.569 0.365 25324 12513 1 18 . 1 1 58 58 PRO C C 58 177.785 177.785 176.401 1.384 25324 12514 1 18 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.075 0.057 25324 12515 1 18 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.399 -0.559 25324 12516 1 18 . 1 1 59 59 ILE N N 59 117.386 117.386 116.516 0.870 25324 12517 1 18 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.745 0.243 25324 12518 1 18 . 1 1 59 59 ILE C C 59 175.688 175.688 175.019 0.669 25324 12519 1 18 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.037 0.506 25324 12520 1 18 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.503 0.785 25324 12521 1 18 . 1 1 59 59 ILE H H 59 9.600 9.600 8.947 0.653 25324 12522 1 18 . 1 1 60 60 GLY N N 60 107.164 107.164 107.729 -0.565 25324 12523 1 18 . 1 1 60 60 GLY C C 60 173.787 173.787 172.428 1.359 25324 12524 1 18 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.080 2.155 25324 12525 1 18 . 1 1 60 60 GLY H H 60 8.957 8.957 8.442 0.515 25324 12526 1 18 . 1 1 61 61 PHE N N 61 124.597 124.597 126.219 -1.622 25324 12527 1 18 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.190 0.033 25324 12528 1 18 . 1 1 61 61 PHE C C 61 173.126 173.126 173.429 -0.303 25324 12529 1 18 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.542 0.319 25324 12530 1 18 . 1 1 61 61 PHE CB C 61 43.217 43.217 42.894 0.323 25324 12531 1 18 . 1 1 61 61 PHE H H 61 8.788 8.788 9.197 -0.409 25324 12532 1 18 . 1 1 62 62 ARG N N 62 129.706 129.706 128.508 1.198 25324 12533 1 18 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.296 -0.164 25324 12534 1 18 . 1 1 62 62 ARG C C 62 172.456 172.456 173.166 -0.710 25324 12535 1 18 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.737 1.217 25324 12536 1 18 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.045 -1.175 25324 12537 1 18 . 1 1 62 62 ARG H H 62 8.405 8.405 8.592 -0.187 25324 12538 1 18 . 1 1 63 63 ALA N N 63 122.744 122.744 129.415 -6.671 25324 12539 1 18 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.373 -0.028 25324 12540 1 18 . 1 1 63 63 ALA C C 63 176.120 176.120 175.488 0.632 25324 12541 1 18 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.179 -0.260 25324 12542 1 18 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.970 1.803 25324 12543 1 18 . 1 1 63 63 ALA H H 63 8.628 8.628 8.848 -0.220 25324 12544 1 18 . 1 1 64 64 THR N N 64 116.855 116.855 118.993 -2.138 25324 12545 1 18 . 1 1 64 64 THR HA H 64 4.848 4.848 5.022 -0.174 25324 12546 1 18 . 1 1 64 64 THR C C 64 172.957 172.957 173.907 -0.950 25324 12547 1 18 . 1 1 64 64 THR CA C 64 61.211 61.211 61.418 -0.207 25324 12548 1 18 . 1 1 64 64 THR CB C 64 71.064 71.064 71.119 -0.055 25324 12549 1 18 . 1 1 64 64 THR H H 64 8.315 8.315 8.671 -0.356 25324 12550 1 18 . 1 1 65 65 LEU N N 65 129.360 129.360 128.238 1.122 25324 12551 1 18 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.924 -0.562 25324 12552 1 18 . 1 1 65 65 LEU C C 65 176.459 176.459 176.005 0.454 25324 12553 1 18 . 1 1 65 65 LEU CA C 65 55.687 55.687 55.140 0.547 25324 12554 1 18 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.548 0.163 25324 12555 1 18 . 1 1 65 65 LEU H H 65 8.877 8.877 8.894 -0.017 25324 12556 1 18 . 1 1 66 66 LEU N N 66 128.683 128.683 126.456 2.227 25324 12557 1 18 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.177 0.199 25324 12558 1 18 . 1 1 66 66 LEU C C 66 177.621 177.621 177.809 -0.188 25324 12559 1 18 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.108 -1.408 25324 12560 1 18 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.147 0.155 25324 12561 1 18 . 1 1 66 66 LEU H H 66 9.320 9.320 8.938 0.382 25324 12562 1 18 . 1 1 67 67 GLY N N 67 105.361 105.361 104.019 1.342 25324 12563 1 18 . 1 1 67 67 GLY C C 67 173.618 173.618 173.999 -0.381 25324 12564 1 18 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.892 -1.525 25324 12565 1 18 . 1 1 67 67 GLY H H 67 6.639 6.639 8.173 -1.534 25324 12566 1 18 . 1 1 68 68 ASN N N 68 121.848 121.848 118.494 3.354 25324 12567 1 18 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.792 -0.461 25324 12568 1 18 . 1 1 68 68 ASN C C 68 174.316 174.316 175.307 -0.991 25324 12569 1 18 . 1 1 68 68 ASN CA C 68 54.552 54.552 51.091 3.461 25324 12570 1 18 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.980 -1.815 25324 12571 1 18 . 1 1 68 68 ASN H H 68 9.236 9.236 8.160 1.076 25324 12572 1 18 . 1 1 69 69 ASN N N 69 109.509 109.509 114.143 -4.634 25324 12573 1 18 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.144 -0.064 25324 12574 1 18 . 1 1 69 69 ASN C C 69 171.456 171.456 173.698 -2.242 25324 12575 1 18 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.978 0.771 25324 12576 1 18 . 1 1 69 69 ASN CB C 69 37.306 37.306 37.343 -0.037 25324 12577 1 18 . 1 1 69 69 ASN H H 69 8.651 8.651 8.717 -0.066 25324 12578 1 18 . 1 1 70 70 SER N N 70 113.479 113.479 114.670 -1.191 25324 12579 1 18 . 1 1 70 70 SER HA H 70 5.437 5.437 5.138 0.299 25324 12580 1 18 . 1 1 70 70 SER C C 70 173.750 173.750 173.225 0.525 25324 12581 1 18 . 1 1 70 70 SER CA C 70 57.139 57.139 58.565 -1.426 25324 12582 1 18 . 1 1 70 70 SER CB C 70 63.818 63.818 64.897 -1.079 25324 12583 1 18 . 1 1 70 70 SER H H 70 7.693 7.693 7.310 0.383 25324 12584 1 18 . 1 1 71 71 TYR N N 71 123.132 123.132 123.119 0.013 25324 12585 1 18 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.206 -0.063 25324 12586 1 18 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.517 0.131 25324 12587 1 18 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.001 0.444 25324 12588 1 18 . 1 1 71 71 TYR H H 71 9.326 9.326 9.606 -0.280 25324 12589 1 18 . 1 1 72 72 GLU N N 72 122.396 122.396 123.449 -1.053 25324 12590 1 18 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.764 0.042 25324 12591 1 18 . 1 1 72 72 GLU C C 72 175.698 175.698 175.234 0.464 25324 12592 1 18 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.640 -0.473 25324 12593 1 18 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.381 -1.197 25324 12594 1 18 . 1 1 72 72 GLU H H 72 8.624 8.624 9.043 -0.419 25324 12595 1 18 . 1 1 73 73 VAL N N 73 128.513 128.513 127.760 0.753 25324 12596 1 18 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.689 -0.490 25324 12597 1 18 . 1 1 73 73 VAL C C 73 175.369 175.369 174.975 0.394 25324 12598 1 18 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.267 1.213 25324 12599 1 18 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.988 0.345 25324 12600 1 18 . 1 1 73 73 VAL H H 73 8.564 8.564 9.137 -0.573 25324 12601 1 18 . 1 1 74 74 GLU N N 74 124.842 124.842 125.964 -1.122 25324 12602 1 18 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.024 0.063 25324 12603 1 18 . 1 1 74 74 GLU C C 74 174.415 174.415 175.094 -0.679 25324 12604 1 18 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.871 -0.534 25324 12605 1 18 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.412 1.745 25324 12606 1 18 . 1 1 74 74 GLU H H 74 9.011 9.011 9.017 -0.006 25324 12607 1 18 . 1 1 75 75 ASN N N 75 116.136 116.136 121.257 -5.121 25324 12608 1 18 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.680 0.459 25324 12609 1 18 . 1 1 75 75 ASN C C 75 172.703 172.703 173.709 -1.006 25324 12610 1 18 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.819 0.006 25324 12611 1 18 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.217 3.679 25324 12612 1 18 . 1 1 75 75 ASN H H 75 9.424 9.424 9.192 0.232 25324 12613 1 18 . 1 1 76 76 GLN N N 76 120.762 120.762 123.777 -3.015 25324 12614 1 18 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.251 -0.211 25324 12615 1 18 . 1 1 76 76 GLN C C 76 173.113 173.113 174.006 -0.893 25324 12616 1 18 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.027 0.196 25324 12617 1 18 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.532 -0.183 25324 12618 1 18 . 1 1 76 76 GLN H H 76 7.106 7.106 8.578 -1.472 25324 12619 1 18 . 1 1 77 77 TRP N N 77 125.598 125.598 124.599 0.999 25324 12620 1 18 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.054 0.098 25324 12621 1 18 . 1 1 77 77 TRP C C 77 175.502 175.502 175.821 -0.319 25324 12622 1 18 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.655 -0.891 25324 12623 1 18 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.901 -0.902 25324 12624 1 18 . 1 1 77 77 TRP H H 77 8.181 8.181 7.992 0.189 25324 12625 1 18 . 1 1 78 78 GLY N N 78 107.901 107.901 108.098 -0.197 25324 12626 1 18 . 1 1 78 78 GLY C C 78 174.611 174.611 174.087 0.524 25324 12627 1 18 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.157 -0.255 25324 12628 1 18 . 1 1 78 78 GLY H H 78 8.778 8.778 8.887 -0.109 25324 12629 1 18 . 1 1 79 79 GLY N N 79 109.844 109.844 107.326 2.518 25324 12630 1 18 . 1 1 79 79 GLY C C 79 173.782 173.782 172.275 1.507 25324 12631 1 18 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.248 -0.455 25324 12632 1 18 . 1 1 79 79 GLY H H 79 8.198 8.198 7.862 0.336 25324 12633 1 18 . 1 1 80 80 ASP N N 80 115.837 115.837 118.586 -2.749 25324 12634 1 18 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.461 -0.220 25324 12635 1 18 . 1 1 80 80 ASP C C 80 177.285 177.285 176.863 0.422 25324 12636 1 18 . 1 1 80 80 ASP CA C 80 56.183 56.183 54.039 2.144 25324 12637 1 18 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.416 -0.893 25324 12638 1 18 . 1 1 80 80 ASP H H 80 8.132 8.132 8.217 -0.085 25324 12639 1 18 . 1 1 81 81 SER N N 81 112.690 112.690 116.926 -4.236 25324 12640 1 18 . 1 1 81 81 SER HA H 81 4.513 4.513 3.949 0.564 25324 12641 1 18 . 1 1 81 81 SER C C 81 173.684 173.684 173.997 -0.313 25324 12642 1 18 . 1 1 81 81 SER CA C 81 57.232 57.232 59.907 -2.675 25324 12643 1 18 . 1 1 81 81 SER CB C 81 63.170 63.170 62.799 0.371 25324 12644 1 18 . 1 1 81 81 SER H H 81 8.179 8.179 8.549 -0.370 25324 12645 1 18 . 1 1 82 82 ALA N N 82 126.310 126.310 124.417 1.893 25324 12646 1 18 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.023 0.380 25324 12647 1 18 . 1 1 82 82 ALA CA C 82 50.466 50.466 52.264 -1.798 25324 12648 1 18 . 1 1 82 82 ALA CB C 82 18.198 18.198 17.923 0.275 25324 12649 1 18 . 1 1 82 82 ALA H H 82 7.274 7.274 7.848 -0.574 25324 12650 1 18 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.394 -0.021 25324 12651 1 18 . 1 1 83 83 PRO C C 83 175.378 175.378 175.593 -0.215 25324 12652 1 18 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.579 -0.252 25324 12653 1 18 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.223 -0.059 25324 12654 1 18 . 1 1 84 84 TRP N N 84 120.106 120.106 120.116 -0.010 25324 12655 1 18 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.505 -0.234 25324 12656 1 18 . 1 1 84 84 TRP C C 84 176.358 176.358 175.721 0.637 25324 12657 1 18 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.448 0.498 25324 12658 1 18 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.711 -0.995 25324 12659 1 18 . 1 1 84 84 TRP H H 84 8.329 8.329 8.055 0.274 25324 12660 1 18 . 1 1 85 85 HIS N N 85 118.543 118.543 121.165 -2.622 25324 12661 1 18 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.923 -0.005 25324 12662 1 18 . 1 1 85 85 HIS C C 85 174.950 174.950 175.124 -0.174 25324 12663 1 18 . 1 1 85 85 HIS CA C 85 53.469 53.469 55.105 -1.637 25324 12664 1 18 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.322 -0.649 25324 12665 1 18 . 1 1 85 85 HIS H H 85 9.204 9.204 8.730 0.474 25324 12666 1 18 . 1 1 86 86 SER N N 86 117.803 117.803 118.566 -0.763 25324 12667 1 18 . 1 1 86 86 SER HA H 86 4.412 4.412 4.286 0.126 25324 12668 1 18 . 1 1 86 86 SER C C 86 175.691 175.691 174.584 1.107 25324 12669 1 18 . 1 1 86 86 SER CA C 86 60.257 60.257 58.898 1.359 25324 12670 1 18 . 1 1 86 86 SER CB C 86 63.015 63.015 63.198 -0.183 25324 12671 1 18 . 1 1 86 86 SER H H 86 9.168 9.168 8.819 0.349 25324 12672 1 18 . 1 1 87 87 GLY N N 87 115.773 115.773 112.639 3.134 25324 12673 1 18 . 1 1 87 87 GLY C C 87 174.288 174.288 174.123 0.165 25324 12674 1 18 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.792 -0.091 25324 12675 1 18 . 1 1 87 87 GLY H H 87 9.284 9.284 8.803 0.481 25324 12676 1 18 . 1 1 88 88 GLY N N 88 109.162 109.162 109.228 -0.066 25324 12677 1 18 . 1 1 88 88 GLY C C 88 171.120 171.120 172.058 -0.938 25324 12678 1 18 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.386 -0.792 25324 12679 1 18 . 1 1 88 88 GLY H H 88 8.054 8.054 8.041 0.013 25324 12680 1 18 . 1 1 89 89 ASN N N 89 117.048 117.048 119.852 -2.804 25324 12681 1 18 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.600 0.438 25324 12682 1 18 . 1 1 89 89 ASN C C 89 175.287 175.287 174.764 0.523 25324 12683 1 18 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.330 -0.465 25324 12684 1 18 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.102 -0.498 25324 12685 1 18 . 1 1 89 89 ASN H H 89 8.516 8.516 8.670 -0.154 25324 12686 1 18 . 1 1 90 90 TRP N N 90 125.844 125.844 126.170 -0.326 25324 12687 1 18 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.113 0.140 25324 12688 1 18 . 1 1 90 90 TRP C C 90 175.278 175.278 175.278 0.000 25324 12689 1 18 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.340 -0.072 25324 12690 1 18 . 1 1 90 90 TRP CB C 90 31.958 31.958 31.819 0.139 25324 12691 1 18 . 1 1 90 90 TRP H H 90 9.282 9.282 9.341 -0.059 25324 12692 1 18 . 1 1 91 91 ILE N N 91 123.134 123.134 121.041 2.093 25324 12693 1 18 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.711 0.735 25324 12694 1 18 . 1 1 91 91 ILE C C 91 175.489 175.489 175.270 0.219 25324 12695 1 18 . 1 1 91 91 ILE CA C 91 60.826 60.826 61.121 -0.295 25324 12696 1 18 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.963 0.713 25324 12697 1 18 . 1 1 91 91 ILE H H 91 9.318 9.318 8.740 0.578 25324 12698 1 18 . 1 1 92 92 LEU N N 92 123.452 123.452 129.686 -6.234 25324 12699 1 18 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.822 0.120 25324 12700 1 18 . 1 1 92 92 LEU C C 92 173.620 173.620 174.524 -0.904 25324 12701 1 18 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.763 -1.507 25324 12702 1 18 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.340 1.168 25324 12703 1 18 . 1 1 92 92 LEU H H 92 8.463 8.463 9.181 -0.718 25324 12704 1 18 . 1 1 93 93 GLY N N 93 103.987 103.987 107.476 -3.489 25324 12705 1 18 . 1 1 93 93 GLY C C 93 172.284 172.284 173.795 -1.511 25324 12706 1 18 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.556 -2.057 25324 12707 1 18 . 1 1 93 93 GLY H H 93 2.937 2.937 6.948 -4.011 25324 12708 1 18 . 1 1 94 94 SER N N 94 110.274 110.274 116.964 -6.690 25324 12709 1 18 . 1 1 94 94 SER HA H 94 4.711 4.711 4.917 -0.206 25324 12710 1 18 . 1 1 94 94 SER C C 94 174.784 174.784 174.934 -0.150 25324 12711 1 18 . 1 1 94 94 SER CA C 94 56.555 56.555 58.234 -1.679 25324 12712 1 18 . 1 1 94 94 SER CB C 94 65.051 65.051 65.334 -0.283 25324 12713 1 18 . 1 1 94 94 SER H H 94 7.919 7.919 9.472 -1.553 25324 12714 1 18 . 1 1 95 95 ARG N N 95 123.020 123.020 122.238 0.782 25324 12715 1 18 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.504 0.168 25324 12716 1 18 . 1 1 95 95 ARG C C 95 176.120 176.120 177.478 -1.358 25324 12717 1 18 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.189 0.185 25324 12718 1 18 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.556 0.292 25324 12719 1 18 . 1 1 95 95 ARG H H 95 9.148 9.148 7.802 1.346 25324 12720 1 18 . 1 1 96 96 GLU N N 96 120.357 120.357 123.797 -3.440 25324 12721 1 18 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.045 0.237 25324 12722 1 18 . 1 1 96 96 GLU C C 96 176.278 176.278 176.362 -0.084 25324 12723 1 18 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.742 -2.212 25324 12724 1 18 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.377 0.776 25324 12725 1 18 . 1 1 96 96 GLU H H 96 8.610 8.610 9.035 -0.425 25324 12726 1 18 . 1 1 97 97 ASN N N 97 117.678 117.678 115.252 2.426 25324 12727 1 18 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.773 -0.161 25324 12728 1 18 . 1 1 97 97 ASN C C 97 173.949 173.949 173.843 0.106 25324 12729 1 18 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.027 0.988 25324 12730 1 18 . 1 1 97 97 ASN CB C 97 38.166 38.166 37.925 0.241 25324 12731 1 18 . 1 1 97 97 ASN H H 97 8.533 8.533 8.310 0.223 25324 12732 1 18 . 1 1 98 98 GLN N N 98 118.592 118.592 119.457 -0.865 25324 12733 1 18 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.529 -0.169 25324 12734 1 18 . 1 1 98 98 GLN C C 98 173.116 173.116 173.698 -0.582 25324 12735 1 18 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.711 -0.083 25324 12736 1 18 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.532 -0.663 25324 12737 1 18 . 1 1 98 98 GLN H H 98 7.663 7.663 7.490 0.173 25324 12738 1 18 . 1 1 99 99 ASN N N 99 122.855 122.855 121.695 1.160 25324 12739 1 18 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.063 0.072 25324 12740 1 18 . 1 1 99 99 ASN C C 99 175.287 175.287 175.136 0.151 25324 12741 1 18 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.284 0.706 25324 12742 1 18 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.597 -0.106 25324 12743 1 18 . 1 1 99 99 ASN H H 99 8.759 8.759 8.685 0.074 25324 12744 1 18 . 1 1 100 100 VAL N N 100 121.385 121.385 119.796 1.589 25324 12745 1 18 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.632 0.116 25324 12746 1 18 . 1 1 100 100 VAL C C 100 174.956 174.956 176.550 -1.594 25324 12747 1 18 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.780 0.063 25324 12748 1 18 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.340 1.103 25324 12749 1 18 . 1 1 100 100 VAL H H 100 8.717 8.717 8.097 0.620 25324 12750 1 18 . 1 1 101 101 VAL N N 101 112.736 112.736 121.432 -8.696 25324 12751 1 18 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.481 0.164 25324 12752 1 18 . 1 1 101 101 VAL C C 101 175.577 175.577 174.908 0.669 25324 12753 1 18 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.623 -1.660 25324 12754 1 18 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.649 -0.608 25324 12755 1 18 . 1 1 101 101 VAL H H 101 8.802 8.802 8.491 0.311 25324 12756 1 18 . 1 1 102 102 ALA N N 102 122.104 122.104 122.738 -0.634 25324 12757 1 18 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.146 -0.339 25324 12758 1 18 . 1 1 102 102 ALA C C 102 176.046 176.046 175.081 0.965 25324 12759 1 18 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.400 2.854 25324 12760 1 18 . 1 1 102 102 ALA CB C 102 21.625 21.625 21.913 -0.288 25324 12761 1 18 . 1 1 102 102 ALA H H 102 7.677 7.677 7.883 -0.206 25324 12762 1 18 . 1 1 103 103 ILE N N 103 118.218 118.218 123.471 -5.253 25324 12763 1 18 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.450 -0.423 25324 12764 1 18 . 1 1 103 103 ILE C C 103 173.118 173.118 173.979 -0.861 25324 12765 1 18 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.496 1.731 25324 12766 1 18 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.182 1.289 25324 12767 1 18 . 1 1 103 103 ILE H H 103 8.102 8.102 8.625 -0.523 25324 12768 1 18 . 1 1 104 104 ASN N N 104 125.938 125.938 126.580 -0.642 25324 12769 1 18 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.121 0.565 25324 12770 1 18 . 1 1 104 104 ASN C C 104 174.870 174.870 173.743 1.127 25324 12771 1 18 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.538 0.015 25324 12772 1 18 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.262 -1.410 25324 12773 1 18 . 1 1 104 104 ASN H H 104 8.668 8.668 8.856 -0.188 25324 12774 1 18 . 1 1 105 105 VAL N N 105 114.631 114.631 118.422 -3.791 25324 12775 1 18 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.083 0.122 25324 12776 1 18 . 1 1 105 105 VAL C C 105 174.788 174.788 173.335 1.453 25324 12777 1 18 . 1 1 105 105 VAL CA C 105 57.979 57.979 59.753 -1.774 25324 12778 1 18 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.753 0.287 25324 12779 1 18 . 1 1 105 105 VAL H H 105 8.933 8.933 8.748 0.185 25324 12780 1 18 . 1 1 106 106 GLU N N 106 118.347 118.347 124.670 -6.323 25324 12781 1 18 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.180 -0.100 25324 12782 1 18 . 1 1 106 106 GLU C C 106 174.777 174.777 174.464 0.313 25324 12783 1 18 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.082 -0.115 25324 12784 1 18 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.376 -0.733 25324 12785 1 18 . 1 1 106 106 GLU H H 106 8.814 8.814 8.924 -0.110 25324 12786 1 18 . 1 1 107 107 SER N N 107 115.335 115.335 118.815 -3.480 25324 12787 1 18 . 1 1 107 107 SER HA H 107 5.266 5.266 4.978 0.288 25324 12788 1 18 . 1 1 107 107 SER C C 107 175.787 175.787 174.297 1.490 25324 12789 1 18 . 1 1 107 107 SER CA C 107 55.888 55.888 56.976 -1.088 25324 12790 1 18 . 1 1 107 107 SER CB C 107 65.921 65.921 65.067 0.854 25324 12791 1 18 . 1 1 107 107 SER H H 107 8.576 8.576 8.445 0.131 25324 12792 1 18 . 1 1 108 108 GLY N N 108 117.567 117.567 110.900 6.667 25324 12793 1 18 . 1 1 108 108 GLY C C 108 173.959 173.959 175.282 -1.323 25324 12794 1 18 . 1 1 108 108 GLY CA C 108 44.677 44.677 44.984 -0.308 25324 12795 1 18 . 1 1 108 108 GLY H H 108 9.532 9.532 8.588 0.944 25324 12796 1 18 . 1 1 109 109 ASP N N 109 122.108 122.108 123.425 -1.317 25324 12797 1 18 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.875 -0.074 25324 12798 1 18 . 1 1 109 109 ASP C C 109 176.203 176.203 175.335 0.868 25324 12799 1 18 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.956 -0.822 25324 12800 1 18 . 1 1 109 109 ASP CB C 109 39.342 39.342 39.587 -0.245 25324 12801 1 18 . 1 1 109 109 ASP H H 109 8.605 8.605 7.691 0.914 25324 12802 1 18 . 1 1 110 110 ASP N N 110 116.197 116.197 119.485 -3.288 25324 12803 1 18 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.303 -0.081 25324 12804 1 18 . 1 1 110 110 ASP C C 110 175.951 175.951 176.228 -0.277 25324 12805 1 18 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.084 0.114 25324 12806 1 18 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.494 -1.864 25324 12807 1 18 . 1 1 110 110 ASP H H 110 9.087 9.087 8.129 0.958 25324 12808 1 18 . 1 1 111 111 GLY N N 111 103.841 103.841 103.786 0.055 25324 12809 1 18 . 1 1 111 111 GLY C C 111 173.924 173.924 175.339 -1.415 25324 12810 1 18 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.661 -0.498 25324 12811 1 18 . 1 1 111 111 GLY H H 111 8.930 8.930 7.847 1.083 25324 12812 1 18 . 1 1 112 112 GLN N N 112 121.626 121.626 118.873 2.753 25324 12813 1 18 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.103 -0.033 25324 12814 1 18 . 1 1 112 112 GLN C C 112 176.431 176.431 175.600 0.831 25324 12815 1 18 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.426 -0.153 25324 12816 1 18 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.591 -1.898 25324 12817 1 18 . 1 1 112 112 GLN H H 112 7.351 7.351 8.032 -0.681 25324 12818 1 18 . 1 1 113 113 THR N N 113 112.322 112.322 110.172 2.150 25324 12819 1 18 . 1 1 113 113 THR HA H 113 5.331 5.331 5.208 0.123 25324 12820 1 18 . 1 1 113 113 THR C C 113 174.452 174.452 173.645 0.807 25324 12821 1 18 . 1 1 113 113 THR CA C 113 59.739 59.739 60.223 -0.484 25324 12822 1 18 . 1 1 113 113 THR CB C 113 71.773 71.773 70.033 1.740 25324 12823 1 18 . 1 1 113 113 THR H H 113 10.053 10.053 7.569 2.484 25324 12824 1 18 . 1 1 114 114 LEU N N 114 122.083 122.083 128.532 -6.449 25324 12825 1 18 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.577 0.004 25324 12826 1 18 . 1 1 114 114 LEU C C 114 175.113 175.113 175.637 -0.524 25324 12827 1 18 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.431 -1.526 25324 12828 1 18 . 1 1 114 114 LEU CB C 114 47.033 47.033 42.723 4.310 25324 12829 1 18 . 1 1 114 114 LEU H H 114 8.978 8.978 9.048 -0.070 25324 12830 1 18 . 1 1 115 115 ASN N N 115 118.846 118.846 121.659 -2.813 25324 12831 1 18 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.553 0.217 25324 12832 1 18 . 1 1 115 115 ASN C C 115 174.788 174.788 174.931 -0.143 25324 12833 1 18 . 1 1 115 115 ASN CA C 115 52.342 52.342 52.385 -0.043 25324 12834 1 18 . 1 1 115 115 ASN CB C 115 43.414 43.414 41.635 1.779 25324 12835 1 18 . 1 1 115 115 ASN H H 115 8.837 8.837 8.068 0.769 25324 12836 1 18 . 1 1 116 116 GLY N N 116 109.661 109.661 110.959 -1.298 25324 12837 1 18 . 1 1 116 116 GLY C C 116 172.452 172.452 172.423 0.029 25324 12838 1 18 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.451 0.020 25324 12839 1 18 . 1 1 116 116 GLY H H 116 8.625 8.625 8.983 -0.358 25324 12840 1 18 . 1 1 117 117 THR N N 117 120.009 120.009 113.360 6.649 25324 12841 1 18 . 1 1 117 117 THR HA H 117 5.556 5.556 5.419 0.137 25324 12842 1 18 . 1 1 117 117 THR C C 117 171.619 171.619 173.168 -1.549 25324 12843 1 18 . 1 1 117 117 THR CA C 117 59.373 59.373 60.603 -1.230 25324 12844 1 18 . 1 1 117 117 THR CB C 117 72.777 72.777 72.755 0.022 25324 12845 1 18 . 1 1 117 117 THR H H 117 8.911 8.911 9.009 -0.098 25324 12846 1 18 . 1 1 118 118 MET N N 118 115.550 115.550 117.634 -2.084 25324 12847 1 18 . 1 1 118 118 MET HA H 118 4.889 4.889 5.502 -0.613 25324 12848 1 18 . 1 1 118 118 MET C C 118 172.707 172.707 174.135 -1.428 25324 12849 1 18 . 1 1 118 118 MET CA C 118 54.714 54.714 54.892 -0.178 25324 12850 1 18 . 1 1 118 118 MET CB C 118 33.663 33.663 37.507 -3.844 25324 12851 1 18 . 1 1 118 118 MET H H 118 9.159 9.159 9.351 -0.192 25324 12852 1 18 . 1 1 119 119 THR N N 119 113.716 113.716 115.982 -2.266 25324 12853 1 18 . 1 1 119 119 THR HA H 119 4.682 4.682 5.274 -0.592 25324 12854 1 18 . 1 1 119 119 THR C C 119 173.952 173.952 173.858 0.094 25324 12855 1 18 . 1 1 119 119 THR CA C 119 61.395 61.395 61.491 -0.096 25324 12856 1 18 . 1 1 119 119 THR CB C 119 71.746 71.746 72.365 -0.619 25324 12857 1 18 . 1 1 119 119 THR H H 119 8.685 8.685 8.653 0.032 25324 12858 1 18 . 1 1 120 120 TYR N N 120 129.153 129.153 124.670 4.483 25324 12859 1 18 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.645 0.155 25324 12860 1 18 . 1 1 120 120 TYR C C 120 175.214 175.214 177.529 -2.315 25324 12861 1 18 . 1 1 120 120 TYR CA C 120 58.877 58.877 59.152 -0.275 25324 12862 1 18 . 1 1 120 120 TYR CB C 120 40.502 40.502 39.420 1.082 25324 12863 1 18 . 1 1 120 120 TYR H H 120 10.107 10.107 8.234 1.873 25324 12864 1 18 . 1 1 121 121 ALA N N 121 119.947 119.947 123.050 -3.103 25324 12865 1 18 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.109 -0.105 25324 12866 1 18 . 1 1 121 121 ALA C C 121 178.456 178.456 176.970 1.486 25324 12867 1 18 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.324 -0.368 25324 12868 1 18 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.926 -0.216 25324 12869 1 18 . 1 1 121 121 ALA H H 121 8.704 8.704 8.553 0.151 25324 12870 1 18 . 1 1 122 122 GLY N N 122 111.186 111.186 102.677 8.509 25324 12871 1 18 . 1 1 122 122 GLY C C 122 173.949 173.949 172.894 1.055 25324 12872 1 18 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.032 -0.030 25324 12873 1 18 . 1 1 122 122 GLY H H 122 8.792 8.792 8.521 0.271 25324 12874 1 18 . 1 1 123 123 GLU N N 123 120.099 120.099 118.643 1.456 25324 12875 1 18 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.416 0.289 25324 12876 1 18 . 1 1 123 123 GLU C C 123 175.912 175.912 175.378 0.534 25324 12877 1 18 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.976 -0.562 25324 12878 1 18 . 1 1 123 123 GLU CB C 123 32.784 32.784 31.433 1.351 25324 12879 1 18 . 1 1 123 123 GLU H H 123 8.072 8.072 7.619 0.453 25324 12880 1 18 . 1 1 124 124 GLY N N 124 105.303 105.303 108.647 -3.344 25324 12881 1 18 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.639 -0.837 25324 12882 1 18 . 1 1 124 124 GLY H H 124 7.939 7.939 8.636 -0.697 25324 12883 1 18 . 1 1 125 125 PRO HA H 125 4.935 4.935 5.025 -0.090 25324 12884 1 18 . 1 1 125 125 PRO C C 125 177.788 177.788 176.236 1.552 25324 12885 1 18 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.490 0.641 25324 12886 1 18 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.168 0.692 25324 12887 1 18 . 1 1 126 126 ILE N N 126 117.387 117.387 120.059 -2.672 25324 12888 1 18 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.704 0.195 25324 12889 1 18 . 1 1 126 126 ILE C C 126 175.625 175.625 174.765 0.860 25324 12890 1 18 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.127 0.326 25324 12891 1 18 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.578 0.970 25324 12892 1 18 . 1 1 126 126 ILE H H 126 9.599 9.599 8.742 0.857 25324 12893 1 18 . 1 1 127 127 GLY N N 127 106.753 106.753 107.988 -1.235 25324 12894 1 18 . 1 1 127 127 GLY C C 127 173.627 173.627 172.707 0.920 25324 12895 1 18 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.686 1.597 25324 12896 1 18 . 1 1 127 127 GLY H H 127 8.840 8.840 8.539 0.301 25324 12897 1 18 . 1 1 128 128 PHE N N 128 124.826 124.826 126.304 -1.478 25324 12898 1 18 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.420 -0.476 25324 12899 1 18 . 1 1 128 128 PHE C C 128 173.087 173.087 173.531 -0.444 25324 12900 1 18 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.599 0.410 25324 12901 1 18 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.289 -0.130 25324 12902 1 18 . 1 1 128 128 PHE H H 128 8.924 8.924 9.174 -0.250 25324 12903 1 18 . 1 1 129 129 LYS N N 129 131.518 131.518 128.611 2.907 25324 12904 1 18 . 1 1 129 129 LYS HA H 129 4.883 4.883 5.120 -0.237 25324 12905 1 18 . 1 1 129 129 LYS C C 129 173.863 173.863 174.170 -0.307 25324 12906 1 18 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.357 1.378 25324 12907 1 18 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.559 -0.837 25324 12908 1 18 . 1 1 129 129 LYS H H 129 8.201 8.201 8.468 -0.267 25324 12909 1 18 . 1 1 130 130 GLY N N 130 114.030 114.030 112.559 1.471 25324 12910 1 18 . 1 1 130 130 GLY C C 130 171.951 171.951 172.373 -0.422 25324 12911 1 18 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.425 0.362 25324 12912 1 18 . 1 1 130 130 GLY H H 130 9.325 9.325 8.608 0.717 25324 12913 1 18 . 1 1 131 131 THR N N 131 120.583 120.583 116.259 4.324 25324 12914 1 18 . 1 1 131 131 THR HA H 131 4.939 4.939 5.481 -0.542 25324 12915 1 18 . 1 1 131 131 THR C C 131 173.118 173.118 172.579 0.539 25324 12916 1 18 . 1 1 131 131 THR CA C 131 61.266 61.266 60.480 0.786 25324 12917 1 18 . 1 1 131 131 THR CB C 131 70.392 70.392 72.157 -1.765 25324 12918 1 18 . 1 1 131 131 THR H H 131 8.916 8.916 8.645 0.271 25324 12919 1 18 . 1 1 132 132 LEU N N 132 130.774 130.774 129.350 1.424 25324 12920 1 18 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.689 -0.189 25324 12921 1 18 . 1 1 132 132 LEU C C 132 176.574 176.574 175.996 0.578 25324 12922 1 18 . 1 1 132 132 LEU CA C 132 56.187 56.187 53.721 2.466 25324 12923 1 18 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.995 -0.548 25324 12924 1 18 . 1 1 132 132 LEU H H 132 8.527 8.527 8.628 -0.101 25324 12925 1 19 . 1 1 3 3 LEU N N 3 123.202 123.202 123.852 -0.650 25324 12926 1 19 . 1 1 3 3 LEU HA H 3 5.157 5.157 5.199 -0.042 25324 12927 1 19 . 1 1 3 3 LEU C C 3 175.786 175.786 175.379 0.407 25324 12928 1 19 . 1 1 3 3 LEU CA C 3 54.284 54.284 53.919 0.366 25324 12929 1 19 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.780 -0.450 25324 12930 1 19 . 1 1 3 3 LEU H H 3 8.711 8.711 8.364 0.347 25324 12931 1 19 . 1 1 4 4 TYR N N 4 120.906 120.906 124.431 -3.525 25324 12932 1 19 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.048 -0.024 25324 12933 1 19 . 1 1 4 4 TYR C C 4 175.953 175.953 174.769 1.184 25324 12934 1 19 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.702 -0.325 25324 12935 1 19 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.373 -0.718 25324 12936 1 19 . 1 1 4 4 TYR H H 4 9.142 9.142 9.510 -0.368 25324 12937 1 19 . 1 1 5 5 ASN N N 5 120.496 120.496 119.949 0.547 25324 12938 1 19 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.995 0.121 25324 12939 1 19 . 1 1 5 5 ASN C C 5 174.953 174.953 173.598 1.355 25324 12940 1 19 . 1 1 5 5 ASN CA C 5 52.947 52.947 52.697 0.250 25324 12941 1 19 . 1 1 5 5 ASN CB C 5 38.891 38.891 41.087 -2.196 25324 12942 1 19 . 1 1 5 5 ASN H H 5 8.787 8.787 9.175 -0.388 25324 12943 1 19 . 1 1 6 6 VAL N N 6 127.428 127.428 124.303 3.125 25324 12944 1 19 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.248 0.114 25324 12945 1 19 . 1 1 6 6 VAL C C 6 174.955 174.955 174.432 0.523 25324 12946 1 19 . 1 1 6 6 VAL CA C 6 61.433 61.433 60.529 0.904 25324 12947 1 19 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.467 -0.136 25324 12948 1 19 . 1 1 6 6 VAL H H 6 8.806 8.806 8.960 -0.154 25324 12949 1 19 . 1 1 7 7 GLU N N 7 124.355 124.355 126.259 -1.904 25324 12950 1 19 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.990 -0.008 25324 12951 1 19 . 1 1 7 7 GLU C C 7 174.551 174.551 174.692 -0.141 25324 12952 1 19 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.663 -0.874 25324 12953 1 19 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.539 1.028 25324 12954 1 19 . 1 1 7 7 GLU H H 7 8.800 8.800 8.815 -0.015 25324 12955 1 19 . 1 1 8 8 ASN N N 8 116.231 116.231 120.458 -4.227 25324 12956 1 19 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.817 0.224 25324 12957 1 19 . 1 1 8 8 ASN C C 8 172.709 172.709 173.241 -0.532 25324 12958 1 19 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.312 -0.695 25324 12959 1 19 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.054 2.531 25324 12960 1 19 . 1 1 8 8 ASN H H 8 9.320 9.320 9.122 0.198 25324 12961 1 19 . 1 1 9 9 GLN N N 9 120.762 120.762 122.675 -1.913 25324 12962 1 19 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.229 -0.055 25324 12963 1 19 . 1 1 9 9 GLN C C 9 173.454 173.454 173.635 -0.181 25324 12964 1 19 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.080 -0.120 25324 12965 1 19 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.691 -1.000 25324 12966 1 19 . 1 1 9 9 GLN H H 9 6.887 6.887 8.569 -1.682 25324 12967 1 19 . 1 1 10 10 TRP N N 10 127.775 127.775 124.794 2.981 25324 12968 1 19 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.093 -0.105 25324 12969 1 19 . 1 1 10 10 TRP C C 10 175.281 175.281 175.571 -0.290 25324 12970 1 19 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.428 -0.135 25324 12971 1 19 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.271 -1.529 25324 12972 1 19 . 1 1 10 10 TRP H H 10 8.518 8.518 8.082 0.436 25324 12973 1 19 . 1 1 11 11 GLY N N 11 107.838 107.838 109.938 -2.100 25324 12974 1 19 . 1 1 11 11 GLY C C 11 174.733 174.733 174.474 0.259 25324 12975 1 19 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.546 0.290 25324 12976 1 19 . 1 1 11 11 GLY H H 11 8.461 8.461 8.719 -0.258 25324 12977 1 19 . 1 1 12 12 GLY N N 12 109.696 109.696 107.886 1.810 25324 12978 1 19 . 1 1 12 12 GLY C C 12 174.133 174.133 174.587 -0.454 25324 12979 1 19 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.324 -0.535 25324 12980 1 19 . 1 1 12 12 GLY H H 12 8.138 8.138 7.475 0.663 25324 12981 1 19 . 1 1 13 13 SER N N 13 111.308 111.308 115.299 -3.991 25324 12982 1 19 . 1 1 13 13 SER HA H 13 4.092 4.092 4.008 0.084 25324 12983 1 19 . 1 1 13 13 SER C C 13 175.622 175.622 175.245 0.377 25324 12984 1 19 . 1 1 13 13 SER CA C 13 60.494 60.494 60.577 -0.083 25324 12985 1 19 . 1 1 13 13 SER CB C 13 63.028 63.028 63.247 -0.219 25324 12986 1 19 . 1 1 13 13 SER H H 13 8.215 8.215 8.644 -0.429 25324 12987 1 19 . 1 1 14 14 SER N N 14 115.290 115.290 115.473 -0.183 25324 12988 1 19 . 1 1 14 14 SER HA H 14 4.566 4.566 4.328 0.238 25324 12989 1 19 . 1 1 14 14 SER C C 14 173.532 173.532 174.413 -0.881 25324 12990 1 19 . 1 1 14 14 SER CA C 14 57.317 57.317 59.452 -2.135 25324 12991 1 19 . 1 1 14 14 SER CB C 14 63.230 63.230 63.487 -0.257 25324 12992 1 19 . 1 1 14 14 SER H H 14 8.213 8.213 8.023 0.190 25324 12993 1 19 . 1 1 15 15 ALA N N 15 126.470 126.470 124.990 1.480 25324 12994 1 19 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.339 0.064 25324 12995 1 19 . 1 1 15 15 ALA CA C 15 50.464 50.464 50.566 -0.102 25324 12996 1 19 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.381 -0.152 25324 12997 1 19 . 1 1 15 15 ALA H H 15 7.308 7.308 7.265 0.043 25324 12998 1 19 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.325 0.084 25324 12999 1 19 . 1 1 16 16 PRO C C 16 175.627 175.627 175.400 0.227 25324 13000 1 19 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.299 0.093 25324 13001 1 19 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.662 -0.525 25324 13002 1 19 . 1 1 17 17 TRP N N 17 120.228 120.228 120.378 -0.150 25324 13003 1 19 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.492 -0.174 25324 13004 1 19 . 1 1 17 17 TRP C C 17 175.951 175.951 176.064 -0.113 25324 13005 1 19 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.775 0.140 25324 13006 1 19 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.060 -0.651 25324 13007 1 19 . 1 1 17 17 TRP H H 17 8.380 8.380 8.241 0.139 25324 13008 1 19 . 1 1 18 18 ASN N N 18 120.663 120.663 122.255 -1.592 25324 13009 1 19 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.011 0.075 25324 13010 1 19 . 1 1 18 18 ASN C C 18 174.793 174.793 174.621 0.172 25324 13011 1 19 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.402 -0.801 25324 13012 1 19 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.055 1.593 25324 13013 1 19 . 1 1 18 18 ASN H H 18 9.094 9.094 8.720 0.374 25324 13014 1 19 . 1 1 19 19 GLU N N 19 122.202 122.202 122.952 -0.750 25324 13015 1 19 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.137 0.002 25324 13016 1 19 . 1 1 19 19 GLU C C 19 176.869 176.869 176.262 0.607 25324 13017 1 19 . 1 1 19 19 GLU CA C 19 58.600 58.600 57.228 1.372 25324 13018 1 19 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.099 0.283 25324 13019 1 19 . 1 1 19 19 GLU H H 19 9.013 9.013 8.894 0.119 25324 13020 1 19 . 1 1 20 20 GLY N N 20 112.893 112.893 112.046 0.847 25324 13021 1 19 . 1 1 20 20 GLY C C 20 174.878 174.878 173.856 1.022 25324 13022 1 19 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.807 0.188 25324 13023 1 19 . 1 1 20 20 GLY H H 20 8.926 8.926 9.034 -0.108 25324 13024 1 19 . 1 1 21 21 GLY N N 21 110.354 110.354 108.162 2.192 25324 13025 1 19 . 1 1 21 21 GLY C C 21 171.623 171.623 171.589 0.034 25324 13026 1 19 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.030 -0.632 25324 13027 1 19 . 1 1 21 21 GLY H H 21 8.258 8.258 7.658 0.600 25324 13028 1 19 . 1 1 22 22 GLN N N 22 117.541 117.541 118.346 -0.805 25324 13029 1 19 . 1 1 22 22 GLN HA H 22 5.677 5.677 5.176 0.501 25324 13030 1 19 . 1 1 22 22 GLN C C 22 175.957 175.957 174.469 1.488 25324 13031 1 19 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.717 0.227 25324 13032 1 19 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.358 -1.273 25324 13033 1 19 . 1 1 22 22 GLN H H 22 8.564 8.564 8.596 -0.032 25324 13034 1 19 . 1 1 23 23 TRP N N 23 127.208 127.208 123.136 4.072 25324 13035 1 19 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.106 0.093 25324 13036 1 19 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.462 0.069 25324 13037 1 19 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.973 -1.290 25324 13038 1 19 . 1 1 23 23 TRP H H 23 9.347 9.347 9.047 0.300 25324 13039 1 19 . 1 1 24 24 GLU N N 24 123.504 123.504 120.648 2.856 25324 13040 1 19 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.512 -0.004 25324 13041 1 19 . 1 1 24 24 GLU C C 24 174.222 174.222 175.309 -1.087 25324 13042 1 19 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.353 0.238 25324 13043 1 19 . 1 1 24 24 GLU CB C 24 30.615 30.615 33.115 -2.501 25324 13044 1 19 . 1 1 24 24 GLU H H 24 9.296 9.296 8.645 0.651 25324 13045 1 19 . 1 1 25 25 ILE N N 25 123.447 123.447 125.685 -2.238 25324 13046 1 19 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.549 -0.113 25324 13047 1 19 . 1 1 25 25 ILE C C 25 175.790 175.790 174.811 0.979 25324 13048 1 19 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.081 -0.454 25324 13049 1 19 . 1 1 25 25 ILE CB C 25 40.952 40.952 41.063 -0.111 25324 13050 1 19 . 1 1 25 25 ILE H H 25 8.635 8.635 8.978 -0.343 25324 13051 1 19 . 1 1 26 26 GLY N N 26 111.544 111.544 110.772 0.772 25324 13052 1 19 . 1 1 26 26 GLY C C 26 172.122 172.122 175.149 -3.027 25324 13053 1 19 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.976 -0.898 25324 13054 1 19 . 1 1 26 26 GLY H H 26 3.381 3.381 6.883 -3.502 25324 13055 1 19 . 1 1 27 27 SER N N 27 112.279 112.279 114.675 -2.396 25324 13056 1 19 . 1 1 27 27 SER HA H 27 4.876 4.876 4.290 0.586 25324 13057 1 19 . 1 1 27 27 SER C C 27 174.113 174.113 175.808 -1.695 25324 13058 1 19 . 1 1 27 27 SER CA C 27 56.954 56.954 59.074 -2.120 25324 13059 1 19 . 1 1 27 27 SER CB C 27 64.554 64.554 62.900 1.654 25324 13060 1 19 . 1 1 27 27 SER H H 27 8.212 8.212 7.992 0.220 25324 13061 1 19 . 1 1 28 28 ARG N N 28 120.872 120.872 122.647 -1.775 25324 13062 1 19 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.761 0.002 25324 13063 1 19 . 1 1 28 28 ARG C C 28 176.119 176.119 176.866 -0.747 25324 13064 1 19 . 1 1 28 28 ARG CA C 28 55.117 55.117 58.588 -3.471 25324 13065 1 19 . 1 1 28 28 ARG CB C 28 31.830 31.830 30.945 0.885 25324 13066 1 19 . 1 1 28 28 ARG H H 28 7.849 7.849 8.440 -0.591 25324 13067 1 19 . 1 1 29 29 SER N N 29 118.985 118.985 111.583 7.402 25324 13068 1 19 . 1 1 29 29 SER HA H 29 4.192 4.192 4.597 -0.405 25324 13069 1 19 . 1 1 29 29 SER C C 29 174.622 174.622 172.935 1.687 25324 13070 1 19 . 1 1 29 29 SER CA C 29 60.072 60.072 57.877 2.195 25324 13071 1 19 . 1 1 29 29 SER CB C 29 62.876 62.876 64.827 -1.951 25324 13072 1 19 . 1 1 29 29 SER H H 29 8.892 8.892 8.060 0.832 25324 13073 1 19 . 1 1 30 30 ASP N N 30 117.632 117.632 120.229 -2.597 25324 13074 1 19 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.341 0.277 25324 13075 1 19 . 1 1 30 30 ASP C C 30 175.101 175.101 174.789 0.312 25324 13076 1 19 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.686 -2.634 25324 13077 1 19 . 1 1 30 30 ASP CB C 30 40.523 40.523 39.409 1.114 25324 13078 1 19 . 1 1 30 30 ASP H H 30 8.441 8.441 8.156 0.285 25324 13079 1 19 . 1 1 31 31 GLN N N 31 118.273 118.273 120.389 -2.116 25324 13080 1 19 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.525 -0.040 25324 13081 1 19 . 1 1 31 31 GLN C C 31 173.453 173.453 173.937 -0.484 25324 13082 1 19 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.241 0.627 25324 13083 1 19 . 1 1 31 31 GLN CB C 31 33.249 33.249 33.215 0.034 25324 13084 1 19 . 1 1 31 31 GLN H H 31 7.029 7.029 8.033 -1.004 25324 13085 1 19 . 1 1 32 32 ASN N N 32 120.865 120.865 121.829 -0.964 25324 13086 1 19 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.061 0.059 25324 13087 1 19 . 1 1 32 32 ASN C C 32 175.198 175.198 175.192 0.006 25324 13088 1 19 . 1 1 32 32 ASN CA C 32 51.869 51.869 53.588 -1.719 25324 13089 1 19 . 1 1 32 32 ASN CB C 32 39.630 39.630 39.824 -0.194 25324 13090 1 19 . 1 1 32 32 ASN H H 32 8.713 8.713 8.608 0.105 25324 13091 1 19 . 1 1 33 33 VAL N N 33 122.111 122.111 122.768 -0.657 25324 13092 1 19 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.162 -0.457 25324 13093 1 19 . 1 1 33 33 VAL C C 33 174.950 174.950 176.016 -1.066 25324 13094 1 19 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.402 1.445 25324 13095 1 19 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.617 0.733 25324 13096 1 19 . 1 1 33 33 VAL H H 33 8.542 8.542 8.496 0.046 25324 13097 1 19 . 1 1 34 34 VAL N N 34 113.282 113.282 117.865 -4.583 25324 13098 1 19 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.456 0.189 25324 13099 1 19 . 1 1 34 34 VAL C C 34 175.574 175.574 174.710 0.864 25324 13100 1 19 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.640 -1.666 25324 13101 1 19 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.021 0.008 25324 13102 1 19 . 1 1 34 34 VAL H H 34 8.744 8.744 8.910 -0.166 25324 13103 1 19 . 1 1 35 35 ALA N N 35 122.102 122.102 121.514 0.588 25324 13104 1 19 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.276 -0.473 25324 13105 1 19 . 1 1 35 35 ALA C C 35 175.947 175.947 174.949 0.998 25324 13106 1 19 . 1 1 35 35 ALA CA C 35 53.250 53.250 51.094 2.156 25324 13107 1 19 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.402 -0.774 25324 13108 1 19 . 1 1 35 35 ALA H H 35 7.677 7.677 7.769 -0.092 25324 13109 1 19 . 1 1 36 36 ILE N N 36 118.005 118.005 122.445 -4.440 25324 13110 1 19 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.269 -0.241 25324 13111 1 19 . 1 1 36 36 ILE C C 36 173.116 173.116 173.837 -0.721 25324 13112 1 19 . 1 1 36 36 ILE CA C 36 62.182 62.182 60.945 1.237 25324 13113 1 19 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.007 1.478 25324 13114 1 19 . 1 1 36 36 ILE H H 36 8.126 8.126 8.955 -0.829 25324 13115 1 19 . 1 1 37 37 ASN N N 37 125.632 125.632 127.176 -1.544 25324 13116 1 19 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.553 0.128 25324 13117 1 19 . 1 1 37 37 ASN C C 37 174.854 174.854 173.733 1.121 25324 13118 1 19 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.383 0.146 25324 13119 1 19 . 1 1 37 37 ASN CB C 37 38.853 38.853 40.760 -1.907 25324 13120 1 19 . 1 1 37 37 ASN H H 37 8.577 8.577 8.973 -0.396 25324 13121 1 19 . 1 1 38 38 VAL N N 38 114.223 114.223 117.907 -3.684 25324 13122 1 19 . 1 1 38 38 VAL HA H 38 5.203 5.203 5.011 0.192 25324 13123 1 19 . 1 1 38 38 VAL C C 38 174.854 174.854 173.511 1.343 25324 13124 1 19 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.944 -1.964 25324 13125 1 19 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.318 0.726 25324 13126 1 19 . 1 1 38 38 VAL H H 38 8.874 8.874 8.767 0.107 25324 13127 1 19 . 1 1 39 39 GLU N N 39 118.277 118.277 122.642 -4.365 25324 13128 1 19 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.162 -0.080 25324 13129 1 19 . 1 1 39 39 GLU C C 39 174.548 174.548 175.439 -0.891 25324 13130 1 19 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.247 0.746 25324 13131 1 19 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.413 -0.835 25324 13132 1 19 . 1 1 39 39 GLU H H 39 8.761 8.761 9.262 -0.501 25324 13133 1 19 . 1 1 40 40 SER N N 40 114.960 114.960 119.929 -4.969 25324 13134 1 19 . 1 1 40 40 SER HA H 40 5.265 5.265 4.964 0.301 25324 13135 1 19 . 1 1 40 40 SER C C 40 175.783 175.783 175.095 0.688 25324 13136 1 19 . 1 1 40 40 SER CA C 40 55.880 55.880 57.894 -2.014 25324 13137 1 19 . 1 1 40 40 SER CB C 40 65.911 65.911 63.626 2.285 25324 13138 1 19 . 1 1 40 40 SER H H 40 8.500 8.500 8.786 -0.286 25324 13139 1 19 . 1 1 41 41 GLY N N 41 117.567 117.567 110.989 6.578 25324 13140 1 19 . 1 1 41 41 GLY C C 41 174.119 174.119 174.697 -0.578 25324 13141 1 19 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.402 -0.714 25324 13142 1 19 . 1 1 41 41 GLY H H 41 9.533 9.533 8.424 1.109 25324 13143 1 19 . 1 1 42 42 ASP N N 42 122.141 122.141 121.209 0.932 25324 13144 1 19 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.907 -0.107 25324 13145 1 19 . 1 1 42 42 ASP C C 42 176.121 176.121 176.734 -0.613 25324 13146 1 19 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.530 -1.384 25324 13147 1 19 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.190 -2.836 25324 13148 1 19 . 1 1 42 42 ASP H H 42 8.644 8.644 8.013 0.631 25324 13149 1 19 . 1 1 43 43 ASP N N 43 116.025 116.025 120.777 -4.752 25324 13150 1 19 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.524 -0.295 25324 13151 1 19 . 1 1 43 43 ASP C C 43 176.018 176.018 176.600 -0.582 25324 13152 1 19 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.595 0.654 25324 13153 1 19 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.052 -0.493 25324 13154 1 19 . 1 1 43 43 ASP H H 43 9.111 9.111 8.742 0.369 25324 13155 1 19 . 1 1 44 44 GLY N N 44 104.263 104.263 107.933 -3.670 25324 13156 1 19 . 1 1 44 44 GLY C C 44 173.922 173.922 175.146 -1.224 25324 13157 1 19 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.977 -0.676 25324 13158 1 19 . 1 1 44 44 GLY H H 44 9.063 9.063 8.291 0.772 25324 13159 1 19 . 1 1 45 45 GLN N N 45 121.691 121.691 117.492 4.199 25324 13160 1 19 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.364 -0.278 25324 13161 1 19 . 1 1 45 45 GLN C C 45 176.284 176.284 175.197 1.087 25324 13162 1 19 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.566 0.552 25324 13163 1 19 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.097 -1.423 25324 13164 1 19 . 1 1 45 45 GLN H H 45 7.356 7.356 8.737 -1.381 25324 13165 1 19 . 1 1 46 46 THR N N 46 111.843 111.843 109.160 2.683 25324 13166 1 19 . 1 1 46 46 THR HA H 46 5.355 5.355 5.671 -0.316 25324 13167 1 19 . 1 1 46 46 THR C C 46 174.451 174.451 173.393 1.058 25324 13168 1 19 . 1 1 46 46 THR CA C 46 59.644 59.644 59.802 -0.158 25324 13169 1 19 . 1 1 46 46 THR CB C 46 72.714 72.714 71.498 1.216 25324 13170 1 19 . 1 1 46 46 THR H H 46 10.123 10.123 7.586 2.537 25324 13171 1 19 . 1 1 47 47 LEU N N 47 119.302 119.302 124.316 -5.014 25324 13172 1 19 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.819 -0.012 25324 13173 1 19 . 1 1 47 47 LEU C C 47 175.487 175.487 175.064 0.423 25324 13174 1 19 . 1 1 47 47 LEU CA C 47 53.070 53.070 54.060 -0.990 25324 13175 1 19 . 1 1 47 47 LEU CB C 47 48.003 48.003 45.200 2.803 25324 13176 1 19 . 1 1 47 47 LEU H H 47 8.364 8.364 8.613 -0.249 25324 13177 1 19 . 1 1 48 48 ASN N N 48 116.844 116.844 119.990 -3.146 25324 13178 1 19 . 1 1 48 48 ASN HA H 48 5.729 5.729 6.012 -0.283 25324 13179 1 19 . 1 1 48 48 ASN C C 48 174.460 174.460 174.868 -0.408 25324 13180 1 19 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.884 0.855 25324 13181 1 19 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.740 0.673 25324 13182 1 19 . 1 1 48 48 ASN H H 48 8.748 8.748 9.075 -0.327 25324 13183 1 19 . 1 1 49 49 GLY N N 49 109.417 109.417 109.831 -0.414 25324 13184 1 19 . 1 1 49 49 GLY C C 49 172.126 172.126 172.318 -0.192 25324 13185 1 19 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.236 0.255 25324 13186 1 19 . 1 1 49 49 GLY H H 49 8.744 8.744 8.920 -0.176 25324 13187 1 19 . 1 1 50 50 THR N N 50 119.162 119.162 113.199 5.963 25324 13188 1 19 . 1 1 50 50 THR HA H 50 5.556 5.556 5.550 0.006 25324 13189 1 19 . 1 1 50 50 THR C C 50 171.790 171.790 172.619 -0.829 25324 13190 1 19 . 1 1 50 50 THR CA C 50 59.371 59.371 60.406 -1.035 25324 13191 1 19 . 1 1 50 50 THR CB C 50 72.799 72.799 72.671 0.128 25324 13192 1 19 . 1 1 50 50 THR H H 50 8.799 8.799 8.938 -0.139 25324 13193 1 19 . 1 1 51 51 MET N N 51 115.232 115.232 122.128 -6.896 25324 13194 1 19 . 1 1 51 51 MET HA H 51 4.886 4.886 5.031 -0.145 25324 13195 1 19 . 1 1 51 51 MET C C 51 172.708 172.708 173.671 -0.963 25324 13196 1 19 . 1 1 51 51 MET CA C 51 54.722 54.722 54.364 0.358 25324 13197 1 19 . 1 1 51 51 MET CB C 51 34.557 34.557 37.265 -2.708 25324 13198 1 19 . 1 1 51 51 MET H H 51 9.062 9.062 9.087 -0.025 25324 13199 1 19 . 1 1 52 52 THR N N 52 113.697 113.697 122.019 -8.322 25324 13200 1 19 . 1 1 52 52 THR HA H 52 4.682 4.682 4.756 -0.074 25324 13201 1 19 . 1 1 52 52 THR C C 52 173.952 173.952 173.447 0.505 25324 13202 1 19 . 1 1 52 52 THR CA C 52 61.395 61.395 61.414 -0.019 25324 13203 1 19 . 1 1 52 52 THR CB C 52 71.734 71.734 71.153 0.581 25324 13204 1 19 . 1 1 52 52 THR H H 52 8.685 8.685 8.754 -0.069 25324 13205 1 19 . 1 1 53 53 TYR N N 53 129.086 129.086 125.875 3.211 25324 13206 1 19 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.838 -0.038 25324 13207 1 19 . 1 1 53 53 TYR C C 53 175.214 175.214 176.507 -1.293 25324 13208 1 19 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.925 0.956 25324 13209 1 19 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.913 0.599 25324 13210 1 19 . 1 1 53 53 TYR H H 53 10.112 10.112 8.978 1.134 25324 13211 1 19 . 1 1 54 54 ALA N N 54 119.947 119.947 123.933 -3.986 25324 13212 1 19 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.262 -0.260 25324 13213 1 19 . 1 1 54 54 ALA C C 54 178.285 178.285 177.362 0.923 25324 13214 1 19 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.227 0.744 25324 13215 1 19 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.248 1.469 25324 13216 1 19 . 1 1 54 54 ALA H H 54 8.704 8.704 8.567 0.137 25324 13217 1 19 . 1 1 55 55 GLY N N 55 110.940 110.940 112.129 -1.189 25324 13218 1 19 . 1 1 55 55 GLY C C 55 173.903 173.903 174.352 -0.449 25324 13219 1 19 . 1 1 55 55 GLY CA C 55 45.016 45.016 44.952 0.064 25324 13220 1 19 . 1 1 55 55 GLY H H 55 8.745 8.745 8.159 0.586 25324 13221 1 19 . 1 1 56 56 GLU N N 56 120.073 120.073 120.678 -0.605 25324 13222 1 19 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.711 -0.002 25324 13223 1 19 . 1 1 56 56 GLU C C 56 175.906 175.906 176.407 -0.501 25324 13224 1 19 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.189 -0.766 25324 13225 1 19 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.221 0.603 25324 13226 1 19 . 1 1 56 56 GLU H H 56 8.039 8.039 7.766 0.273 25324 13227 1 19 . 1 1 57 57 GLY N N 57 105.298 105.298 109.002 -3.704 25324 13228 1 19 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.753 0.049 25324 13229 1 19 . 1 1 57 57 GLY H H 57 7.937 7.937 8.314 -0.377 25324 13230 1 19 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.706 0.228 25324 13231 1 19 . 1 1 58 58 PRO C C 58 177.785 177.785 176.461 1.324 25324 13232 1 19 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.142 -0.010 25324 13233 1 19 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.346 -0.506 25324 13234 1 19 . 1 1 59 59 ILE N N 59 117.386 117.386 117.863 -0.477 25324 13235 1 19 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.720 0.268 25324 13236 1 19 . 1 1 59 59 ILE C C 59 175.688 175.688 175.271 0.417 25324 13237 1 19 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.066 0.477 25324 13238 1 19 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.676 0.612 25324 13239 1 19 . 1 1 59 59 ILE H H 59 9.600 9.600 8.787 0.813 25324 13240 1 19 . 1 1 60 60 GLY N N 60 107.164 107.164 108.471 -1.307 25324 13241 1 19 . 1 1 60 60 GLY C C 60 173.787 173.787 172.616 1.171 25324 13242 1 19 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.411 1.824 25324 13243 1 19 . 1 1 60 60 GLY H H 60 8.957 8.957 8.600 0.357 25324 13244 1 19 . 1 1 61 61 PHE N N 61 124.597 124.597 126.882 -2.285 25324 13245 1 19 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.301 -0.078 25324 13246 1 19 . 1 1 61 61 PHE C C 61 173.126 173.126 173.532 -0.406 25324 13247 1 19 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.603 0.258 25324 13248 1 19 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.021 0.196 25324 13249 1 19 . 1 1 61 61 PHE H H 61 8.788 8.788 9.296 -0.508 25324 13250 1 19 . 1 1 62 62 ARG N N 62 129.706 129.706 128.094 1.612 25324 13251 1 19 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.478 -0.346 25324 13252 1 19 . 1 1 62 62 ARG C C 62 172.456 172.456 173.148 -0.692 25324 13253 1 19 . 1 1 62 62 ARG CA C 62 54.954 54.954 54.003 0.951 25324 13254 1 19 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.306 -1.436 25324 13255 1 19 . 1 1 62 62 ARG H H 62 8.405 8.405 8.240 0.165 25324 13256 1 19 . 1 1 63 63 ALA N N 63 122.744 122.744 129.438 -6.694 25324 13257 1 19 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.184 0.161 25324 13258 1 19 . 1 1 63 63 ALA C C 63 176.120 176.120 175.461 0.659 25324 13259 1 19 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.184 -0.265 25324 13260 1 19 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.744 2.030 25324 13261 1 19 . 1 1 63 63 ALA H H 63 8.628 8.628 8.765 -0.137 25324 13262 1 19 . 1 1 64 64 THR N N 64 116.855 116.855 119.233 -2.378 25324 13263 1 19 . 1 1 64 64 THR HA H 64 4.848 4.848 5.173 -0.325 25324 13264 1 19 . 1 1 64 64 THR C C 64 172.957 172.957 173.346 -0.389 25324 13265 1 19 . 1 1 64 64 THR CA C 64 61.211 61.211 61.237 -0.026 25324 13266 1 19 . 1 1 64 64 THR CB C 64 71.064 71.064 71.374 -0.310 25324 13267 1 19 . 1 1 64 64 THR H H 64 8.315 8.315 8.795 -0.480 25324 13268 1 19 . 1 1 65 65 LEU N N 65 129.360 129.360 129.440 -0.080 25324 13269 1 19 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.942 -0.580 25324 13270 1 19 . 1 1 65 65 LEU C C 65 176.459 176.459 175.877 0.582 25324 13271 1 19 . 1 1 65 65 LEU CA C 65 55.687 55.687 54.879 0.808 25324 13272 1 19 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.048 -0.337 25324 13273 1 19 . 1 1 65 65 LEU H H 65 8.877 8.877 8.947 -0.070 25324 13274 1 19 . 1 1 66 66 LEU N N 66 128.683 128.683 127.453 1.230 25324 13275 1 19 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.459 -0.083 25324 13276 1 19 . 1 1 66 66 LEU C C 66 177.621 177.621 176.891 0.730 25324 13277 1 19 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.139 -0.439 25324 13278 1 19 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.405 -0.103 25324 13279 1 19 . 1 1 66 66 LEU H H 66 9.320 9.320 8.876 0.444 25324 13280 1 19 . 1 1 67 67 GLY N N 67 105.361 105.361 104.936 0.425 25324 13281 1 19 . 1 1 67 67 GLY C C 67 173.618 173.618 173.275 0.343 25324 13282 1 19 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.166 -0.799 25324 13283 1 19 . 1 1 67 67 GLY H H 67 6.639 6.639 7.376 -0.737 25324 13284 1 19 . 1 1 68 68 ASN N N 68 121.848 121.848 117.601 4.247 25324 13285 1 19 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.285 0.046 25324 13286 1 19 . 1 1 68 68 ASN C C 68 174.316 174.316 175.260 -0.944 25324 13287 1 19 . 1 1 68 68 ASN CA C 68 54.552 54.552 54.009 0.543 25324 13288 1 19 . 1 1 68 68 ASN CB C 68 37.165 37.165 37.397 -0.232 25324 13289 1 19 . 1 1 68 68 ASN H H 68 9.236 9.236 8.784 0.452 25324 13290 1 19 . 1 1 69 69 ASN N N 69 109.509 109.509 108.980 0.529 25324 13291 1 19 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.235 -0.155 25324 13292 1 19 . 1 1 69 69 ASN C C 69 171.456 171.456 174.123 -2.667 25324 13293 1 19 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.734 1.016 25324 13294 1 19 . 1 1 69 69 ASN CB C 69 37.306 37.306 38.369 -1.063 25324 13295 1 19 . 1 1 69 69 ASN H H 69 8.651 8.651 8.767 -0.116 25324 13296 1 19 . 1 1 70 70 SER N N 70 113.479 113.479 115.361 -1.882 25324 13297 1 19 . 1 1 70 70 SER HA H 70 5.437 5.437 5.055 0.382 25324 13298 1 19 . 1 1 70 70 SER C C 70 173.750 173.750 173.526 0.224 25324 13299 1 19 . 1 1 70 70 SER CA C 70 57.139 57.139 58.611 -1.472 25324 13300 1 19 . 1 1 70 70 SER CB C 70 63.818 63.818 63.699 0.119 25324 13301 1 19 . 1 1 70 70 SER H H 70 7.693 7.693 7.301 0.392 25324 13302 1 19 . 1 1 71 71 TYR N N 71 123.132 123.132 125.153 -2.021 25324 13303 1 19 . 1 1 71 71 TYR HA H 71 5.143 5.143 4.982 0.161 25324 13304 1 19 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.812 -0.164 25324 13305 1 19 . 1 1 71 71 TYR CB C 71 42.445 42.445 41.343 1.102 25324 13306 1 19 . 1 1 71 71 TYR H H 71 9.326 9.326 9.562 -0.236 25324 13307 1 19 . 1 1 72 72 GLU N N 72 122.396 122.396 123.843 -1.447 25324 13308 1 19 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.761 0.045 25324 13309 1 19 . 1 1 72 72 GLU C C 72 175.698 175.698 175.114 0.584 25324 13310 1 19 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.704 -0.537 25324 13311 1 19 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.253 -1.069 25324 13312 1 19 . 1 1 72 72 GLU H H 72 8.624 8.624 9.177 -0.553 25324 13313 1 19 . 1 1 73 73 VAL N N 73 128.513 128.513 127.711 0.802 25324 13314 1 19 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.446 -0.247 25324 13315 1 19 . 1 1 73 73 VAL C C 73 175.369 175.369 174.690 0.679 25324 13316 1 19 . 1 1 73 73 VAL CA C 73 61.480 61.480 60.651 0.829 25324 13317 1 19 . 1 1 73 73 VAL CB C 73 33.333 33.333 32.867 0.466 25324 13318 1 19 . 1 1 73 73 VAL H H 73 8.564 8.564 9.137 -0.573 25324 13319 1 19 . 1 1 74 74 GLU N N 74 124.842 124.842 126.588 -1.746 25324 13320 1 19 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.053 0.034 25324 13321 1 19 . 1 1 74 74 GLU C C 74 174.415 174.415 174.958 -0.543 25324 13322 1 19 . 1 1 74 74 GLU CA C 74 54.337 54.337 55.000 -0.663 25324 13323 1 19 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.203 1.954 25324 13324 1 19 . 1 1 74 74 GLU H H 74 9.011 9.011 9.042 -0.031 25324 13325 1 19 . 1 1 75 75 ASN N N 75 116.136 116.136 122.153 -6.017 25324 13326 1 19 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.731 0.408 25324 13327 1 19 . 1 1 75 75 ASN C C 75 172.703 172.703 173.665 -0.962 25324 13328 1 19 . 1 1 75 75 ASN CA C 75 51.825 51.825 52.233 -0.408 25324 13329 1 19 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.967 2.929 25324 13330 1 19 . 1 1 75 75 ASN H H 75 9.424 9.424 9.176 0.248 25324 13331 1 19 . 1 1 76 76 GLN N N 76 120.762 120.762 121.680 -0.918 25324 13332 1 19 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.334 -0.294 25324 13333 1 19 . 1 1 76 76 GLN C C 76 173.113 173.113 174.011 -0.898 25324 13334 1 19 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.421 -0.198 25324 13335 1 19 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.596 -0.248 25324 13336 1 19 . 1 1 76 76 GLN H H 76 7.106 7.106 8.726 -1.620 25324 13337 1 19 . 1 1 77 77 TRP N N 77 125.598 125.598 125.304 0.294 25324 13338 1 19 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.080 0.072 25324 13339 1 19 . 1 1 77 77 TRP C C 77 175.502 175.502 175.380 0.122 25324 13340 1 19 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.760 -0.996 25324 13341 1 19 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.844 -0.845 25324 13342 1 19 . 1 1 77 77 TRP H H 77 8.181 8.181 8.063 0.118 25324 13343 1 19 . 1 1 78 78 GLY N N 78 107.901 107.901 108.581 -0.680 25324 13344 1 19 . 1 1 78 78 GLY C C 78 174.611 174.611 174.338 0.273 25324 13345 1 19 . 1 1 78 78 GLY CA C 78 44.902 44.902 44.924 -0.022 25324 13346 1 19 . 1 1 78 78 GLY H H 78 8.778 8.778 8.815 -0.037 25324 13347 1 19 . 1 1 79 79 GLY N N 79 109.844 109.844 107.568 2.276 25324 13348 1 19 . 1 1 79 79 GLY C C 79 173.782 173.782 173.840 -0.058 25324 13349 1 19 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.535 -0.742 25324 13350 1 19 . 1 1 79 79 GLY H H 79 8.198 8.198 7.348 0.850 25324 13351 1 19 . 1 1 80 80 ASP N N 80 115.837 115.837 119.385 -3.548 25324 13352 1 19 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.304 -0.063 25324 13353 1 19 . 1 1 80 80 ASP C C 80 177.285 177.285 176.509 0.776 25324 13354 1 19 . 1 1 80 80 ASP CA C 80 56.183 56.183 56.200 -0.017 25324 13355 1 19 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.274 -0.751 25324 13356 1 19 . 1 1 80 80 ASP H H 80 8.132 8.132 8.609 -0.477 25324 13357 1 19 . 1 1 81 81 SER N N 81 112.690 112.690 114.290 -1.600 25324 13358 1 19 . 1 1 81 81 SER HA H 81 4.513 4.513 4.351 0.162 25324 13359 1 19 . 1 1 81 81 SER C C 81 173.684 173.684 174.272 -0.588 25324 13360 1 19 . 1 1 81 81 SER CA C 81 57.232 57.232 58.189 -0.957 25324 13361 1 19 . 1 1 81 81 SER CB C 81 63.170 63.170 62.979 0.191 25324 13362 1 19 . 1 1 81 81 SER H H 81 8.179 8.179 7.903 0.276 25324 13363 1 19 . 1 1 82 82 ALA N N 82 126.310 126.310 125.980 0.330 25324 13364 1 19 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.429 -0.026 25324 13365 1 19 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.134 0.332 25324 13366 1 19 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.497 -0.299 25324 13367 1 19 . 1 1 82 82 ALA H H 82 7.274 7.274 7.254 0.020 25324 13368 1 19 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.308 0.065 25324 13369 1 19 . 1 1 83 83 PRO C C 83 175.378 175.378 175.347 0.031 25324 13370 1 19 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.236 0.091 25324 13371 1 19 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.529 -0.365 25324 13372 1 19 . 1 1 84 84 TRP N N 84 120.106 120.106 117.009 3.097 25324 13373 1 19 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.580 -0.309 25324 13374 1 19 . 1 1 84 84 TRP C C 84 176.358 176.358 176.049 0.309 25324 13375 1 19 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.786 0.160 25324 13376 1 19 . 1 1 84 84 TRP CB C 84 29.716 29.716 31.054 -1.338 25324 13377 1 19 . 1 1 84 84 TRP H H 84 8.329 8.329 8.017 0.312 25324 13378 1 19 . 1 1 85 85 HIS N N 85 118.543 118.543 120.757 -2.214 25324 13379 1 19 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.888 0.030 25324 13380 1 19 . 1 1 85 85 HIS C C 85 174.950 174.950 174.956 -0.006 25324 13381 1 19 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.992 -1.523 25324 13382 1 19 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.786 -1.113 25324 13383 1 19 . 1 1 85 85 HIS H H 85 9.204 9.204 9.071 0.133 25324 13384 1 19 . 1 1 86 86 SER N N 86 117.803 117.803 117.513 0.290 25324 13385 1 19 . 1 1 86 86 SER HA H 86 4.412 4.412 4.242 0.170 25324 13386 1 19 . 1 1 86 86 SER C C 86 175.691 175.691 174.968 0.723 25324 13387 1 19 . 1 1 86 86 SER CA C 86 60.257 60.257 58.957 1.300 25324 13388 1 19 . 1 1 86 86 SER CB C 86 63.015 63.015 63.207 -0.192 25324 13389 1 19 . 1 1 86 86 SER H H 86 9.168 9.168 8.858 0.310 25324 13390 1 19 . 1 1 87 87 GLY N N 87 115.773 115.773 110.126 5.647 25324 13391 1 19 . 1 1 87 87 GLY C C 87 174.288 174.288 173.700 0.588 25324 13392 1 19 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.255 -0.554 25324 13393 1 19 . 1 1 87 87 GLY H H 87 9.284 9.284 9.001 0.283 25324 13394 1 19 . 1 1 88 88 GLY N N 88 109.162 109.162 107.950 1.212 25324 13395 1 19 . 1 1 88 88 GLY C C 88 171.120 171.120 171.799 -0.679 25324 13396 1 19 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.952 -0.357 25324 13397 1 19 . 1 1 88 88 GLY H H 88 8.054 8.054 7.993 0.061 25324 13398 1 19 . 1 1 89 89 ASN N N 89 117.048 117.048 120.218 -3.170 25324 13399 1 19 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.848 0.190 25324 13400 1 19 . 1 1 89 89 ASN C C 89 175.287 175.287 174.777 0.510 25324 13401 1 19 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.228 -0.363 25324 13402 1 19 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.073 -0.468 25324 13403 1 19 . 1 1 89 89 ASN H H 89 8.516 8.516 8.721 -0.205 25324 13404 1 19 . 1 1 90 90 TRP N N 90 125.844 125.844 125.449 0.395 25324 13405 1 19 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.218 0.035 25324 13406 1 19 . 1 1 90 90 TRP C C 90 175.278 175.278 175.350 -0.072 25324 13407 1 19 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.305 -0.037 25324 13408 1 19 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.288 -0.330 25324 13409 1 19 . 1 1 90 90 TRP H H 90 9.282 9.282 9.398 -0.116 25324 13410 1 19 . 1 1 91 91 ILE N N 91 123.134 123.134 121.384 1.750 25324 13411 1 19 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.072 0.374 25324 13412 1 19 . 1 1 91 91 ILE C C 91 175.489 175.489 175.518 -0.029 25324 13413 1 19 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.864 -0.038 25324 13414 1 19 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.949 0.727 25324 13415 1 19 . 1 1 91 91 ILE H H 91 9.318 9.318 8.727 0.591 25324 13416 1 19 . 1 1 92 92 LEU N N 92 123.452 123.452 128.998 -5.546 25324 13417 1 19 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.673 0.269 25324 13418 1 19 . 1 1 92 92 LEU C C 92 173.620 173.620 174.342 -0.722 25324 13419 1 19 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.532 -1.276 25324 13420 1 19 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.765 1.743 25324 13421 1 19 . 1 1 92 92 LEU H H 92 8.463 8.463 8.787 -0.324 25324 13422 1 19 . 1 1 93 93 GLY N N 93 103.987 103.987 107.548 -3.561 25324 13423 1 19 . 1 1 93 93 GLY C C 93 172.284 172.284 173.834 -1.550 25324 13424 1 19 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.694 -2.194 25324 13425 1 19 . 1 1 93 93 GLY H H 93 2.937 2.937 6.963 -4.026 25324 13426 1 19 . 1 1 94 94 SER N N 94 110.274 110.274 117.305 -7.031 25324 13427 1 19 . 1 1 94 94 SER HA H 94 4.711 4.711 4.946 -0.235 25324 13428 1 19 . 1 1 94 94 SER C C 94 174.784 174.784 175.128 -0.344 25324 13429 1 19 . 1 1 94 94 SER CA C 94 56.555 56.555 58.557 -2.002 25324 13430 1 19 . 1 1 94 94 SER CB C 94 65.051 65.051 65.375 -0.324 25324 13431 1 19 . 1 1 94 94 SER H H 94 7.919 7.919 9.539 -1.620 25324 13432 1 19 . 1 1 95 95 ARG N N 95 123.020 123.020 121.743 1.277 25324 13433 1 19 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.492 0.180 25324 13434 1 19 . 1 1 95 95 ARG C C 95 176.120 176.120 177.371 -1.251 25324 13435 1 19 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.082 0.292 25324 13436 1 19 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.971 -0.123 25324 13437 1 19 . 1 1 95 95 ARG H H 95 9.148 9.148 7.732 1.416 25324 13438 1 19 . 1 1 96 96 GLU N N 96 120.357 120.357 122.567 -2.210 25324 13439 1 19 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.068 0.214 25324 13440 1 19 . 1 1 96 96 GLU C C 96 176.278 176.278 176.664 -0.386 25324 13441 1 19 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.822 -2.292 25324 13442 1 19 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.955 0.198 25324 13443 1 19 . 1 1 96 96 GLU H H 96 8.610 8.610 8.940 -0.330 25324 13444 1 19 . 1 1 97 97 ASN N N 97 117.678 117.678 112.975 4.703 25324 13445 1 19 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.803 -0.191 25324 13446 1 19 . 1 1 97 97 ASN C C 97 173.949 173.949 174.525 -0.576 25324 13447 1 19 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.437 0.578 25324 13448 1 19 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.045 0.120 25324 13449 1 19 . 1 1 97 97 ASN H H 97 8.533 8.533 8.016 0.517 25324 13450 1 19 . 1 1 98 98 GLN N N 98 118.592 118.592 119.771 -1.179 25324 13451 1 19 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.481 -0.121 25324 13452 1 19 . 1 1 98 98 GLN C C 98 173.116 173.116 174.190 -1.074 25324 13453 1 19 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.198 0.430 25324 13454 1 19 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.279 -0.410 25324 13455 1 19 . 1 1 98 98 GLN H H 98 7.663 7.663 7.405 0.258 25324 13456 1 19 . 1 1 99 99 ASN N N 99 122.855 122.855 122.090 0.765 25324 13457 1 19 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.064 0.071 25324 13458 1 19 . 1 1 99 99 ASN C C 99 175.287 175.287 175.126 0.161 25324 13459 1 19 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.560 0.430 25324 13460 1 19 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.530 -0.039 25324 13461 1 19 . 1 1 99 99 ASN H H 99 8.759 8.759 8.792 -0.033 25324 13462 1 19 . 1 1 100 100 VAL N N 100 121.385 121.385 120.670 0.715 25324 13463 1 19 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.747 0.001 25324 13464 1 19 . 1 1 100 100 VAL C C 100 174.956 174.956 176.029 -1.073 25324 13465 1 19 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.705 0.138 25324 13466 1 19 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.619 0.824 25324 13467 1 19 . 1 1 100 100 VAL H H 100 8.717 8.717 8.107 0.610 25324 13468 1 19 . 1 1 101 101 VAL N N 101 112.736 112.736 119.361 -6.625 25324 13469 1 19 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.466 0.179 25324 13470 1 19 . 1 1 101 101 VAL C C 101 175.577 175.577 174.405 1.172 25324 13471 1 19 . 1 1 101 101 VAL CA C 101 59.963 59.963 60.889 -0.926 25324 13472 1 19 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.497 -0.456 25324 13473 1 19 . 1 1 101 101 VAL H H 101 8.802 8.802 8.841 -0.039 25324 13474 1 19 . 1 1 102 102 ALA N N 102 122.104 122.104 121.634 0.470 25324 13475 1 19 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.039 -0.232 25324 13476 1 19 . 1 1 102 102 ALA C C 102 176.046 176.046 174.949 1.097 25324 13477 1 19 . 1 1 102 102 ALA CA C 102 53.254 53.254 51.325 1.929 25324 13478 1 19 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.281 -0.656 25324 13479 1 19 . 1 1 102 102 ALA H H 102 7.677 7.677 7.735 -0.058 25324 13480 1 19 . 1 1 103 103 ILE N N 103 118.218 118.218 121.820 -3.602 25324 13481 1 19 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.320 -0.293 25324 13482 1 19 . 1 1 103 103 ILE C C 103 173.118 173.118 173.675 -0.557 25324 13483 1 19 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.682 1.545 25324 13484 1 19 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.674 0.797 25324 13485 1 19 . 1 1 103 103 ILE H H 103 8.102 8.102 8.734 -0.632 25324 13486 1 19 . 1 1 104 104 ASN N N 104 125.938 125.938 126.400 -0.462 25324 13487 1 19 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.454 0.232 25324 13488 1 19 . 1 1 104 104 ASN C C 104 174.870 174.870 173.530 1.340 25324 13489 1 19 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.072 0.481 25324 13490 1 19 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.289 -1.437 25324 13491 1 19 . 1 1 104 104 ASN H H 104 8.668 8.668 9.130 -0.462 25324 13492 1 19 . 1 1 105 105 VAL N N 105 114.631 114.631 119.135 -4.504 25324 13493 1 19 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.072 0.133 25324 13494 1 19 . 1 1 105 105 VAL C C 105 174.788 174.788 173.706 1.082 25324 13495 1 19 . 1 1 105 105 VAL CA C 105 57.979 57.979 59.942 -1.963 25324 13496 1 19 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.267 0.773 25324 13497 1 19 . 1 1 105 105 VAL H H 105 8.933 8.933 8.768 0.165 25324 13498 1 19 . 1 1 106 106 GLU N N 106 118.347 118.347 123.393 -5.046 25324 13499 1 19 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.448 -0.368 25324 13500 1 19 . 1 1 106 106 GLU C C 106 174.777 174.777 174.823 -0.046 25324 13501 1 19 . 1 1 106 106 GLU CA C 106 54.967 54.967 54.903 0.064 25324 13502 1 19 . 1 1 106 106 GLU CB C 106 33.643 33.643 34.755 -1.113 25324 13503 1 19 . 1 1 106 106 GLU H H 106 8.814 8.814 8.802 0.012 25324 13504 1 19 . 1 1 107 107 SER N N 107 115.335 115.335 117.065 -1.730 25324 13505 1 19 . 1 1 107 107 SER HA H 107 5.266 5.266 4.797 0.469 25324 13506 1 19 . 1 1 107 107 SER C C 107 175.787 175.787 175.152 0.635 25324 13507 1 19 . 1 1 107 107 SER CA C 107 55.888 55.888 56.575 -0.687 25324 13508 1 19 . 1 1 107 107 SER CB C 107 65.921 65.921 64.768 1.153 25324 13509 1 19 . 1 1 107 107 SER H H 107 8.576 8.576 8.446 0.130 25324 13510 1 19 . 1 1 108 108 GLY N N 108 117.567 117.567 112.431 5.136 25324 13511 1 19 . 1 1 108 108 GLY C C 108 173.959 173.959 174.559 -0.600 25324 13512 1 19 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.158 -0.481 25324 13513 1 19 . 1 1 108 108 GLY H H 108 9.532 9.532 8.733 0.799 25324 13514 1 19 . 1 1 109 109 ASP N N 109 122.108 122.108 121.270 0.838 25324 13515 1 19 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.791 0.010 25324 13516 1 19 . 1 1 109 109 ASP C C 109 176.203 176.203 175.298 0.905 25324 13517 1 19 . 1 1 109 109 ASP CA C 109 52.134 52.134 52.808 -0.674 25324 13518 1 19 . 1 1 109 109 ASP CB C 109 39.342 39.342 42.448 -3.106 25324 13519 1 19 . 1 1 109 109 ASP H H 109 8.605 8.605 7.678 0.927 25324 13520 1 19 . 1 1 110 110 ASP N N 110 116.197 116.197 117.791 -1.594 25324 13521 1 19 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.566 -0.344 25324 13522 1 19 . 1 1 110 110 ASP C C 110 175.951 175.951 176.376 -0.425 25324 13523 1 19 . 1 1 110 110 ASP CA C 110 55.198 55.198 53.221 1.977 25324 13524 1 19 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.055 -1.425 25324 13525 1 19 . 1 1 110 110 ASP H H 110 9.087 9.087 8.402 0.685 25324 13526 1 19 . 1 1 111 111 GLY N N 111 103.841 103.841 107.657 -3.816 25324 13527 1 19 . 1 1 111 111 GLY C C 111 173.924 173.924 174.745 -0.821 25324 13528 1 19 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.410 -0.247 25324 13529 1 19 . 1 1 111 111 GLY H H 111 8.930 8.930 7.983 0.947 25324 13530 1 19 . 1 1 112 112 GLN N N 112 121.626 121.626 119.859 1.767 25324 13531 1 19 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.121 -0.051 25324 13532 1 19 . 1 1 112 112 GLN C C 112 176.431 176.431 175.062 1.369 25324 13533 1 19 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.186 0.087 25324 13534 1 19 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.401 -1.708 25324 13535 1 19 . 1 1 112 112 GLN H H 112 7.351 7.351 8.472 -1.121 25324 13536 1 19 . 1 1 113 113 THR N N 113 112.322 112.322 106.499 5.823 25324 13537 1 19 . 1 1 113 113 THR HA H 113 5.331 5.331 5.197 0.134 25324 13538 1 19 . 1 1 113 113 THR C C 113 174.452 174.452 172.797 1.655 25324 13539 1 19 . 1 1 113 113 THR CA C 113 59.739 59.739 59.648 0.091 25324 13540 1 19 . 1 1 113 113 THR CB C 113 71.773 71.773 71.876 -0.103 25324 13541 1 19 . 1 1 113 113 THR H H 113 10.053 10.053 7.595 2.458 25324 13542 1 19 . 1 1 114 114 LEU N N 114 122.083 122.083 123.064 -0.981 25324 13543 1 19 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.729 -0.148 25324 13544 1 19 . 1 1 114 114 LEU C C 114 175.113 175.113 174.938 0.175 25324 13545 1 19 . 1 1 114 114 LEU CA C 114 52.905 52.905 54.012 -1.107 25324 13546 1 19 . 1 1 114 114 LEU CB C 114 47.033 47.033 44.530 2.503 25324 13547 1 19 . 1 1 114 114 LEU H H 114 8.978 8.978 9.051 -0.073 25324 13548 1 19 . 1 1 115 115 ASN N N 115 118.846 118.846 120.939 -2.093 25324 13549 1 19 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.950 -0.180 25324 13550 1 19 . 1 1 115 115 ASN C C 115 174.788 174.788 174.939 -0.151 25324 13551 1 19 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.832 0.510 25324 13552 1 19 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.597 0.817 25324 13553 1 19 . 1 1 115 115 ASN H H 115 8.837 8.837 8.034 0.803 25324 13554 1 19 . 1 1 116 116 GLY N N 116 109.661 109.661 109.593 0.068 25324 13555 1 19 . 1 1 116 116 GLY C C 116 172.452 172.452 172.358 0.094 25324 13556 1 19 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.151 0.320 25324 13557 1 19 . 1 1 116 116 GLY H H 116 8.625 8.625 8.734 -0.109 25324 13558 1 19 . 1 1 117 117 THR N N 117 120.009 120.009 113.666 6.343 25324 13559 1 19 . 1 1 117 117 THR HA H 117 5.556 5.556 5.616 -0.060 25324 13560 1 19 . 1 1 117 117 THR C C 117 171.619 171.619 173.364 -1.745 25324 13561 1 19 . 1 1 117 117 THR CA C 117 59.373 59.373 59.971 -0.598 25324 13562 1 19 . 1 1 117 117 THR CB C 117 72.777 72.777 72.558 0.219 25324 13563 1 19 . 1 1 117 117 THR H H 117 8.911 8.911 9.047 -0.136 25324 13564 1 19 . 1 1 118 118 MET N N 118 115.550 115.550 117.494 -1.944 25324 13565 1 19 . 1 1 118 118 MET HA H 118 4.889 4.889 5.209 -0.320 25324 13566 1 19 . 1 1 118 118 MET C C 118 172.707 172.707 173.889 -1.182 25324 13567 1 19 . 1 1 118 118 MET CA C 118 54.714 54.714 54.677 0.037 25324 13568 1 19 . 1 1 118 118 MET CB C 118 33.663 33.663 37.386 -3.723 25324 13569 1 19 . 1 1 118 118 MET H H 118 9.159 9.159 9.396 -0.237 25324 13570 1 19 . 1 1 119 119 THR N N 119 113.716 113.716 116.149 -2.433 25324 13571 1 19 . 1 1 119 119 THR HA H 119 4.682 4.682 5.374 -0.692 25324 13572 1 19 . 1 1 119 119 THR C C 119 173.952 173.952 173.581 0.371 25324 13573 1 19 . 1 1 119 119 THR CA C 119 61.395 61.395 61.404 -0.009 25324 13574 1 19 . 1 1 119 119 THR CB C 119 71.746 71.746 71.897 -0.150 25324 13575 1 19 . 1 1 119 119 THR H H 119 8.685 8.685 8.754 -0.069 25324 13576 1 19 . 1 1 120 120 TYR N N 120 129.153 129.153 124.990 4.163 25324 13577 1 19 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.837 -0.037 25324 13578 1 19 . 1 1 120 120 TYR C C 120 175.214 175.214 177.553 -2.339 25324 13579 1 19 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.410 0.467 25324 13580 1 19 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.077 0.425 25324 13581 1 19 . 1 1 120 120 TYR H H 120 10.107 10.107 8.098 2.009 25324 13582 1 19 . 1 1 121 121 ALA N N 121 119.947 119.947 126.515 -6.568 25324 13583 1 19 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.085 -0.081 25324 13584 1 19 . 1 1 121 121 ALA C C 121 178.456 178.456 177.127 1.329 25324 13585 1 19 . 1 1 121 121 ALA CA C 121 53.956 53.956 54.755 -0.798 25324 13586 1 19 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.891 -0.181 25324 13587 1 19 . 1 1 121 121 ALA H H 121 8.704 8.704 8.588 0.116 25324 13588 1 19 . 1 1 122 122 GLY N N 122 111.186 111.186 104.792 6.394 25324 13589 1 19 . 1 1 122 122 GLY C C 122 173.949 173.949 173.661 0.288 25324 13590 1 19 . 1 1 122 122 GLY CA C 122 45.002 45.002 44.945 0.057 25324 13591 1 19 . 1 1 122 122 GLY H H 122 8.792 8.792 8.236 0.556 25324 13592 1 19 . 1 1 123 123 GLU N N 123 120.099 120.099 121.450 -1.351 25324 13593 1 19 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.678 0.027 25324 13594 1 19 . 1 1 123 123 GLU C C 123 175.912 175.912 176.557 -0.645 25324 13595 1 19 . 1 1 123 123 GLU CA C 123 54.414 54.414 56.039 -1.625 25324 13596 1 19 . 1 1 123 123 GLU CB C 123 32.784 32.784 31.481 1.303 25324 13597 1 19 . 1 1 123 123 GLU H H 123 8.072 8.072 8.045 0.027 25324 13598 1 19 . 1 1 124 124 GLY N N 124 105.303 105.303 108.055 -2.752 25324 13599 1 19 . 1 1 124 124 GLY CA C 124 43.802 43.802 44.458 -0.656 25324 13600 1 19 . 1 1 124 124 GLY H H 124 7.939 7.939 7.662 0.277 25324 13601 1 19 . 1 1 125 125 PRO HA H 125 4.935 4.935 5.131 -0.196 25324 13602 1 19 . 1 1 125 125 PRO C C 125 177.788 177.788 176.417 1.371 25324 13603 1 19 . 1 1 125 125 PRO CA C 125 63.131 63.131 62.718 0.413 25324 13604 1 19 . 1 1 125 125 PRO CB C 125 31.859 31.859 31.595 0.264 25324 13605 1 19 . 1 1 126 126 ILE N N 126 117.387 117.387 119.451 -2.064 25324 13606 1 19 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.753 0.146 25324 13607 1 19 . 1 1 126 126 ILE C C 126 175.625 175.625 175.008 0.617 25324 13608 1 19 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.124 0.329 25324 13609 1 19 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.278 1.270 25324 13610 1 19 . 1 1 126 126 ILE H H 126 9.599 9.599 9.027 0.572 25324 13611 1 19 . 1 1 127 127 GLY N N 127 106.753 106.753 108.400 -1.647 25324 13612 1 19 . 1 1 127 127 GLY C C 127 173.627 173.627 172.680 0.947 25324 13613 1 19 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.451 1.832 25324 13614 1 19 . 1 1 127 127 GLY H H 127 8.840 8.840 8.721 0.119 25324 13615 1 19 . 1 1 128 128 PHE N N 128 124.826 124.826 125.890 -1.064 25324 13616 1 19 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.284 -0.340 25324 13617 1 19 . 1 1 128 128 PHE C C 128 173.087 173.087 173.406 -0.319 25324 13618 1 19 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.755 0.254 25324 13619 1 19 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.334 -0.173 25324 13620 1 19 . 1 1 128 128 PHE H H 128 8.924 8.924 9.279 -0.355 25324 13621 1 19 . 1 1 129 129 LYS N N 129 131.518 131.518 128.791 2.727 25324 13622 1 19 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.827 0.056 25324 13623 1 19 . 1 1 129 129 LYS C C 129 173.863 173.863 174.297 -0.434 25324 13624 1 19 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.397 1.338 25324 13625 1 19 . 1 1 129 129 LYS CB C 129 34.721 34.721 34.835 -0.114 25324 13626 1 19 . 1 1 129 129 LYS H H 129 8.201 8.201 8.442 -0.241 25324 13627 1 19 . 1 1 130 130 GLY N N 130 114.030 114.030 112.673 1.357 25324 13628 1 19 . 1 1 130 130 GLY C C 130 171.951 171.951 172.266 -0.315 25324 13629 1 19 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.285 0.502 25324 13630 1 19 . 1 1 130 130 GLY H H 130 9.325 9.325 8.747 0.578 25324 13631 1 19 . 1 1 131 131 THR N N 131 120.583 120.583 116.948 3.635 25324 13632 1 19 . 1 1 131 131 THR HA H 131 4.939 4.939 5.157 -0.218 25324 13633 1 19 . 1 1 131 131 THR C C 131 173.118 173.118 173.621 -0.503 25324 13634 1 19 . 1 1 131 131 THR CA C 131 61.266 61.266 60.154 1.112 25324 13635 1 19 . 1 1 131 131 THR CB C 131 70.392 70.392 71.408 -1.016 25324 13636 1 19 . 1 1 131 131 THR H H 131 8.916 8.916 8.844 0.072 25324 13637 1 19 . 1 1 132 132 LEU N N 132 130.774 130.774 129.047 1.727 25324 13638 1 19 . 1 1 132 132 LEU HA H 132 3.500 3.500 4.075 -0.575 25324 13639 1 19 . 1 1 132 132 LEU C C 132 176.574 176.574 177.706 -1.132 25324 13640 1 19 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.865 0.322 25324 13641 1 19 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.094 0.353 25324 13642 1 19 . 1 1 132 132 LEU H H 132 8.527 8.527 8.481 0.046 25324 13643 1 20 . 1 1 3 3 LEU N N 3 123.202 123.202 123.114 0.088 25324 13644 1 20 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.946 0.211 25324 13645 1 20 . 1 1 3 3 LEU C C 3 175.786 175.786 175.206 0.580 25324 13646 1 20 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.181 0.103 25324 13647 1 20 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.225 0.105 25324 13648 1 20 . 1 1 3 3 LEU H H 3 8.711 8.711 8.301 0.410 25324 13649 1 20 . 1 1 4 4 TYR N N 4 120.906 120.906 125.302 -4.396 25324 13650 1 20 . 1 1 4 4 TYR HA H 4 5.024 5.024 4.895 0.129 25324 13651 1 20 . 1 1 4 4 TYR C C 4 175.953 175.953 174.690 1.263 25324 13652 1 20 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.938 -0.561 25324 13653 1 20 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.038 -0.383 25324 13654 1 20 . 1 1 4 4 TYR H H 4 9.142 9.142 9.492 -0.350 25324 13655 1 20 . 1 1 5 5 ASN N N 5 120.496 120.496 120.751 -0.255 25324 13656 1 20 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.805 0.311 25324 13657 1 20 . 1 1 5 5 ASN C C 5 174.953 174.953 173.574 1.379 25324 13658 1 20 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.210 -0.263 25324 13659 1 20 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.290 -1.399 25324 13660 1 20 . 1 1 5 5 ASN H H 5 8.787 8.787 9.070 -0.283 25324 13661 1 20 . 1 1 6 6 VAL N N 6 127.428 127.428 126.252 1.176 25324 13662 1 20 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.263 0.099 25324 13663 1 20 . 1 1 6 6 VAL C C 6 174.955 174.955 174.588 0.367 25324 13664 1 20 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.297 0.136 25324 13665 1 20 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.467 -0.135 25324 13666 1 20 . 1 1 6 6 VAL H H 6 8.806 8.806 7.948 0.858 25324 13667 1 20 . 1 1 7 7 GLU N N 7 124.355 124.355 126.898 -2.543 25324 13668 1 20 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.886 0.096 25324 13669 1 20 . 1 1 7 7 GLU C C 7 174.551 174.551 174.887 -0.336 25324 13670 1 20 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.684 -0.895 25324 13671 1 20 . 1 1 7 7 GLU CB C 7 34.567 34.567 33.116 1.451 25324 13672 1 20 . 1 1 7 7 GLU H H 7 8.800 8.800 8.821 -0.021 25324 13673 1 20 . 1 1 8 8 ASN N N 8 116.231 116.231 121.554 -5.323 25324 13674 1 20 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.773 0.268 25324 13675 1 20 . 1 1 8 8 ASN C C 8 172.709 172.709 173.462 -0.753 25324 13676 1 20 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.446 -0.829 25324 13677 1 20 . 1 1 8 8 ASN CB C 8 45.585 45.585 42.968 2.617 25324 13678 1 20 . 1 1 8 8 ASN H H 8 9.320 9.320 9.169 0.151 25324 13679 1 20 . 1 1 9 9 GLN N N 9 120.762 120.762 122.923 -2.161 25324 13680 1 20 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.276 -0.102 25324 13681 1 20 . 1 1 9 9 GLN C C 9 173.454 173.454 173.565 -0.111 25324 13682 1 20 . 1 1 9 9 GLN CA C 9 53.960 53.960 53.848 0.112 25324 13683 1 20 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.578 -0.888 25324 13684 1 20 . 1 1 9 9 GLN H H 9 6.887 6.887 8.557 -1.670 25324 13685 1 20 . 1 1 10 10 TRP N N 10 127.775 127.775 124.090 3.685 25324 13686 1 20 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.106 -0.118 25324 13687 1 20 . 1 1 10 10 TRP C C 10 175.281 175.281 176.317 -1.036 25324 13688 1 20 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.433 -0.140 25324 13689 1 20 . 1 1 10 10 TRP CB C 10 29.742 29.742 31.510 -1.768 25324 13690 1 20 . 1 1 10 10 TRP H H 10 8.518 8.518 7.736 0.782 25324 13691 1 20 . 1 1 11 11 GLY N N 11 107.838 107.838 111.107 -3.269 25324 13692 1 20 . 1 1 11 11 GLY C C 11 174.733 174.733 174.265 0.468 25324 13693 1 20 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.716 0.120 25324 13694 1 20 . 1 1 11 11 GLY H H 11 8.461 8.461 8.716 -0.255 25324 13695 1 20 . 1 1 12 12 GLY N N 12 109.696 109.696 108.197 1.499 25324 13696 1 20 . 1 1 12 12 GLY C C 12 174.133 174.133 173.913 0.220 25324 13697 1 20 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.620 -0.831 25324 13698 1 20 . 1 1 12 12 GLY H H 12 8.138 8.138 7.457 0.681 25324 13699 1 20 . 1 1 13 13 SER N N 13 111.308 111.308 114.661 -3.353 25324 13700 1 20 . 1 1 13 13 SER HA H 13 4.092 4.092 4.386 -0.294 25324 13701 1 20 . 1 1 13 13 SER C C 13 175.622 175.622 175.397 0.225 25324 13702 1 20 . 1 1 13 13 SER CA C 13 60.494 60.494 59.536 0.958 25324 13703 1 20 . 1 1 13 13 SER CB C 13 63.028 63.028 63.610 -0.582 25324 13704 1 20 . 1 1 13 13 SER H H 13 8.215 8.215 8.526 -0.311 25324 13705 1 20 . 1 1 14 14 SER N N 14 115.290 115.290 116.112 -0.822 25324 13706 1 20 . 1 1 14 14 SER HA H 14 4.566 4.566 4.337 0.229 25324 13707 1 20 . 1 1 14 14 SER C C 14 173.532 173.532 174.119 -0.587 25324 13708 1 20 . 1 1 14 14 SER CA C 14 57.317 57.317 58.110 -0.793 25324 13709 1 20 . 1 1 14 14 SER CB C 14 63.230 63.230 63.157 0.073 25324 13710 1 20 . 1 1 14 14 SER H H 14 8.213 8.213 7.850 0.363 25324 13711 1 20 . 1 1 15 15 ALA N N 15 126.470 126.470 125.638 0.832 25324 13712 1 20 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.469 -0.066 25324 13713 1 20 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.437 1.028 25324 13714 1 20 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.300 -0.071 25324 13715 1 20 . 1 1 15 15 ALA H H 15 7.308 7.308 7.346 -0.038 25324 13716 1 20 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.256 0.153 25324 13717 1 20 . 1 1 16 16 PRO C C 16 175.627 175.627 175.433 0.194 25324 13718 1 20 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.405 -0.013 25324 13719 1 20 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.501 -0.364 25324 13720 1 20 . 1 1 17 17 TRP N N 17 120.228 120.228 121.165 -0.937 25324 13721 1 20 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.496 -0.178 25324 13722 1 20 . 1 1 17 17 TRP C C 17 175.951 175.951 176.221 -0.270 25324 13723 1 20 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.956 -0.041 25324 13724 1 20 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.469 -1.060 25324 13725 1 20 . 1 1 17 17 TRP H H 17 8.380 8.380 8.158 0.222 25324 13726 1 20 . 1 1 18 18 ASN N N 18 120.663 120.663 122.920 -2.257 25324 13727 1 20 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.061 0.025 25324 13728 1 20 . 1 1 18 18 ASN C C 18 174.793 174.793 174.148 0.645 25324 13729 1 20 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.100 -0.499 25324 13730 1 20 . 1 1 18 18 ASN CB C 18 42.648 42.648 40.966 1.682 25324 13731 1 20 . 1 1 18 18 ASN H H 18 9.094 9.094 8.836 0.258 25324 13732 1 20 . 1 1 19 19 GLU N N 19 122.202 122.202 124.574 -2.372 25324 13733 1 20 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.939 -0.800 25324 13734 1 20 . 1 1 19 19 GLU C C 19 176.869 176.869 176.414 0.455 25324 13735 1 20 . 1 1 19 19 GLU CA C 19 58.600 58.600 55.961 2.639 25324 13736 1 20 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.972 -0.590 25324 13737 1 20 . 1 1 19 19 GLU H H 19 9.013 9.013 8.918 0.095 25324 13738 1 20 . 1 1 20 20 GLY N N 20 112.893 112.893 112.787 0.106 25324 13739 1 20 . 1 1 20 20 GLY C C 20 174.878 174.878 173.153 1.725 25324 13740 1 20 . 1 1 20 20 GLY CA C 20 44.995 44.995 45.085 -0.090 25324 13741 1 20 . 1 1 20 20 GLY H H 20 8.926 8.926 8.523 0.403 25324 13742 1 20 . 1 1 21 21 GLY N N 21 110.354 110.354 107.253 3.101 25324 13743 1 20 . 1 1 21 21 GLY C C 21 171.623 171.623 171.927 -0.304 25324 13744 1 20 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.457 -1.059 25324 13745 1 20 . 1 1 21 21 GLY H H 21 8.258 8.258 7.739 0.519 25324 13746 1 20 . 1 1 22 22 GLN N N 22 117.541 117.541 117.677 -0.136 25324 13747 1 20 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.927 0.750 25324 13748 1 20 . 1 1 22 22 GLN C C 22 175.957 175.957 174.329 1.628 25324 13749 1 20 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.772 0.172 25324 13750 1 20 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.229 -1.144 25324 13751 1 20 . 1 1 22 22 GLN H H 22 8.564 8.564 8.602 -0.038 25324 13752 1 20 . 1 1 23 23 TRP N N 23 127.208 127.208 122.624 4.584 25324 13753 1 20 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.086 0.113 25324 13754 1 20 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.623 -0.093 25324 13755 1 20 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.426 -0.743 25324 13756 1 20 . 1 1 23 23 TRP H H 23 9.347 9.347 9.022 0.325 25324 13757 1 20 . 1 1 24 24 GLU N N 24 123.504 123.504 120.502 3.002 25324 13758 1 20 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.391 0.117 25324 13759 1 20 . 1 1 24 24 GLU C C 24 174.222 174.222 175.176 -0.954 25324 13760 1 20 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.409 0.182 25324 13761 1 20 . 1 1 24 24 GLU CB C 24 30.615 30.615 33.178 -2.563 25324 13762 1 20 . 1 1 24 24 GLU H H 24 9.296 9.296 8.588 0.708 25324 13763 1 20 . 1 1 25 25 ILE N N 25 123.447 123.447 126.658 -3.211 25324 13764 1 20 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.266 0.170 25324 13765 1 20 . 1 1 25 25 ILE C C 25 175.790 175.790 174.543 1.247 25324 13766 1 20 . 1 1 25 25 ILE CA C 25 59.627 59.627 59.798 -0.171 25324 13767 1 20 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.037 0.915 25324 13768 1 20 . 1 1 25 25 ILE H H 25 8.635 8.635 8.434 0.201 25324 13769 1 20 . 1 1 26 26 GLY N N 26 111.544 111.544 113.782 -2.238 25324 13770 1 20 . 1 1 26 26 GLY C C 26 172.122 172.122 174.606 -2.484 25324 13771 1 20 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.776 -0.698 25324 13772 1 20 . 1 1 26 26 GLY H H 26 3.381 3.381 6.987 -3.606 25324 13773 1 20 . 1 1 27 27 SER N N 27 112.279 112.279 117.978 -5.699 25324 13774 1 20 . 1 1 27 27 SER HA H 27 4.876 4.876 4.746 0.130 25324 13775 1 20 . 1 1 27 27 SER C C 27 174.113 174.113 174.136 -0.023 25324 13776 1 20 . 1 1 27 27 SER CA C 27 56.954 56.954 58.823 -1.869 25324 13777 1 20 . 1 1 27 27 SER CB C 27 64.554 64.554 64.082 0.473 25324 13778 1 20 . 1 1 27 27 SER H H 27 8.212 8.212 8.996 -0.784 25324 13779 1 20 . 1 1 28 28 ARG N N 28 120.872 120.872 121.310 -0.438 25324 13780 1 20 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.686 0.077 25324 13781 1 20 . 1 1 28 28 ARG C C 28 176.119 176.119 175.884 0.235 25324 13782 1 20 . 1 1 28 28 ARG CA C 28 55.117 55.117 55.679 -0.562 25324 13783 1 20 . 1 1 28 28 ARG CB C 28 31.830 31.830 33.031 -1.201 25324 13784 1 20 . 1 1 28 28 ARG H H 28 7.849 7.849 7.760 0.089 25324 13785 1 20 . 1 1 29 29 SER N N 29 118.985 118.985 117.617 1.368 25324 13786 1 20 . 1 1 29 29 SER HA H 29 4.192 4.192 4.531 -0.339 25324 13787 1 20 . 1 1 29 29 SER C C 29 174.622 174.622 174.977 -0.355 25324 13788 1 20 . 1 1 29 29 SER CA C 29 60.072 60.072 58.601 1.471 25324 13789 1 20 . 1 1 29 29 SER CB C 29 62.876 62.876 63.559 -0.682 25324 13790 1 20 . 1 1 29 29 SER H H 29 8.892 8.892 8.883 0.009 25324 13791 1 20 . 1 1 30 30 ASP N N 30 117.632 117.632 121.667 -4.035 25324 13792 1 20 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.490 0.128 25324 13793 1 20 . 1 1 30 30 ASP C C 30 175.101 175.101 176.374 -1.273 25324 13794 1 20 . 1 1 30 30 ASP CA C 30 53.052 53.052 56.030 -2.978 25324 13795 1 20 . 1 1 30 30 ASP CB C 30 40.523 40.523 40.889 -0.366 25324 13796 1 20 . 1 1 30 30 ASP H H 30 8.441 8.441 8.403 0.038 25324 13797 1 20 . 1 1 31 31 GLN N N 31 118.273 118.273 116.566 1.707 25324 13798 1 20 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.546 -0.061 25324 13799 1 20 . 1 1 31 31 GLN C C 31 173.453 173.453 173.693 -0.240 25324 13800 1 20 . 1 1 31 31 GLN CA C 31 54.868 54.868 55.221 -0.353 25324 13801 1 20 . 1 1 31 31 GLN CB C 31 33.249 33.249 31.612 1.637 25324 13802 1 20 . 1 1 31 31 GLN H H 31 7.029 7.029 7.794 -0.765 25324 13803 1 20 . 1 1 32 32 ASN N N 32 120.865 120.865 118.674 2.191 25324 13804 1 20 . 1 1 32 32 ASN HA H 32 5.120 5.120 5.002 0.118 25324 13805 1 20 . 1 1 32 32 ASN C C 32 175.198 175.198 174.702 0.496 25324 13806 1 20 . 1 1 32 32 ASN CA C 32 51.869 51.869 53.129 -1.260 25324 13807 1 20 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.096 -0.466 25324 13808 1 20 . 1 1 32 32 ASN H H 32 8.713 8.713 8.571 0.142 25324 13809 1 20 . 1 1 33 33 VAL N N 33 122.111 122.111 119.164 2.947 25324 13810 1 20 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.209 -0.504 25324 13811 1 20 . 1 1 33 33 VAL C C 33 174.950 174.950 175.855 -0.905 25324 13812 1 20 . 1 1 33 33 VAL CA C 33 63.847 63.847 61.831 2.016 25324 13813 1 20 . 1 1 33 33 VAL CB C 33 32.350 32.350 31.568 0.782 25324 13814 1 20 . 1 1 33 33 VAL H H 33 8.542 8.542 8.757 -0.215 25324 13815 1 20 . 1 1 34 34 VAL N N 34 113.282 113.282 119.011 -5.729 25324 13816 1 20 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.578 0.067 25324 13817 1 20 . 1 1 34 34 VAL C C 34 175.574 175.574 174.530 1.044 25324 13818 1 20 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.311 -1.337 25324 13819 1 20 . 1 1 34 34 VAL CB C 34 33.029 33.029 34.194 -1.165 25324 13820 1 20 . 1 1 34 34 VAL H H 34 8.744 8.744 8.070 0.674 25324 13821 1 20 . 1 1 35 35 ALA N N 35 122.102 122.102 121.531 0.571 25324 13822 1 20 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.177 -0.374 25324 13823 1 20 . 1 1 35 35 ALA C C 35 175.947 175.947 174.930 1.017 25324 13824 1 20 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.559 2.691 25324 13825 1 20 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.336 -0.708 25324 13826 1 20 . 1 1 35 35 ALA H H 35 7.677 7.677 7.748 -0.071 25324 13827 1 20 . 1 1 36 36 ILE N N 36 118.005 118.005 121.629 -3.624 25324 13828 1 20 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.382 -0.354 25324 13829 1 20 . 1 1 36 36 ILE C C 36 173.116 173.116 173.918 -0.802 25324 13830 1 20 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.106 1.075 25324 13831 1 20 . 1 1 36 36 ILE CB C 36 42.485 42.485 42.117 0.367 25324 13832 1 20 . 1 1 36 36 ILE H H 36 8.126 8.126 8.607 -0.481 25324 13833 1 20 . 1 1 37 37 ASN N N 37 125.632 125.632 125.963 -0.331 25324 13834 1 20 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.753 -0.072 25324 13835 1 20 . 1 1 37 37 ASN C C 37 174.854 174.854 173.869 0.985 25324 13836 1 20 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.331 0.199 25324 13837 1 20 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.262 -2.409 25324 13838 1 20 . 1 1 37 37 ASN H H 37 8.577 8.577 8.802 -0.225 25324 13839 1 20 . 1 1 38 38 VAL N N 38 114.223 114.223 118.047 -3.824 25324 13840 1 20 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.956 0.247 25324 13841 1 20 . 1 1 38 38 VAL C C 38 174.854 174.854 173.276 1.578 25324 13842 1 20 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.736 -1.756 25324 13843 1 20 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.773 0.271 25324 13844 1 20 . 1 1 38 38 VAL H H 38 8.874 8.874 8.739 0.135 25324 13845 1 20 . 1 1 39 39 GLU N N 39 118.277 118.277 122.661 -4.384 25324 13846 1 20 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.206 -0.124 25324 13847 1 20 . 1 1 39 39 GLU C C 39 174.548 174.548 175.576 -1.028 25324 13848 1 20 . 1 1 39 39 GLU CA C 39 54.993 54.993 53.897 1.096 25324 13849 1 20 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.557 -0.979 25324 13850 1 20 . 1 1 39 39 GLU H H 39 8.761 8.761 9.354 -0.593 25324 13851 1 20 . 1 1 40 40 SER N N 40 114.960 114.960 120.774 -5.814 25324 13852 1 20 . 1 1 40 40 SER HA H 40 5.265 5.265 4.709 0.556 25324 13853 1 20 . 1 1 40 40 SER C C 40 175.783 175.783 175.129 0.654 25324 13854 1 20 . 1 1 40 40 SER CA C 40 55.880 55.880 58.089 -2.209 25324 13855 1 20 . 1 1 40 40 SER CB C 40 65.911 65.911 63.443 2.468 25324 13856 1 20 . 1 1 40 40 SER H H 40 8.500 8.500 8.604 -0.104 25324 13857 1 20 . 1 1 41 41 GLY N N 41 117.567 117.567 112.727 4.840 25324 13858 1 20 . 1 1 41 41 GLY C C 41 174.119 174.119 174.755 -0.636 25324 13859 1 20 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.319 -0.631 25324 13860 1 20 . 1 1 41 41 GLY H H 41 9.533 9.533 8.926 0.607 25324 13861 1 20 . 1 1 42 42 ASP N N 42 122.141 122.141 120.606 1.535 25324 13862 1 20 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.808 -0.008 25324 13863 1 20 . 1 1 42 42 ASP C C 42 176.121 176.121 176.577 -0.456 25324 13864 1 20 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.787 -1.641 25324 13865 1 20 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.210 -2.856 25324 13866 1 20 . 1 1 42 42 ASP H H 42 8.644 8.644 7.817 0.827 25324 13867 1 20 . 1 1 43 43 ASP N N 43 116.025 116.025 120.090 -4.065 25324 13868 1 20 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.487 -0.258 25324 13869 1 20 . 1 1 43 43 ASP C C 43 176.018 176.018 176.799 -0.781 25324 13870 1 20 . 1 1 43 43 ASP CA C 43 55.249 55.249 55.187 0.062 25324 13871 1 20 . 1 1 43 43 ASP CB C 43 38.559 38.559 38.801 -0.242 25324 13872 1 20 . 1 1 43 43 ASP H H 43 9.111 9.111 8.631 0.480 25324 13873 1 20 . 1 1 44 44 GLY N N 44 104.263 104.263 108.942 -4.679 25324 13874 1 20 . 1 1 44 44 GLY C C 44 173.922 173.922 175.305 -1.383 25324 13875 1 20 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.268 0.033 25324 13876 1 20 . 1 1 44 44 GLY H H 44 9.063 9.063 8.179 0.884 25324 13877 1 20 . 1 1 45 45 GLN N N 45 121.691 121.691 118.418 3.273 25324 13878 1 20 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.163 -0.077 25324 13879 1 20 . 1 1 45 45 GLN C C 45 176.284 176.284 175.494 0.790 25324 13880 1 20 . 1 1 45 45 GLN CA C 45 58.118 58.118 57.640 0.478 25324 13881 1 20 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.183 -1.509 25324 13882 1 20 . 1 1 45 45 GLN H H 45 7.356 7.356 8.255 -0.899 25324 13883 1 20 . 1 1 46 46 THR N N 46 111.843 111.843 111.842 0.001 25324 13884 1 20 . 1 1 46 46 THR HA H 46 5.355 5.355 5.473 -0.118 25324 13885 1 20 . 1 1 46 46 THR C C 46 174.451 174.451 172.522 1.929 25324 13886 1 20 . 1 1 46 46 THR CA C 46 59.644 59.644 59.936 -0.292 25324 13887 1 20 . 1 1 46 46 THR CB C 46 72.714 72.714 70.286 2.428 25324 13888 1 20 . 1 1 46 46 THR H H 46 10.123 10.123 7.666 2.457 25324 13889 1 20 . 1 1 47 47 LEU N N 47 119.302 119.302 127.995 -8.693 25324 13890 1 20 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.667 0.140 25324 13891 1 20 . 1 1 47 47 LEU C C 47 175.487 175.487 174.996 0.491 25324 13892 1 20 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.694 -0.624 25324 13893 1 20 . 1 1 47 47 LEU CB C 47 48.003 48.003 43.996 4.006 25324 13894 1 20 . 1 1 47 47 LEU H H 47 8.364 8.364 8.716 -0.352 25324 13895 1 20 . 1 1 48 48 ASN N N 48 116.844 116.844 120.012 -3.168 25324 13896 1 20 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.931 -0.202 25324 13897 1 20 . 1 1 48 48 ASN C C 48 174.460 174.460 174.953 -0.493 25324 13898 1 20 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.734 1.005 25324 13899 1 20 . 1 1 48 48 ASN CB C 48 43.413 43.413 43.018 0.395 25324 13900 1 20 . 1 1 48 48 ASN H H 48 8.748 8.748 8.770 -0.022 25324 13901 1 20 . 1 1 49 49 GLY N N 49 109.417 109.417 108.991 0.426 25324 13902 1 20 . 1 1 49 49 GLY C C 49 172.126 172.126 172.240 -0.114 25324 13903 1 20 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.207 0.284 25324 13904 1 20 . 1 1 49 49 GLY H H 49 8.744 8.744 9.032 -0.288 25324 13905 1 20 . 1 1 50 50 THR N N 50 119.162 119.162 113.847 5.315 25324 13906 1 20 . 1 1 50 50 THR HA H 50 5.556 5.556 5.543 0.013 25324 13907 1 20 . 1 1 50 50 THR C C 50 171.790 171.790 172.757 -0.967 25324 13908 1 20 . 1 1 50 50 THR CA C 50 59.371 59.371 60.035 -0.664 25324 13909 1 20 . 1 1 50 50 THR CB C 50 72.799 72.799 72.628 0.171 25324 13910 1 20 . 1 1 50 50 THR H H 50 8.799 8.799 8.996 -0.197 25324 13911 1 20 . 1 1 51 51 MET N N 51 115.232 115.232 122.433 -7.201 25324 13912 1 20 . 1 1 51 51 MET HA H 51 4.886 4.886 4.669 0.217 25324 13913 1 20 . 1 1 51 51 MET C C 51 172.708 172.708 173.740 -1.032 25324 13914 1 20 . 1 1 51 51 MET CA C 51 54.722 54.722 54.430 0.292 25324 13915 1 20 . 1 1 51 51 MET CB C 51 34.557 34.557 36.771 -2.214 25324 13916 1 20 . 1 1 51 51 MET H H 51 9.062 9.062 9.304 -0.242 25324 13917 1 20 . 1 1 52 52 THR N N 52 113.697 113.697 123.174 -9.477 25324 13918 1 20 . 1 1 52 52 THR HA H 52 4.682 4.682 4.797 -0.115 25324 13919 1 20 . 1 1 52 52 THR C C 52 173.952 173.952 173.507 0.445 25324 13920 1 20 . 1 1 52 52 THR CA C 52 61.395 61.395 61.075 0.320 25324 13921 1 20 . 1 1 52 52 THR CB C 52 71.734 71.734 70.787 0.947 25324 13922 1 20 . 1 1 52 52 THR H H 52 8.685 8.685 8.746 -0.061 25324 13923 1 20 . 1 1 53 53 TYR N N 53 129.086 129.086 125.472 3.614 25324 13924 1 20 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.837 -0.037 25324 13925 1 20 . 1 1 53 53 TYR C C 53 175.214 175.214 176.591 -1.377 25324 13926 1 20 . 1 1 53 53 TYR CA C 53 58.881 58.881 58.048 0.833 25324 13927 1 20 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.622 0.890 25324 13928 1 20 . 1 1 53 53 TYR H H 53 10.112 10.112 8.948 1.164 25324 13929 1 20 . 1 1 54 54 ALA N N 54 119.947 119.947 123.633 -3.686 25324 13930 1 20 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.267 -0.265 25324 13931 1 20 . 1 1 54 54 ALA C C 54 178.285 178.285 177.634 0.651 25324 13932 1 20 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.302 0.669 25324 13933 1 20 . 1 1 54 54 ALA CB C 54 18.717 18.717 17.877 0.840 25324 13934 1 20 . 1 1 54 54 ALA H H 54 8.704 8.704 8.328 0.376 25324 13935 1 20 . 1 1 55 55 GLY N N 55 110.940 110.940 112.157 -1.217 25324 13936 1 20 . 1 1 55 55 GLY C C 55 173.903 173.903 174.175 -0.272 25324 13937 1 20 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.204 -0.188 25324 13938 1 20 . 1 1 55 55 GLY H H 55 8.745 8.745 8.599 0.146 25324 13939 1 20 . 1 1 56 56 GLU N N 56 120.073 120.073 119.635 0.438 25324 13940 1 20 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.623 0.086 25324 13941 1 20 . 1 1 56 56 GLU C C 56 175.906 175.906 175.843 0.063 25324 13942 1 20 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.100 -0.677 25324 13943 1 20 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.559 0.265 25324 13944 1 20 . 1 1 56 56 GLU H H 56 8.039 8.039 7.828 0.211 25324 13945 1 20 . 1 1 57 57 GLY N N 57 105.298 105.298 109.162 -3.864 25324 13946 1 20 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.904 -0.102 25324 13947 1 20 . 1 1 57 57 GLY H H 57 7.937 7.937 8.413 -0.476 25324 13948 1 20 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.747 0.187 25324 13949 1 20 . 1 1 58 58 PRO C C 58 177.785 177.785 176.533 1.252 25324 13950 1 20 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.070 0.062 25324 13951 1 20 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.499 -0.659 25324 13952 1 20 . 1 1 59 59 ILE N N 59 117.386 117.386 117.698 -0.312 25324 13953 1 20 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.632 0.356 25324 13954 1 20 . 1 1 59 59 ILE C C 59 175.688 175.688 175.408 0.280 25324 13955 1 20 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.116 0.427 25324 13956 1 20 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.216 1.072 25324 13957 1 20 . 1 1 59 59 ILE H H 59 9.600 9.600 8.889 0.711 25324 13958 1 20 . 1 1 60 60 GLY N N 60 107.164 107.164 107.826 -0.662 25324 13959 1 20 . 1 1 60 60 GLY C C 60 173.787 173.787 172.731 1.056 25324 13960 1 20 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.739 1.496 25324 13961 1 20 . 1 1 60 60 GLY H H 60 8.957 8.957 8.493 0.464 25324 13962 1 20 . 1 1 61 61 PHE N N 61 124.597 124.597 126.537 -1.940 25324 13963 1 20 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.729 -0.506 25324 13964 1 20 . 1 1 61 61 PHE C C 61 173.126 173.126 173.332 -0.206 25324 13965 1 20 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.331 0.530 25324 13966 1 20 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.504 -0.287 25324 13967 1 20 . 1 1 61 61 PHE H H 61 8.788 8.788 9.327 -0.539 25324 13968 1 20 . 1 1 62 62 ARG N N 62 129.706 129.706 127.288 2.418 25324 13969 1 20 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.353 -0.221 25324 13970 1 20 . 1 1 62 62 ARG C C 62 172.456 172.456 172.955 -0.499 25324 13971 1 20 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.813 1.141 25324 13972 1 20 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.224 -1.354 25324 13973 1 20 . 1 1 62 62 ARG H H 62 8.405 8.405 8.324 0.081 25324 13974 1 20 . 1 1 63 63 ALA N N 63 122.744 122.744 129.155 -6.411 25324 13975 1 20 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.311 0.034 25324 13976 1 20 . 1 1 63 63 ALA C C 63 176.120 176.120 175.672 0.448 25324 13977 1 20 . 1 1 63 63 ALA CA C 63 49.919 49.919 49.946 -0.027 25324 13978 1 20 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.543 2.230 25324 13979 1 20 . 1 1 63 63 ALA H H 63 8.628 8.628 8.826 -0.198 25324 13980 1 20 . 1 1 64 64 THR N N 64 116.855 116.855 119.669 -2.814 25324 13981 1 20 . 1 1 64 64 THR HA H 64 4.848 4.848 5.147 -0.299 25324 13982 1 20 . 1 1 64 64 THR C C 64 172.957 172.957 174.400 -1.443 25324 13983 1 20 . 1 1 64 64 THR CA C 64 61.211 61.211 61.146 0.065 25324 13984 1 20 . 1 1 64 64 THR CB C 64 71.064 71.064 71.403 -0.339 25324 13985 1 20 . 1 1 64 64 THR H H 64 8.315 8.315 8.947 -0.632 25324 13986 1 20 . 1 1 65 65 LEU N N 65 129.360 129.360 128.592 0.768 25324 13987 1 20 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.893 -0.531 25324 13988 1 20 . 1 1 65 65 LEU C C 65 176.459 176.459 177.151 -0.692 25324 13989 1 20 . 1 1 65 65 LEU CA C 65 55.687 55.687 56.314 -0.627 25324 13990 1 20 . 1 1 65 65 LEU CB C 65 41.711 41.711 42.074 -0.363 25324 13991 1 20 . 1 1 65 65 LEU H H 65 8.877 8.877 9.022 -0.145 25324 13992 1 20 . 1 1 66 66 LEU N N 66 128.683 128.683 126.238 2.445 25324 13993 1 20 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.128 0.248 25324 13994 1 20 . 1 1 66 66 LEU C C 66 177.621 177.621 177.904 -0.283 25324 13995 1 20 . 1 1 66 66 LEU CA C 66 54.700 54.700 56.747 -2.047 25324 13996 1 20 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.245 0.057 25324 13997 1 20 . 1 1 66 66 LEU H H 66 9.320 9.320 8.929 0.391 25324 13998 1 20 . 1 1 67 67 GLY N N 67 105.361 105.361 105.043 0.318 25324 13999 1 20 . 1 1 67 67 GLY C C 67 173.618 173.618 173.455 0.163 25324 14000 1 20 . 1 1 67 67 GLY CA C 67 43.367 43.367 45.467 -2.100 25324 14001 1 20 . 1 1 67 67 GLY H H 67 6.639 6.639 7.578 -0.939 25324 14002 1 20 . 1 1 68 68 ASN N N 68 121.848 121.848 117.543 4.305 25324 14003 1 20 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.727 -0.396 25324 14004 1 20 . 1 1 68 68 ASN C C 68 174.316 174.316 174.415 -0.099 25324 14005 1 20 . 1 1 68 68 ASN CA C 68 54.552 54.552 53.712 0.840 25324 14006 1 20 . 1 1 68 68 ASN CB C 68 37.165 37.165 39.586 -2.421 25324 14007 1 20 . 1 1 68 68 ASN H H 68 9.236 9.236 7.867 1.369 25324 14008 1 20 . 1 1 69 69 ASN N N 69 109.509 109.509 116.613 -7.104 25324 14009 1 20 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.706 -0.626 25324 14010 1 20 . 1 1 69 69 ASN C C 69 171.456 171.456 173.969 -2.513 25324 14011 1 20 . 1 1 69 69 ASN CA C 69 55.750 55.750 53.263 2.487 25324 14012 1 20 . 1 1 69 69 ASN CB C 69 37.306 37.306 40.040 -2.734 25324 14013 1 20 . 1 1 69 69 ASN H H 69 8.651 8.651 8.298 0.353 25324 14014 1 20 . 1 1 70 70 SER N N 70 113.479 113.479 115.565 -2.086 25324 14015 1 20 . 1 1 70 70 SER HA H 70 5.437 5.437 4.999 0.438 25324 14016 1 20 . 1 1 70 70 SER C C 70 173.750 173.750 173.022 0.728 25324 14017 1 20 . 1 1 70 70 SER CA C 70 57.139 57.139 58.527 -1.388 25324 14018 1 20 . 1 1 70 70 SER CB C 70 63.818 63.818 63.772 0.046 25324 14019 1 20 . 1 1 70 70 SER H H 70 7.693 7.693 7.607 0.086 25324 14020 1 20 . 1 1 71 71 TYR N N 71 123.132 123.132 125.076 -1.944 25324 14021 1 20 . 1 1 71 71 TYR HA H 71 5.143 5.143 4.867 0.276 25324 14022 1 20 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.925 -0.277 25324 14023 1 20 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.158 0.287 25324 14024 1 20 . 1 1 71 71 TYR H H 71 9.326 9.326 9.521 -0.195 25324 14025 1 20 . 1 1 72 72 GLU N N 72 122.396 122.396 121.779 0.617 25324 14026 1 20 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.919 -0.113 25324 14027 1 20 . 1 1 72 72 GLU C C 72 175.698 175.698 174.946 0.752 25324 14028 1 20 . 1 1 72 72 GLU CA C 72 55.167 55.167 54.773 0.394 25324 14029 1 20 . 1 1 72 72 GLU CB C 72 30.184 30.184 32.574 -2.390 25324 14030 1 20 . 1 1 72 72 GLU H H 72 8.624 8.624 9.258 -0.634 25324 14031 1 20 . 1 1 73 73 VAL N N 73 128.513 128.513 127.459 1.054 25324 14032 1 20 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.282 -0.083 25324 14033 1 20 . 1 1 73 73 VAL C C 73 175.369 175.369 174.569 0.800 25324 14034 1 20 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.079 0.401 25324 14035 1 20 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.108 0.226 25324 14036 1 20 . 1 1 73 73 VAL H H 73 8.564 8.564 9.137 -0.573 25324 14037 1 20 . 1 1 74 74 GLU N N 74 124.842 124.842 127.142 -2.300 25324 14038 1 20 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.028 0.059 25324 14039 1 20 . 1 1 74 74 GLU C C 74 174.415 174.415 174.867 -0.452 25324 14040 1 20 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.921 -0.584 25324 14041 1 20 . 1 1 74 74 GLU CB C 74 35.157 35.157 32.696 2.461 25324 14042 1 20 . 1 1 74 74 GLU H H 74 9.011 9.011 8.951 0.060 25324 14043 1 20 . 1 1 75 75 ASN N N 75 116.136 116.136 122.527 -6.391 25324 14044 1 20 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.623 0.516 25324 14045 1 20 . 1 1 75 75 ASN C C 75 172.703 172.703 173.920 -1.217 25324 14046 1 20 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.872 -0.047 25324 14047 1 20 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.637 3.259 25324 14048 1 20 . 1 1 75 75 ASN H H 75 9.424 9.424 9.336 0.088 25324 14049 1 20 . 1 1 76 76 GLN N N 76 120.762 120.762 121.903 -1.141 25324 14050 1 20 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.453 -0.413 25324 14051 1 20 . 1 1 76 76 GLN C C 76 173.113 173.113 174.070 -0.957 25324 14052 1 20 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.609 -0.386 25324 14053 1 20 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.352 -0.005 25324 14054 1 20 . 1 1 76 76 GLN H H 76 7.106 7.106 8.970 -1.864 25324 14055 1 20 . 1 1 77 77 TRP N N 77 125.598 125.598 125.404 0.194 25324 14056 1 20 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.000 0.152 25324 14057 1 20 . 1 1 77 77 TRP C C 77 175.502 175.502 175.553 -0.051 25324 14058 1 20 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.987 -1.223 25324 14059 1 20 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.896 -0.897 25324 14060 1 20 . 1 1 77 77 TRP H H 77 8.181 8.181 8.000 0.181 25324 14061 1 20 . 1 1 78 78 GLY N N 78 107.901 107.901 107.252 0.649 25324 14062 1 20 . 1 1 78 78 GLY C C 78 174.611 174.611 174.842 -0.231 25324 14063 1 20 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.634 -0.732 25324 14064 1 20 . 1 1 78 78 GLY H H 78 8.778 8.778 9.722 -0.944 25324 14065 1 20 . 1 1 79 79 GLY N N 79 109.844 109.844 107.863 1.981 25324 14066 1 20 . 1 1 79 79 GLY C C 79 173.782 173.782 174.160 -0.378 25324 14067 1 20 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.527 -0.734 25324 14068 1 20 . 1 1 79 79 GLY H H 79 8.198 8.198 7.731 0.467 25324 14069 1 20 . 1 1 80 80 ASP N N 80 115.837 115.837 120.362 -4.525 25324 14070 1 20 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.303 -0.062 25324 14071 1 20 . 1 1 80 80 ASP C C 80 177.285 177.285 176.912 0.373 25324 14072 1 20 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.753 0.430 25324 14073 1 20 . 1 1 80 80 ASP CB C 80 40.523 40.523 41.153 -0.630 25324 14074 1 20 . 1 1 80 80 ASP H H 80 8.132 8.132 8.556 -0.424 25324 14075 1 20 . 1 1 81 81 SER N N 81 112.690 112.690 112.441 0.249 25324 14076 1 20 . 1 1 81 81 SER HA H 81 4.513 4.513 4.250 0.263 25324 14077 1 20 . 1 1 81 81 SER C C 81 173.684 173.684 174.402 -0.718 25324 14078 1 20 . 1 1 81 81 SER CA C 81 57.232 57.232 57.993 -0.761 25324 14079 1 20 . 1 1 81 81 SER CB C 81 63.170 63.170 62.991 0.179 25324 14080 1 20 . 1 1 81 81 SER H H 81 8.179 8.179 7.952 0.227 25324 14081 1 20 . 1 1 82 82 ALA N N 82 126.310 126.310 126.616 -0.306 25324 14082 1 20 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.413 -0.010 25324 14083 1 20 . 1 1 82 82 ALA CA C 82 50.466 50.466 49.781 0.685 25324 14084 1 20 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.472 -0.274 25324 14085 1 20 . 1 1 82 82 ALA H H 82 7.274 7.274 7.248 0.026 25324 14086 1 20 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.180 0.193 25324 14087 1 20 . 1 1 83 83 PRO C C 83 175.378 175.378 175.605 -0.227 25324 14088 1 20 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.113 0.214 25324 14089 1 20 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.483 -0.319 25324 14090 1 20 . 1 1 84 84 TRP N N 84 120.106 120.106 120.062 0.044 25324 14091 1 20 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.300 -0.029 25324 14092 1 20 . 1 1 84 84 TRP C C 84 176.358 176.358 176.183 0.175 25324 14093 1 20 . 1 1 84 84 TRP CA C 84 56.946 56.946 57.827 -0.881 25324 14094 1 20 . 1 1 84 84 TRP CB C 84 29.716 29.716 29.651 0.065 25324 14095 1 20 . 1 1 84 84 TRP H H 84 8.329 8.329 8.086 0.243 25324 14096 1 20 . 1 1 85 85 HIS N N 85 118.543 118.543 120.850 -2.307 25324 14097 1 20 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.871 0.047 25324 14098 1 20 . 1 1 85 85 HIS C C 85 174.950 174.950 175.164 -0.214 25324 14099 1 20 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.964 -1.495 25324 14100 1 20 . 1 1 85 85 HIS CB C 85 31.673 31.673 32.674 -1.001 25324 14101 1 20 . 1 1 85 85 HIS H H 85 9.204 9.204 9.126 0.078 25324 14102 1 20 . 1 1 86 86 SER N N 86 117.803 117.803 117.450 0.353 25324 14103 1 20 . 1 1 86 86 SER HA H 86 4.412 4.412 4.263 0.149 25324 14104 1 20 . 1 1 86 86 SER C C 86 175.691 175.691 175.328 0.363 25324 14105 1 20 . 1 1 86 86 SER CA C 86 60.257 60.257 59.076 1.181 25324 14106 1 20 . 1 1 86 86 SER CB C 86 63.015 63.015 63.341 -0.326 25324 14107 1 20 . 1 1 86 86 SER H H 86 9.168 9.168 8.882 0.286 25324 14108 1 20 . 1 1 87 87 GLY N N 87 115.773 115.773 112.695 3.078 25324 14109 1 20 . 1 1 87 87 GLY C C 87 174.288 174.288 174.135 0.153 25324 14110 1 20 . 1 1 87 87 GLY CA C 87 44.701 44.701 44.971 -0.270 25324 14111 1 20 . 1 1 87 87 GLY H H 87 9.284 9.284 8.986 0.298 25324 14112 1 20 . 1 1 88 88 GLY N N 88 109.162 109.162 108.228 0.934 25324 14113 1 20 . 1 1 88 88 GLY C C 88 171.120 171.120 171.698 -0.578 25324 14114 1 20 . 1 1 88 88 GLY CA C 88 44.594 44.594 44.923 -0.329 25324 14115 1 20 . 1 1 88 88 GLY H H 88 8.054 8.054 8.052 0.002 25324 14116 1 20 . 1 1 89 89 ASN N N 89 117.048 117.048 119.496 -2.448 25324 14117 1 20 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.739 0.299 25324 14118 1 20 . 1 1 89 89 ASN C C 89 175.287 175.287 174.827 0.460 25324 14119 1 20 . 1 1 89 89 ASN CA C 89 51.865 51.865 53.253 -1.388 25324 14120 1 20 . 1 1 89 89 ASN CB C 89 39.605 39.605 41.826 -2.221 25324 14121 1 20 . 1 1 89 89 ASN H H 89 8.516 8.516 8.596 -0.080 25324 14122 1 20 . 1 1 90 90 TRP N N 90 125.844 125.844 121.273 4.571 25324 14123 1 20 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.232 0.021 25324 14124 1 20 . 1 1 90 90 TRP C C 90 175.278 175.278 174.844 0.434 25324 14125 1 20 . 1 1 90 90 TRP CA C 90 54.268 54.268 55.372 -1.104 25324 14126 1 20 . 1 1 90 90 TRP CB C 90 31.958 31.958 33.708 -1.750 25324 14127 1 20 . 1 1 90 90 TRP H H 90 9.282 9.282 9.387 -0.105 25324 14128 1 20 . 1 1 91 91 ILE N N 91 123.134 123.134 120.218 2.916 25324 14129 1 20 . 1 1 91 91 ILE HA H 91 5.446 5.446 5.108 0.338 25324 14130 1 20 . 1 1 91 91 ILE C C 91 175.489 175.489 175.206 0.283 25324 14131 1 20 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.735 0.091 25324 14132 1 20 . 1 1 91 91 ILE CB C 91 39.676 39.676 40.086 -0.410 25324 14133 1 20 . 1 1 91 91 ILE H H 91 9.318 9.318 8.785 0.533 25324 14134 1 20 . 1 1 92 92 LEU N N 92 123.452 123.452 128.346 -4.894 25324 14135 1 20 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.693 0.249 25324 14136 1 20 . 1 1 92 92 LEU C C 92 173.620 173.620 174.255 -0.635 25324 14137 1 20 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.693 -1.437 25324 14138 1 20 . 1 1 92 92 LEU CB C 92 43.508 43.508 42.597 0.911 25324 14139 1 20 . 1 1 92 92 LEU H H 92 8.463 8.463 9.128 -0.665 25324 14140 1 20 . 1 1 93 93 GLY N N 93 103.987 103.987 107.066 -3.079 25324 14141 1 20 . 1 1 93 93 GLY C C 93 172.284 172.284 174.106 -1.822 25324 14142 1 20 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.326 -1.826 25324 14143 1 20 . 1 1 93 93 GLY H H 93 2.937 2.937 6.720 -3.783 25324 14144 1 20 . 1 1 94 94 SER N N 94 110.274 110.274 116.466 -6.192 25324 14145 1 20 . 1 1 94 94 SER HA H 94 4.711 4.711 4.848 -0.137 25324 14146 1 20 . 1 1 94 94 SER C C 94 174.784 174.784 175.051 -0.267 25324 14147 1 20 . 1 1 94 94 SER CA C 94 56.555 56.555 59.278 -2.723 25324 14148 1 20 . 1 1 94 94 SER CB C 94 65.051 65.051 64.003 1.048 25324 14149 1 20 . 1 1 94 94 SER H H 94 7.919 7.919 8.976 -1.057 25324 14150 1 20 . 1 1 95 95 ARG N N 95 123.020 123.020 120.690 2.330 25324 14151 1 20 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.480 0.192 25324 14152 1 20 . 1 1 95 95 ARG C C 95 176.120 176.120 176.661 -0.541 25324 14153 1 20 . 1 1 95 95 ARG CA C 95 55.374 55.374 54.417 0.957 25324 14154 1 20 . 1 1 95 95 ARG CB C 95 31.848 31.848 32.311 -0.463 25324 14155 1 20 . 1 1 95 95 ARG H H 95 9.148 9.148 7.798 1.350 25324 14156 1 20 . 1 1 96 96 GLU N N 96 120.357 120.357 124.326 -3.969 25324 14157 1 20 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.062 0.220 25324 14158 1 20 . 1 1 96 96 GLU C C 96 176.278 176.278 176.372 -0.094 25324 14159 1 20 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.961 -2.431 25324 14160 1 20 . 1 1 96 96 GLU CB C 96 30.153 30.153 30.020 0.133 25324 14161 1 20 . 1 1 96 96 GLU H H 96 8.610 8.610 8.820 -0.210 25324 14162 1 20 . 1 1 97 97 ASN N N 97 117.678 117.678 116.801 0.877 25324 14163 1 20 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.926 -0.314 25324 14164 1 20 . 1 1 97 97 ASN C C 97 173.949 173.949 174.581 -0.632 25324 14165 1 20 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.725 0.290 25324 14166 1 20 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.221 -0.055 25324 14167 1 20 . 1 1 97 97 ASN H H 97 8.533 8.533 8.367 0.166 25324 14168 1 20 . 1 1 98 98 GLN N N 98 118.592 118.592 118.145 0.447 25324 14169 1 20 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.425 -0.065 25324 14170 1 20 . 1 1 98 98 GLN C C 98 173.116 173.116 175.448 -2.332 25324 14171 1 20 . 1 1 98 98 GLN CA C 98 55.628 55.628 56.943 -1.315 25324 14172 1 20 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.280 -0.411 25324 14173 1 20 . 1 1 98 98 GLN H H 98 7.663 7.663 7.757 -0.094 25324 14174 1 20 . 1 1 99 99 ASN N N 99 122.855 122.855 115.446 7.409 25324 14175 1 20 . 1 1 99 99 ASN HA H 99 5.135 5.135 4.468 0.667 25324 14176 1 20 . 1 1 99 99 ASN C C 99 175.287 175.287 174.285 1.002 25324 14177 1 20 . 1 1 99 99 ASN CA C 99 52.990 52.990 54.340 -1.350 25324 14178 1 20 . 1 1 99 99 ASN CB C 99 40.491 40.491 38.246 2.245 25324 14179 1 20 . 1 1 99 99 ASN H H 99 8.759 8.759 8.101 0.658 25324 14180 1 20 . 1 1 100 100 VAL N N 100 121.385 121.385 120.853 0.532 25324 14181 1 20 . 1 1 100 100 VAL HA H 100 3.748 3.748 4.038 -0.290 25324 14182 1 20 . 1 1 100 100 VAL C C 100 174.956 174.956 176.838 -1.882 25324 14183 1 20 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.334 0.509 25324 14184 1 20 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.085 1.357 25324 14185 1 20 . 1 1 100 100 VAL H H 100 8.717 8.717 8.185 0.532 25324 14186 1 20 . 1 1 101 101 VAL N N 101 112.736 112.736 120.899 -8.163 25324 14187 1 20 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.414 0.231 25324 14188 1 20 . 1 1 101 101 VAL C C 101 175.577 175.577 174.468 1.109 25324 14189 1 20 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.245 -1.282 25324 14190 1 20 . 1 1 101 101 VAL CB C 101 33.041 33.041 32.943 0.098 25324 14191 1 20 . 1 1 101 101 VAL H H 101 8.802 8.802 9.047 -0.245 25324 14192 1 20 . 1 1 102 102 ALA N N 102 122.104 122.104 121.491 0.613 25324 14193 1 20 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.029 -0.222 25324 14194 1 20 . 1 1 102 102 ALA C C 102 176.046 176.046 174.979 1.067 25324 14195 1 20 . 1 1 102 102 ALA CA C 102 53.254 53.254 51.206 2.048 25324 14196 1 20 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.555 -0.930 25324 14197 1 20 . 1 1 102 102 ALA H H 102 7.677 7.677 7.749 -0.072 25324 14198 1 20 . 1 1 103 103 ILE N N 103 118.218 118.218 121.257 -3.039 25324 14199 1 20 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.586 -0.559 25324 14200 1 20 . 1 1 103 103 ILE C C 103 173.118 173.118 173.901 -0.783 25324 14201 1 20 . 1 1 103 103 ILE CA C 103 62.227 62.227 59.434 2.792 25324 14202 1 20 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.312 1.159 25324 14203 1 20 . 1 1 103 103 ILE H H 103 8.102 8.102 8.439 -0.337 25324 14204 1 20 . 1 1 104 104 ASN N N 104 125.938 125.938 126.637 -0.699 25324 14205 1 20 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.413 0.273 25324 14206 1 20 . 1 1 104 104 ASN C C 104 174.870 174.870 173.696 1.174 25324 14207 1 20 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.165 0.388 25324 14208 1 20 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.187 -1.335 25324 14209 1 20 . 1 1 104 104 ASN H H 104 8.668 8.668 9.136 -0.468 25324 14210 1 20 . 1 1 105 105 VAL N N 105 114.631 114.631 120.269 -5.638 25324 14211 1 20 . 1 1 105 105 VAL HA H 105 5.205 5.205 4.955 0.250 25324 14212 1 20 . 1 1 105 105 VAL C C 105 174.788 174.788 174.348 0.440 25324 14213 1 20 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.301 -2.322 25324 14214 1 20 . 1 1 105 105 VAL CB C 105 36.040 36.040 34.176 1.864 25324 14215 1 20 . 1 1 105 105 VAL H H 105 8.933 8.933 8.740 0.193 25324 14216 1 20 . 1 1 106 106 GLU N N 106 118.347 118.347 123.656 -5.309 25324 14217 1 20 . 1 1 106 106 GLU HA H 106 5.080 5.080 4.698 0.382 25324 14218 1 20 . 1 1 106 106 GLU C C 106 174.777 174.777 175.129 -0.352 25324 14219 1 20 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.482 -0.515 25324 14220 1 20 . 1 1 106 106 GLU CB C 106 33.643 33.643 31.310 2.333 25324 14221 1 20 . 1 1 106 106 GLU H H 106 8.814 8.814 8.510 0.304 25324 14222 1 20 . 1 1 107 107 SER N N 107 115.335 115.335 115.305 0.030 25324 14223 1 20 . 1 1 107 107 SER HA H 107 5.266 5.266 4.739 0.527 25324 14224 1 20 . 1 1 107 107 SER C C 107 175.787 175.787 173.352 2.435 25324 14225 1 20 . 1 1 107 107 SER CA C 107 55.888 55.888 57.053 -1.165 25324 14226 1 20 . 1 1 107 107 SER CB C 107 65.921 65.921 66.147 -0.226 25324 14227 1 20 . 1 1 107 107 SER H H 107 8.576 8.576 7.755 0.821 25324 14228 1 20 . 1 1 108 108 GLY N N 108 117.567 117.567 110.542 7.025 25324 14229 1 20 . 1 1 108 108 GLY C C 108 173.959 173.959 172.918 1.041 25324 14230 1 20 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.356 -0.680 25324 14231 1 20 . 1 1 108 108 GLY H H 108 9.532 9.532 8.457 1.075 25324 14232 1 20 . 1 1 109 109 ASP N N 109 122.108 122.108 124.544 -2.436 25324 14233 1 20 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.711 0.090 25324 14234 1 20 . 1 1 109 109 ASP C C 109 176.203 176.203 176.500 -0.297 25324 14235 1 20 . 1 1 109 109 ASP CA C 109 52.134 52.134 53.673 -1.539 25324 14236 1 20 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.769 -2.427 25324 14237 1 20 . 1 1 109 109 ASP H H 109 8.605 8.605 8.537 0.068 25324 14238 1 20 . 1 1 110 110 ASP N N 110 116.197 116.197 125.537 -9.340 25324 14239 1 20 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.355 -0.133 25324 14240 1 20 . 1 1 110 110 ASP C C 110 175.951 175.951 175.636 0.315 25324 14241 1 20 . 1 1 110 110 ASP CA C 110 55.198 55.198 55.551 -0.353 25324 14242 1 20 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.190 -1.560 25324 14243 1 20 . 1 1 110 110 ASP H H 110 9.087 9.087 8.817 0.270 25324 14244 1 20 . 1 1 111 111 GLY N N 111 103.841 103.841 104.027 -0.186 25324 14245 1 20 . 1 1 111 111 GLY C C 111 173.924 173.924 175.264 -1.340 25324 14246 1 20 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.442 -0.279 25324 14247 1 20 . 1 1 111 111 GLY H H 111 8.930 8.930 7.854 1.076 25324 14248 1 20 . 1 1 112 112 GLN N N 112 121.626 121.626 119.742 1.884 25324 14249 1 20 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.023 0.047 25324 14250 1 20 . 1 1 112 112 GLN C C 112 176.431 176.431 174.684 1.747 25324 14251 1 20 . 1 1 112 112 GLN CA C 112 58.273 58.273 59.169 -0.896 25324 14252 1 20 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.393 -1.700 25324 14253 1 20 . 1 1 112 112 GLN H H 112 7.351 7.351 8.213 -0.862 25324 14254 1 20 . 1 1 113 113 THR N N 113 112.322 112.322 105.856 6.466 25324 14255 1 20 . 1 1 113 113 THR HA H 113 5.331 5.331 5.158 0.173 25324 14256 1 20 . 1 1 113 113 THR C C 113 174.452 174.452 172.542 1.910 25324 14257 1 20 . 1 1 113 113 THR CA C 113 59.739 59.739 59.483 0.256 25324 14258 1 20 . 1 1 113 113 THR CB C 113 71.773 71.773 72.322 -0.549 25324 14259 1 20 . 1 1 113 113 THR H H 113 10.053 10.053 7.389 2.664 25324 14260 1 20 . 1 1 114 114 LEU N N 114 122.083 122.083 123.057 -0.974 25324 14261 1 20 . 1 1 114 114 LEU HA H 114 4.581 4.581 5.420 -0.839 25324 14262 1 20 . 1 1 114 114 LEU C C 114 175.113 175.113 174.474 0.639 25324 14263 1 20 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.757 -0.852 25324 14264 1 20 . 1 1 114 114 LEU CB C 114 47.033 47.033 45.645 1.388 25324 14265 1 20 . 1 1 114 114 LEU H H 114 8.978 8.978 8.643 0.335 25324 14266 1 20 . 1 1 115 115 ASN N N 115 118.846 118.846 124.304 -5.458 25324 14267 1 20 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.922 -0.152 25324 14268 1 20 . 1 1 115 115 ASN C C 115 174.788 174.788 174.617 0.171 25324 14269 1 20 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.593 0.749 25324 14270 1 20 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.051 1.363 25324 14271 1 20 . 1 1 115 115 ASN H H 115 8.837 8.837 8.351 0.486 25324 14272 1 20 . 1 1 116 116 GLY N N 116 109.661 109.661 109.014 0.647 25324 14273 1 20 . 1 1 116 116 GLY C C 116 172.452 172.452 172.406 0.046 25324 14274 1 20 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.312 0.159 25324 14275 1 20 . 1 1 116 116 GLY H H 116 8.625 8.625 8.785 -0.160 25324 14276 1 20 . 1 1 117 117 THR N N 117 120.009 120.009 113.891 6.118 25324 14277 1 20 . 1 1 117 117 THR HA H 117 5.556 5.556 5.567 -0.011 25324 14278 1 20 . 1 1 117 117 THR C C 117 171.619 171.619 173.315 -1.696 25324 14279 1 20 . 1 1 117 117 THR CA C 117 59.373 59.373 60.137 -0.764 25324 14280 1 20 . 1 1 117 117 THR CB C 117 72.777 72.777 72.646 0.131 25324 14281 1 20 . 1 1 117 117 THR H H 117 8.911 8.911 9.054 -0.143 25324 14282 1 20 . 1 1 118 118 MET N N 118 115.550 115.550 118.004 -2.454 25324 14283 1 20 . 1 1 118 118 MET HA H 118 4.889 4.889 5.338 -0.449 25324 14284 1 20 . 1 1 118 118 MET C C 118 172.707 172.707 174.067 -1.360 25324 14285 1 20 . 1 1 118 118 MET CA C 118 54.714 54.714 54.838 -0.124 25324 14286 1 20 . 1 1 118 118 MET CB C 118 33.663 33.663 37.482 -3.819 25324 14287 1 20 . 1 1 118 118 MET H H 118 9.159 9.159 9.468 -0.309 25324 14288 1 20 . 1 1 119 119 THR N N 119 113.716 113.716 116.598 -2.882 25324 14289 1 20 . 1 1 119 119 THR HA H 119 4.682 4.682 4.844 -0.162 25324 14290 1 20 . 1 1 119 119 THR C C 119 173.952 173.952 173.203 0.749 25324 14291 1 20 . 1 1 119 119 THR CA C 119 61.395 61.395 61.401 -0.006 25324 14292 1 20 . 1 1 119 119 THR CB C 119 71.746 71.746 71.870 -0.124 25324 14293 1 20 . 1 1 119 119 THR H H 119 8.685 8.685 8.672 0.013 25324 14294 1 20 . 1 1 120 120 TYR N N 120 129.153 129.153 125.755 3.398 25324 14295 1 20 . 1 1 120 120 TYR HA H 120 4.800 4.800 5.161 -0.361 25324 14296 1 20 . 1 1 120 120 TYR C C 120 175.214 175.214 176.225 -1.011 25324 14297 1 20 . 1 1 120 120 TYR CA C 120 58.877 58.877 57.913 0.964 25324 14298 1 20 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.373 0.129 25324 14299 1 20 . 1 1 120 120 TYR H H 120 10.107 10.107 8.956 1.151 25324 14300 1 20 . 1 1 121 121 ALA N N 121 119.947 119.947 123.829 -3.882 25324 14301 1 20 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.372 -0.368 25324 14302 1 20 . 1 1 121 121 ALA C C 121 178.456 178.456 177.941 0.515 25324 14303 1 20 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.461 0.495 25324 14304 1 20 . 1 1 121 121 ALA CB C 121 18.710 18.710 19.230 -0.520 25324 14305 1 20 . 1 1 121 121 ALA H H 121 8.704 8.704 8.296 0.408 25324 14306 1 20 . 1 1 122 122 GLY N N 122 111.186 111.186 110.713 0.473 25324 14307 1 20 . 1 1 122 122 GLY C C 122 173.949 173.949 174.366 -0.417 25324 14308 1 20 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.836 -0.834 25324 14309 1 20 . 1 1 122 122 GLY H H 122 8.792 8.792 8.858 -0.066 25324 14310 1 20 . 1 1 123 123 GLU N N 123 120.099 120.099 119.610 0.489 25324 14311 1 20 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.620 0.085 25324 14312 1 20 . 1 1 123 123 GLU C C 123 175.912 175.912 175.652 0.260 25324 14313 1 20 . 1 1 123 123 GLU CA C 123 54.414 54.414 54.843 -0.429 25324 14314 1 20 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.510 0.274 25324 14315 1 20 . 1 1 123 123 GLU H H 123 8.072 8.072 7.587 0.485 25324 14316 1 20 . 1 1 124 124 GLY N N 124 105.303 105.303 109.753 -4.450 25324 14317 1 20 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.673 0.129 25324 14318 1 20 . 1 1 124 124 GLY H H 124 7.939 7.939 8.331 -0.392 25324 14319 1 20 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.733 0.202 25324 14320 1 20 . 1 1 125 125 PRO C C 125 177.788 177.788 176.401 1.387 25324 14321 1 20 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.298 -0.168 25324 14322 1 20 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.077 -0.218 25324 14323 1 20 . 1 1 126 126 ILE N N 126 117.387 117.387 118.238 -0.851 25324 14324 1 20 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.758 0.141 25324 14325 1 20 . 1 1 126 126 ILE C C 126 175.625 175.625 174.879 0.746 25324 14326 1 20 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.036 0.417 25324 14327 1 20 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.895 0.653 25324 14328 1 20 . 1 1 126 126 ILE H H 126 9.599 9.599 8.945 0.654 25324 14329 1 20 . 1 1 127 127 GLY N N 127 106.753 106.753 107.937 -1.184 25324 14330 1 20 . 1 1 127 127 GLY C C 127 173.627 173.627 172.581 1.046 25324 14331 1 20 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.449 1.834 25324 14332 1 20 . 1 1 127 127 GLY H H 127 8.840 8.840 8.852 -0.012 25324 14333 1 20 . 1 1 128 128 PHE N N 128 124.826 124.826 125.594 -0.768 25324 14334 1 20 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.180 -0.236 25324 14335 1 20 . 1 1 128 128 PHE C C 128 173.087 173.087 173.348 -0.261 25324 14336 1 20 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.526 0.483 25324 14337 1 20 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.404 -0.244 25324 14338 1 20 . 1 1 128 128 PHE H H 128 8.924 8.924 9.145 -0.221 25324 14339 1 20 . 1 1 129 129 LYS N N 129 131.518 131.518 128.755 2.763 25324 14340 1 20 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.616 0.267 25324 14341 1 20 . 1 1 129 129 LYS C C 129 173.863 173.863 174.212 -0.349 25324 14342 1 20 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.469 1.266 25324 14343 1 20 . 1 1 129 129 LYS CB C 129 34.721 34.721 34.893 -0.172 25324 14344 1 20 . 1 1 129 129 LYS H H 129 8.201 8.201 8.237 -0.036 25324 14345 1 20 . 1 1 130 130 GLY N N 130 114.030 114.030 113.292 0.738 25324 14346 1 20 . 1 1 130 130 GLY C C 130 171.951 171.951 172.843 -0.892 25324 14347 1 20 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.570 0.217 25324 14348 1 20 . 1 1 130 130 GLY H H 130 9.325 9.325 8.611 0.714 25324 14349 1 20 . 1 1 131 131 THR N N 131 120.583 120.583 120.922 -0.339 25324 14350 1 20 . 1 1 131 131 THR HA H 131 4.939 4.939 4.852 0.087 25324 14351 1 20 . 1 1 131 131 THR C C 131 173.118 173.118 173.970 -0.852 25324 14352 1 20 . 1 1 131 131 THR CA C 131 61.266 61.266 61.388 -0.122 25324 14353 1 20 . 1 1 131 131 THR CB C 131 70.392 70.392 72.266 -1.874 25324 14354 1 20 . 1 1 131 131 THR H H 131 8.916 8.916 8.839 0.077 25324 14355 1 20 . 1 1 132 132 LEU N N 132 130.774 130.774 129.165 1.609 25324 14356 1 20 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.744 -0.244 25324 14357 1 20 . 1 1 132 132 LEU C C 132 176.574 176.574 176.987 -0.413 25324 14358 1 20 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.844 0.343 25324 14359 1 20 . 1 1 132 132 LEU CB C 132 42.447 42.447 41.959 0.488 25324 14360 1 20 . 1 1 132 132 LEU H H 132 8.527 8.527 8.894 -0.367 25324 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 126 3.408 0.965 3.281 25324 2 1 1 "Average Difference" HA 154 0.371 -0.003 0.372 25324 3 1 1 "Average Difference" C 124 0.833 -0.002 0.836 25324 4 1 1 "Average Difference" CA 130 1.036 0.102 1.035 25324 5 1 1 "Average Difference" CB 106 1.459 0.024 1.466 25324 6 1 1 "Average Difference" HN 126 0.821 -0.023 0.824 25324 7 1 2 "Average Difference" N 126 3.411 0.867 3.312 25324 8 1 2 "Average Difference" HA 154 0.389 -0.015 0.390 25324 9 1 2 "Average Difference" C 124 0.933 0.001 0.937 25324 10 1 2 "Average Difference" CA 130 0.997 0.123 0.993 25324 11 1 2 "Average Difference" CB 106 1.327 0.074 1.332 25324 12 1 2 "Average Difference" HN 126 0.805 -0.043 0.807 25324 13 1 3 "Average Difference" N 126 3.551 0.984 3.426 25324 14 1 3 "Average Difference" HA 154 0.385 -0.018 0.386 25324 15 1 3 "Average Difference" C 124 0.949 0.034 0.952 25324 16 1 3 "Average Difference" CA 130 1.139 0.209 1.124 25324 17 1 3 "Average Difference" CB 106 1.396 -0.045 1.402 25324 18 1 3 "Average Difference" HN 126 0.792 -0.016 0.795 25324 19 1 4 "Average Difference" N 126 3.637 0.997 3.512 25324 20 1 4 "Average Difference" HA 154 0.370 -0.011 0.371 25324 21 1 4 "Average Difference" C 124 0.951 0.003 0.955 25324 22 1 4 "Average Difference" CA 130 1.080 0.142 1.075 25324 23 1 4 "Average Difference" CB 106 1.484 0.037 1.490 25324 24 1 4 "Average Difference" HN 126 0.833 -0.030 0.836 25324 25 1 5 "Average Difference" N 126 3.278 0.770 3.199 25324 26 1 5 "Average Difference" HA 154 0.380 0.023 0.381 25324 27 1 5 "Average Difference" C 124 0.950 -0.005 0.954 25324 28 1 5 "Average Difference" CA 130 1.041 0.105 1.039 25324 29 1 5 "Average Difference" CB 106 1.428 0.190 1.422 25324 30 1 5 "Average Difference" HN 126 0.857 -0.025 0.861 25324 31 1 6 "Average Difference" N 126 3.215 0.663 3.158 25324 32 1 6 "Average Difference" HA 154 0.378 0.009 0.379 25324 33 1 6 "Average Difference" C 124 0.893 0.012 0.897 25324 34 1 6 "Average Difference" CA 130 1.008 0.100 1.007 25324 35 1 6 "Average Difference" CB 106 1.273 -0.007 1.279 25324 36 1 6 "Average Difference" HN 126 0.829 -0.046 0.831 25324 37 1 7 "Average Difference" N 126 3.455 1.016 3.315 25324 38 1 7 "Average Difference" HA 154 0.375 -0.008 0.376 25324 39 1 7 "Average Difference" C 124 0.927 -0.020 0.930 25324 40 1 7 "Average Difference" CA 130 1.019 0.093 1.019 25324 41 1 7 "Average Difference" CB 106 1.349 -0.044 1.355 25324 42 1 7 "Average Difference" HN 126 0.735 -0.025 0.738 25324 43 1 8 "Average Difference" N 126 3.639 0.936 3.530 25324 44 1 8 "Average Difference" HA 154 0.368 -0.012 0.369 25324 45 1 8 "Average Difference" C 124 0.932 0.010 0.935 25324 46 1 8 "Average Difference" CA 130 1.080 0.168 1.071 25324 47 1 8 "Average Difference" CB 106 1.453 -0.013 1.459 25324 48 1 8 "Average Difference" HN 126 0.775 -0.011 0.778 25324 49 1 9 "Average Difference" N 126 3.444 0.874 3.345 25324 50 1 9 "Average Difference" HA 154 0.400 0.014 0.401 25324 51 1 9 "Average Difference" C 124 0.887 0.002 0.890 25324 52 1 9 "Average Difference" CA 130 1.103 0.129 1.100 25324 53 1 9 "Average Difference" CB 106 1.493 0.093 1.497 25324 54 1 9 "Average Difference" HN 126 0.812 -0.034 0.814 25324 55 1 10 "Average Difference" N 126 3.475 0.762 3.404 25324 56 1 10 "Average Difference" HA 154 0.394 0.009 0.395 25324 57 1 10 "Average Difference" C 124 0.928 -0.010 0.932 25324 58 1 10 "Average Difference" CA 130 1.076 0.135 1.071 25324 59 1 10 "Average Difference" CB 106 1.393 0.119 1.395 25324 60 1 10 "Average Difference" HN 126 0.810 -0.008 0.813 25324 61 1 11 "Average Difference" N 126 3.230 0.821 3.137 25324 62 1 11 "Average Difference" HA 154 0.374 0.000 0.375 25324 63 1 11 "Average Difference" C 124 0.924 0.032 0.928 25324 64 1 11 "Average Difference" CA 130 1.055 0.207 1.038 25324 65 1 11 "Average Difference" CB 106 1.484 0.030 1.490 25324 66 1 11 "Average Difference" HN 126 0.856 -0.010 0.860 25324 67 1 12 "Average Difference" N 126 3.428 0.964 3.303 25324 68 1 12 "Average Difference" HA 154 0.383 -0.013 0.384 25324 69 1 12 "Average Difference" C 124 0.882 -0.026 0.885 25324 70 1 12 "Average Difference" CA 130 0.990 0.125 0.986 25324 71 1 12 "Average Difference" CB 106 1.410 -0.027 1.417 25324 72 1 12 "Average Difference" HN 126 0.760 -0.032 0.762 25324 73 1 13 "Average Difference" N 126 3.673 0.729 3.614 25324 74 1 13 "Average Difference" HA 154 0.385 -0.008 0.386 25324 75 1 13 "Average Difference" C 124 1.001 0.020 1.005 25324 76 1 13 "Average Difference" CA 130 1.203 0.167 1.195 25324 77 1 13 "Average Difference" CB 106 1.373 0.093 1.377 25324 78 1 13 "Average Difference" HN 126 0.843 -0.023 0.846 25324 79 1 14 "Average Difference" N 126 3.450 0.661 3.399 25324 80 1 14 "Average Difference" HA 154 0.411 -0.006 0.412 25324 81 1 14 "Average Difference" C 124 0.992 -0.015 0.996 25324 82 1 14 "Average Difference" CA 130 1.176 0.184 1.166 25324 83 1 14 "Average Difference" CB 106 1.317 0.049 1.322 25324 84 1 14 "Average Difference" HN 126 0.781 -0.003 0.784 25324 85 1 15 "Average Difference" N 126 3.386 0.792 3.305 25324 86 1 15 "Average Difference" HA 154 0.400 -0.006 0.401 25324 87 1 15 "Average Difference" C 124 0.964 0.064 0.966 25324 88 1 15 "Average Difference" CA 130 1.227 0.173 1.219 25324 89 1 15 "Average Difference" CB 106 1.307 0.039 1.313 25324 90 1 15 "Average Difference" HN 126 0.875 -0.010 0.878 25324 91 1 16 "Average Difference" N 126 3.518 0.634 3.474 25324 92 1 16 "Average Difference" HA 154 0.418 0.003 0.419 25324 93 1 16 "Average Difference" C 124 0.918 -0.084 0.918 25324 94 1 16 "Average Difference" CA 130 1.072 0.052 1.075 25324 95 1 16 "Average Difference" CB 106 1.301 0.181 1.295 25324 96 1 16 "Average Difference" HN 126 0.774 -0.038 0.776 25324 97 1 17 "Average Difference" N 126 3.808 0.661 3.765 25324 98 1 17 "Average Difference" HA 154 0.421 -0.033 0.421 25324 99 1 17 "Average Difference" C 124 0.970 -0.050 0.972 25324 100 1 17 "Average Difference" CA 130 1.219 0.234 1.201 25324 101 1 17 "Average Difference" CB 106 1.316 0.068 1.320 25324 102 1 17 "Average Difference" HN 126 0.860 -0.051 0.862 25324 103 1 18 "Average Difference" N 126 3.564 0.883 3.466 25324 104 1 18 "Average Difference" HA 154 0.399 -0.033 0.399 25324 105 1 18 "Average Difference" C 124 0.895 -0.011 0.898 25324 106 1 18 "Average Difference" CA 130 1.174 0.142 1.170 25324 107 1 18 "Average Difference" CB 106 1.293 0.028 1.299 25324 108 1 18 "Average Difference" HN 126 0.793 -0.027 0.796 25324 109 1 19 "Average Difference" N 126 3.282 0.665 3.227 25324 110 1 19 "Average Difference" HA 154 0.366 0.006 0.367 25324 111 1 19 "Average Difference" C 124 0.905 0.022 0.909 25324 112 1 19 "Average Difference" CA 130 1.020 0.123 1.017 25324 113 1 19 "Average Difference" CB 106 1.235 0.074 1.238 25324 114 1 19 "Average Difference" HN 126 0.797 -0.028 0.800 25324 115 1 20 "Average Difference" N 126 3.570 0.913 3.466 25324 116 1 20 "Average Difference" HA 154 0.388 -0.008 0.389 25324 117 1 20 "Average Difference" C 124 0.945 0.013 0.949 25324 118 1 20 "Average Difference" CA 130 1.086 0.163 1.078 25324 119 1 20 "Average Difference" CB 106 1.380 0.125 1.381 25324 120 1 20 "Average Difference" HN 126 0.782 -0.036 0.784 25324 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 25324 _Entity_delta_chem_shifts.ID 2 _Entity_delta_chem_shifts.Details ; This saveframe contains the averaged SPARTA chemical shift over all the models used. ; loop_ _Delta_CS.Atom_chem_shift_ID _Delta_CS.Entity_delta_chem_shifts_ID _Delta_CS.Assembly_atom_ID _Delta_CS.Entity_assembly_ID _Delta_CS.Entity_ID _Delta_CS.Comp_index_ID _Delta_CS.Seq_ID _Delta_CS.Comp_ID _Delta_CS.Atom_ID _Delta_CS.Atom_type _Delta_CS.Auth_seq_ID _Delta_CS.Original_CS_value _Delta_CS.Corrected_CS_value _Delta_CS.Sparta_CS_value _Delta_CS.Delta_CS_value _Delta_CS.Entry_ID 1 1 . 1 1 3 3 LEU N N 3 123.202 123.202 122.384 0.818 25324 2 1 . 1 1 3 3 LEU HA H 3 5.157 5.157 4.955 0.202 25324 3 1 . 1 1 3 3 LEU C C 3 175.786 175.786 174.997 0.789 25324 4 1 . 1 1 3 3 LEU CA C 3 54.284 54.284 54.208 0.076 25324 5 1 . 1 1 3 3 LEU CB C 3 43.330 43.330 43.466 -0.136 25324 6 1 . 1 1 3 3 LEU H H 3 8.711 8.711 8.403 0.308 25324 7 1 . 1 1 4 4 TYR N N 4 120.906 120.906 124.662 -3.756 25324 8 1 . 1 1 4 4 TYR HA H 4 5.024 5.024 5.066 -0.042 25324 9 1 . 1 1 4 4 TYR C C 4 175.953 175.953 174.970 0.983 25324 10 1 . 1 1 4 4 TYR CA C 4 56.377 56.377 56.547 -0.170 25324 11 1 . 1 1 4 4 TYR CB C 4 41.655 41.655 42.257 -0.602 25324 12 1 . 1 1 4 4 TYR H H 4 9.142 9.142 9.450 -0.308 25324 13 1 . 1 1 5 5 ASN N N 5 120.496 120.496 120.167 0.329 25324 14 1 . 1 1 5 5 ASN HA H 5 5.116 5.116 4.927 0.189 25324 15 1 . 1 1 5 5 ASN C C 5 174.953 174.953 173.781 1.172 25324 16 1 . 1 1 5 5 ASN CA C 5 52.947 52.947 53.035 -0.088 25324 17 1 . 1 1 5 5 ASN CB C 5 38.891 38.891 40.450 -1.559 25324 18 1 . 1 1 5 5 ASN H H 5 8.787 8.787 9.028 -0.241 25324 19 1 . 1 1 6 6 VAL N N 6 127.428 127.428 124.289 3.139 25324 20 1 . 1 1 6 6 VAL HA H 6 4.362 4.362 4.319 0.043 25324 21 1 . 1 1 6 6 VAL C C 6 174.955 174.955 174.568 0.387 25324 22 1 . 1 1 6 6 VAL CA C 6 61.433 61.433 61.078 0.355 25324 23 1 . 1 1 6 6 VAL CB C 6 33.331 33.331 33.077 0.254 25324 24 1 . 1 1 6 6 VAL H H 6 8.806 8.806 8.446 0.360 25324 25 1 . 1 1 7 7 GLU N N 7 124.355 124.355 126.898 -2.543 25324 26 1 . 1 1 7 7 GLU HA H 7 4.982 4.982 4.944 0.038 25324 27 1 . 1 1 7 7 GLU C C 7 174.551 174.551 174.912 -0.361 25324 28 1 . 1 1 7 7 GLU CA C 7 53.789 53.789 54.744 -0.955 25324 29 1 . 1 1 7 7 GLU CB C 7 34.567 34.567 32.927 1.639 25324 30 1 . 1 1 7 7 GLU H H 7 8.800 8.800 8.882 -0.082 25324 31 1 . 1 1 8 8 ASN N N 8 116.231 116.231 121.592 -5.361 25324 32 1 . 1 1 8 8 ASN HA H 8 6.041 6.041 5.807 0.234 25324 33 1 . 1 1 8 8 ASN C C 8 172.709 172.709 173.622 -0.913 25324 34 1 . 1 1 8 8 ASN CA C 8 51.617 51.617 52.455 -0.838 25324 35 1 . 1 1 8 8 ASN CB C 8 45.585 45.585 43.002 2.583 25324 36 1 . 1 1 8 8 ASN H H 8 9.320 9.320 9.256 0.064 25324 37 1 . 1 1 9 9 GLN N N 9 120.762 120.762 122.773 -2.010 25324 38 1 . 1 1 9 9 GLN HA H 9 4.174 4.174 4.417 -0.243 25324 39 1 . 1 1 9 9 GLN C C 9 173.454 173.454 173.931 -0.477 25324 40 1 . 1 1 9 9 GLN CA C 9 53.960 53.960 54.126 -0.166 25324 41 1 . 1 1 9 9 GLN CB C 9 30.691 30.691 31.159 -0.468 25324 42 1 . 1 1 9 9 GLN H H 9 6.887 6.887 8.560 -1.673 25324 43 1 . 1 1 10 10 TRP N N 10 127.775 127.775 124.684 3.091 25324 44 1 . 1 1 10 10 TRP HA H 10 4.988 4.988 5.047 -0.059 25324 45 1 . 1 1 10 10 TRP C C 10 175.281 175.281 175.870 -0.589 25324 46 1 . 1 1 10 10 TRP CA C 10 56.293 56.293 56.627 -0.334 25324 47 1 . 1 1 10 10 TRP CB C 10 29.742 29.742 30.731 -0.989 25324 48 1 . 1 1 10 10 TRP H H 10 8.518 8.518 8.006 0.512 25324 49 1 . 1 1 11 11 GLY N N 11 107.838 107.838 109.770 -1.932 25324 50 1 . 1 1 11 11 GLY C C 11 174.733 174.733 174.518 0.214 25324 51 1 . 1 1 11 11 GLY CA C 11 44.836 44.836 44.771 0.065 25324 52 1 . 1 1 11 11 GLY H H 11 8.461 8.461 8.530 -0.069 25324 53 1 . 1 1 12 12 GLY N N 12 109.696 109.696 107.966 1.730 25324 54 1 . 1 1 12 12 GLY C C 12 174.133 174.133 174.432 -0.299 25324 55 1 . 1 1 12 12 GLY CA C 12 43.789 43.789 44.559 -0.770 25324 56 1 . 1 1 12 12 GLY H H 12 8.138 8.138 7.638 0.500 25324 57 1 . 1 1 13 13 SER N N 13 111.308 111.308 115.242 -3.934 25324 58 1 . 1 1 13 13 SER HA H 13 4.092 4.092 4.277 -0.185 25324 59 1 . 1 1 13 13 SER C C 13 175.622 175.622 175.116 0.506 25324 60 1 . 1 1 13 13 SER CA C 13 60.494 60.494 59.693 0.801 25324 61 1 . 1 1 13 13 SER CB C 13 63.028 63.028 63.518 -0.490 25324 62 1 . 1 1 13 13 SER H H 13 8.215 8.215 8.402 -0.187 25324 63 1 . 1 1 14 14 SER N N 14 115.290 115.290 115.085 0.205 25324 64 1 . 1 1 14 14 SER HA H 14 4.566 4.566 4.320 0.246 25324 65 1 . 1 1 14 14 SER C C 14 173.532 173.532 173.806 -0.274 25324 66 1 . 1 1 14 14 SER CA C 14 57.317 57.317 58.760 -1.443 25324 67 1 . 1 1 14 14 SER CB C 14 63.230 63.230 63.069 0.161 25324 68 1 . 1 1 14 14 SER H H 14 8.213 8.213 8.113 0.100 25324 69 1 . 1 1 15 15 ALA N N 15 126.470 126.470 125.104 1.366 25324 70 1 . 1 1 15 15 ALA HA H 15 4.403 4.403 4.480 -0.077 25324 71 1 . 1 1 15 15 ALA CA C 15 50.464 50.464 49.853 0.611 25324 72 1 . 1 1 15 15 ALA CB C 15 18.229 18.229 18.676 -0.447 25324 73 1 . 1 1 15 15 ALA H H 15 7.308 7.308 7.412 -0.104 25324 74 1 . 1 1 16 16 PRO HA H 16 4.409 4.409 4.305 0.104 25324 75 1 . 1 1 16 16 PRO C C 16 175.627 175.627 175.488 0.139 25324 76 1 . 1 1 16 16 PRO CA C 16 62.392 62.392 62.219 0.173 25324 77 1 . 1 1 16 16 PRO CB C 16 32.137 32.137 32.626 -0.489 25324 78 1 . 1 1 17 17 TRP N N 17 120.228 120.228 119.398 0.830 25324 79 1 . 1 1 17 17 TRP HA H 17 4.318 4.318 4.571 -0.253 25324 80 1 . 1 1 17 17 TRP C C 17 175.951 175.951 176.130 -0.179 25324 81 1 . 1 1 17 17 TRP CA C 17 56.915 56.915 56.929 -0.014 25324 82 1 . 1 1 17 17 TRP CB C 17 29.409 29.409 30.408 -0.999 25324 83 1 . 1 1 17 17 TRP H H 17 8.380 8.380 8.169 0.211 25324 84 1 . 1 1 18 18 ASN N N 18 120.663 120.663 122.352 -1.689 25324 85 1 . 1 1 18 18 ASN HA H 18 5.086 5.086 5.052 0.034 25324 86 1 . 1 1 18 18 ASN C C 18 174.793 174.793 174.288 0.505 25324 87 1 . 1 1 18 18 ASN CA C 18 51.601 51.601 52.291 -0.690 25324 88 1 . 1 1 18 18 ASN CB C 18 42.648 42.648 41.111 1.537 25324 89 1 . 1 1 18 18 ASN H H 18 9.094 9.094 8.861 0.233 25324 90 1 . 1 1 19 19 GLU N N 19 122.202 122.202 123.847 -1.645 25324 91 1 . 1 1 19 19 GLU HA H 19 4.139 4.139 4.717 -0.578 25324 92 1 . 1 1 19 19 GLU C C 19 176.869 176.869 176.653 0.216 25324 93 1 . 1 1 19 19 GLU CA C 19 58.600 58.600 56.454 2.145 25324 94 1 . 1 1 19 19 GLU CB C 19 29.382 29.382 29.983 -0.601 25324 95 1 . 1 1 19 19 GLU H H 19 9.013 9.013 8.909 0.104 25324 96 1 . 1 1 20 20 GLY N N 20 112.893 112.893 112.671 0.222 25324 97 1 . 1 1 20 20 GLY C C 20 174.878 174.878 173.273 1.605 25324 98 1 . 1 1 20 20 GLY CA C 20 44.995 44.995 44.878 0.117 25324 99 1 . 1 1 20 20 GLY H H 20 8.926 8.926 8.643 0.283 25324 100 1 . 1 1 21 21 GLY N N 21 110.354 110.354 107.618 2.736 25324 101 1 . 1 1 21 21 GLY C C 21 171.623 171.623 171.852 -0.229 25324 102 1 . 1 1 21 21 GLY CA C 21 44.398 44.398 45.258 -0.860 25324 103 1 . 1 1 21 21 GLY H H 21 8.258 8.258 7.674 0.584 25324 104 1 . 1 1 22 22 GLN N N 22 117.541 117.541 118.072 -0.531 25324 105 1 . 1 1 22 22 GLN HA H 22 5.677 5.677 4.984 0.693 25324 106 1 . 1 1 22 22 GLN C C 22 175.957 175.957 174.404 1.553 25324 107 1 . 1 1 22 22 GLN CA C 22 54.944 54.944 54.756 0.188 25324 108 1 . 1 1 22 22 GLN CB C 22 31.085 31.085 32.364 -1.279 25324 109 1 . 1 1 22 22 GLN H H 22 8.564 8.564 8.514 0.050 25324 110 1 . 1 1 23 23 TRP N N 23 127.208 127.208 122.176 5.032 25324 111 1 . 1 1 23 23 TRP HA H 23 5.199 5.199 5.094 0.105 25324 112 1 . 1 1 23 23 TRP CA C 23 54.531 54.531 54.376 0.155 25324 113 1 . 1 1 23 23 TRP CB C 23 31.683 31.683 32.681 -0.998 25324 114 1 . 1 1 23 23 TRP H H 23 9.347 9.347 9.030 0.317 25324 115 1 . 1 1 24 24 GLU N N 24 123.504 123.504 121.212 2.292 25324 116 1 . 1 1 24 24 GLU HA H 24 5.508 5.508 5.277 0.231 25324 117 1 . 1 1 24 24 GLU C C 24 174.222 174.222 175.316 -1.094 25324 118 1 . 1 1 24 24 GLU CA C 24 55.591 55.591 55.248 0.343 25324 119 1 . 1 1 24 24 GLU CB C 24 30.615 30.615 32.354 -1.739 25324 120 1 . 1 1 24 24 GLU H H 24 9.296 9.296 8.610 0.686 25324 121 1 . 1 1 25 25 ILE N N 25 123.447 123.447 126.250 -2.803 25324 122 1 . 1 1 25 25 ILE HA H 25 3.436 3.436 3.479 -0.043 25324 123 1 . 1 1 25 25 ILE C C 25 175.790 175.790 174.586 1.204 25324 124 1 . 1 1 25 25 ILE CA C 25 59.627 59.627 60.011 -0.384 25324 125 1 . 1 1 25 25 ILE CB C 25 40.952 40.952 40.553 0.399 25324 126 1 . 1 1 25 25 ILE H H 25 8.635 8.635 8.504 0.131 25324 127 1 . 1 1 26 26 GLY N N 26 111.544 111.544 112.861 -1.317 25324 128 1 . 1 1 26 26 GLY C C 26 172.122 172.122 174.724 -2.602 25324 129 1 . 1 1 26 26 GLY CA C 26 44.078 44.078 44.700 -0.622 25324 130 1 . 1 1 26 26 GLY H H 26 3.381 3.381 7.067 -3.686 25324 131 1 . 1 1 27 27 SER N N 27 112.279 112.279 116.312 -4.033 25324 132 1 . 1 1 27 27 SER HA H 27 4.876 4.876 4.405 0.471 25324 133 1 . 1 1 27 27 SER C C 27 174.113 174.113 175.014 -0.901 25324 134 1 . 1 1 27 27 SER CA C 27 56.954 56.954 59.623 -2.669 25324 135 1 . 1 1 27 27 SER CB C 27 64.554 64.554 63.880 0.674 25324 136 1 . 1 1 27 27 SER H H 27 8.212 8.212 8.663 -0.451 25324 137 1 . 1 1 28 28 ARG N N 28 120.872 120.872 121.781 -0.909 25324 138 1 . 1 1 28 28 ARG HA H 28 4.763 4.763 4.534 0.229 25324 139 1 . 1 1 28 28 ARG C C 28 176.119 176.119 176.127 -0.008 25324 140 1 . 1 1 28 28 ARG CA C 28 55.117 55.117 56.284 -1.167 25324 141 1 . 1 1 28 28 ARG CB C 28 31.830 31.830 31.449 0.381 25324 142 1 . 1 1 28 28 ARG H H 28 7.849 7.849 8.293 -0.444 25324 143 1 . 1 1 29 29 SER N N 29 118.985 118.985 117.329 1.656 25324 144 1 . 1 1 29 29 SER HA H 29 4.192 4.192 4.398 -0.206 25324 145 1 . 1 1 29 29 SER C C 29 174.622 174.622 174.601 0.021 25324 146 1 . 1 1 29 29 SER CA C 29 60.072 60.072 59.612 0.460 25324 147 1 . 1 1 29 29 SER CB C 29 62.876 62.876 63.280 -0.404 25324 148 1 . 1 1 29 29 SER H H 29 8.892 8.892 8.750 0.143 25324 149 1 . 1 1 30 30 ASP N N 30 117.632 117.632 120.229 -2.597 25324 150 1 . 1 1 30 30 ASP HA H 30 4.618 4.618 4.580 0.038 25324 151 1 . 1 1 30 30 ASP C C 30 175.101 175.101 175.821 -0.720 25324 152 1 . 1 1 30 30 ASP CA C 30 53.052 53.052 55.244 -2.193 25324 153 1 . 1 1 30 30 ASP CB C 30 40.523 40.523 41.017 -0.494 25324 154 1 . 1 1 30 30 ASP H H 30 8.441 8.441 8.219 0.222 25324 155 1 . 1 1 31 31 GLN N N 31 118.273 118.273 118.359 -0.086 25324 156 1 . 1 1 31 31 GLN HA H 31 4.485 4.485 4.505 -0.020 25324 157 1 . 1 1 31 31 GLN C C 31 173.453 173.453 174.179 -0.726 25324 158 1 . 1 1 31 31 GLN CA C 31 54.868 54.868 54.903 -0.035 25324 159 1 . 1 1 31 31 GLN CB C 31 33.249 33.249 30.604 2.645 25324 160 1 . 1 1 31 31 GLN H H 31 7.029 7.029 7.772 -0.743 25324 161 1 . 1 1 32 32 ASN N N 32 120.865 120.865 120.789 0.076 25324 162 1 . 1 1 32 32 ASN HA H 32 5.120 5.120 4.979 0.141 25324 163 1 . 1 1 32 32 ASN C C 32 175.198 175.198 174.643 0.555 25324 164 1 . 1 1 32 32 ASN CA C 32 51.869 51.869 52.547 -0.678 25324 165 1 . 1 1 32 32 ASN CB C 32 39.630 39.630 40.306 -0.676 25324 166 1 . 1 1 32 32 ASN H H 32 8.713 8.713 8.639 0.074 25324 167 1 . 1 1 33 33 VAL N N 33 122.111 122.111 120.579 1.532 25324 168 1 . 1 1 33 33 VAL HA H 33 3.705 3.705 4.209 -0.504 25324 169 1 . 1 1 33 33 VAL C C 33 174.950 174.950 175.979 -1.029 25324 170 1 . 1 1 33 33 VAL CA C 33 63.847 63.847 62.428 1.419 25324 171 1 . 1 1 33 33 VAL CB C 33 32.350 32.350 32.095 0.255 25324 172 1 . 1 1 33 33 VAL H H 33 8.542 8.542 8.691 -0.149 25324 173 1 . 1 1 34 34 VAL N N 34 113.282 113.282 119.365 -6.083 25324 174 1 . 1 1 34 34 VAL HA H 34 4.645 4.645 4.542 0.103 25324 175 1 . 1 1 34 34 VAL C C 34 175.574 175.574 174.758 0.816 25324 176 1 . 1 1 34 34 VAL CA C 34 59.974 59.974 61.337 -1.363 25324 177 1 . 1 1 34 34 VAL CB C 34 33.029 33.029 33.252 -0.223 25324 178 1 . 1 1 34 34 VAL H H 34 8.744 8.744 8.745 -0.001 25324 179 1 . 1 1 35 35 ALA N N 35 122.102 122.102 121.381 0.721 25324 180 1 . 1 1 35 35 ALA HA H 35 4.803 4.803 5.163 -0.360 25324 181 1 . 1 1 35 35 ALA C C 35 175.947 175.947 174.973 0.974 25324 182 1 . 1 1 35 35 ALA CA C 35 53.250 53.250 50.995 2.255 25324 183 1 . 1 1 35 35 ALA CB C 35 21.628 21.628 22.385 -0.757 25324 184 1 . 1 1 35 35 ALA H H 35 7.677 7.677 7.799 -0.122 25324 185 1 . 1 1 36 36 ILE N N 36 118.005 118.005 121.504 -3.499 25324 186 1 . 1 1 36 36 ILE HA H 36 4.028 4.028 4.329 -0.301 25324 187 1 . 1 1 36 36 ILE C C 36 173.116 173.116 173.825 -0.709 25324 188 1 . 1 1 36 36 ILE CA C 36 62.182 62.182 61.105 1.077 25324 189 1 . 1 1 36 36 ILE CB C 36 42.485 42.485 41.639 0.846 25324 190 1 . 1 1 36 36 ILE H H 36 8.126 8.126 8.812 -0.686 25324 191 1 . 1 1 37 37 ASN N N 37 125.632 125.632 126.317 -0.685 25324 192 1 . 1 1 37 37 ASN HA H 37 5.681 5.681 5.843 -0.162 25324 193 1 . 1 1 37 37 ASN C C 37 174.854 174.854 173.712 1.142 25324 194 1 . 1 1 37 37 ASN CA C 37 52.530 52.530 52.257 0.273 25324 195 1 . 1 1 37 37 ASN CB C 37 38.853 38.853 41.347 -2.494 25324 196 1 . 1 1 37 37 ASN H H 37 8.577 8.577 8.897 -0.320 25324 197 1 . 1 1 38 38 VAL N N 38 114.223 114.223 118.490 -4.267 25324 198 1 . 1 1 38 38 VAL HA H 38 5.203 5.203 4.924 0.279 25324 199 1 . 1 1 38 38 VAL C C 38 174.854 174.854 173.356 1.498 25324 200 1 . 1 1 38 38 VAL CA C 38 57.980 57.980 59.911 -1.931 25324 201 1 . 1 1 38 38 VAL CB C 38 36.044 36.044 35.615 0.429 25324 202 1 . 1 1 38 38 VAL H H 38 8.874 8.874 8.703 0.171 25324 203 1 . 1 1 39 39 GLU N N 39 118.277 118.277 121.895 -3.618 25324 204 1 . 1 1 39 39 GLU HA H 39 5.082 5.082 5.246 -0.164 25324 205 1 . 1 1 39 39 GLU C C 39 174.548 174.548 175.301 -0.753 25324 206 1 . 1 1 39 39 GLU CA C 39 54.993 54.993 54.057 0.935 25324 207 1 . 1 1 39 39 GLU CB C 39 33.578 33.578 34.415 -0.837 25324 208 1 . 1 1 39 39 GLU H H 39 8.761 8.761 9.199 -0.438 25324 209 1 . 1 1 40 40 SER N N 40 114.960 114.960 119.792 -4.832 25324 210 1 . 1 1 40 40 SER HA H 40 5.265 5.265 5.023 0.242 25324 211 1 . 1 1 40 40 SER C C 40 175.783 175.783 175.252 0.531 25324 212 1 . 1 1 40 40 SER CA C 40 55.880 55.880 57.712 -1.832 25324 213 1 . 1 1 40 40 SER CB C 40 65.911 65.911 63.805 2.105 25324 214 1 . 1 1 40 40 SER H H 40 8.500 8.500 8.547 -0.047 25324 215 1 . 1 1 41 41 GLY N N 41 117.567 117.567 111.040 6.527 25324 216 1 . 1 1 41 41 GLY C C 41 174.119 174.119 174.346 -0.227 25324 217 1 . 1 1 41 41 GLY CA C 41 44.688 44.688 45.343 -0.655 25324 218 1 . 1 1 41 41 GLY H H 41 9.533 9.533 8.701 0.832 25324 219 1 . 1 1 42 42 ASP N N 42 122.141 122.141 120.919 1.222 25324 220 1 . 1 1 42 42 ASP HA H 42 4.800 4.800 4.861 -0.061 25324 221 1 . 1 1 42 42 ASP C C 42 176.121 176.121 175.989 0.132 25324 222 1 . 1 1 42 42 ASP CA C 42 52.146 52.146 53.418 -1.272 25324 223 1 . 1 1 42 42 ASP CB C 42 39.354 39.354 42.225 -2.871 25324 224 1 . 1 1 42 42 ASP H H 42 8.644 8.644 7.848 0.796 25324 225 1 . 1 1 43 43 ASP N N 43 116.025 116.025 121.416 -5.391 25324 226 1 . 1 1 43 43 ASP HA H 43 4.229 4.229 4.474 -0.245 25324 227 1 . 1 1 43 43 ASP C C 43 176.018 176.018 176.432 -0.414 25324 228 1 . 1 1 43 43 ASP CA C 43 55.249 55.249 54.725 0.523 25324 229 1 . 1 1 43 43 ASP CB C 43 38.559 38.559 39.105 -0.546 25324 230 1 . 1 1 43 43 ASP H H 43 9.111 9.111 8.732 0.379 25324 231 1 . 1 1 44 44 GLY N N 44 104.263 104.263 106.500 -2.237 25324 232 1 . 1 1 44 44 GLY C C 44 173.922 173.922 175.176 -1.254 25324 233 1 . 1 1 44 44 GLY CA C 44 45.301 45.301 45.596 -0.295 25324 234 1 . 1 1 44 44 GLY H H 44 9.063 9.063 8.183 0.880 25324 235 1 . 1 1 45 45 GLN N N 45 121.691 121.691 118.961 2.730 25324 236 1 . 1 1 45 45 GLN HA H 45 4.086 4.086 4.216 -0.130 25324 237 1 . 1 1 45 45 GLN C C 45 176.284 176.284 175.518 0.766 25324 238 1 . 1 1 45 45 GLN CA C 45 58.118 58.118 58.002 0.116 25324 239 1 . 1 1 45 45 GLN CB C 45 27.674 27.674 29.244 -1.570 25324 240 1 . 1 1 45 45 GLN H H 45 7.356 7.356 8.373 -1.017 25324 241 1 . 1 1 46 46 THR N N 46 111.843 111.843 111.070 0.773 25324 242 1 . 1 1 46 46 THR HA H 46 5.355 5.355 5.373 -0.018 25324 243 1 . 1 1 46 46 THR C C 46 174.451 174.451 173.103 1.348 25324 244 1 . 1 1 46 46 THR CA C 46 59.644 59.644 60.112 -0.468 25324 245 1 . 1 1 46 46 THR CB C 46 72.714 72.714 70.689 2.025 25324 246 1 . 1 1 46 46 THR H H 46 10.123 10.123 7.569 2.554 25324 247 1 . 1 1 47 47 LEU N N 47 119.302 119.302 126.595 -7.293 25324 248 1 . 1 1 47 47 LEU HA H 47 4.807 4.807 4.754 0.053 25324 249 1 . 1 1 47 47 LEU C C 47 175.487 175.487 174.976 0.511 25324 250 1 . 1 1 47 47 LEU CA C 47 53.070 53.070 53.856 -0.786 25324 251 1 . 1 1 47 47 LEU CB C 47 48.003 48.003 44.161 3.842 25324 252 1 . 1 1 47 47 LEU H H 47 8.364 8.364 8.842 -0.478 25324 253 1 . 1 1 48 48 ASN N N 48 116.844 116.844 120.082 -3.238 25324 254 1 . 1 1 48 48 ASN HA H 48 5.729 5.729 5.936 -0.207 25324 255 1 . 1 1 48 48 ASN C C 48 174.460 174.460 174.854 -0.394 25324 256 1 . 1 1 48 48 ASN CA C 48 52.739 52.739 51.714 1.025 25324 257 1 . 1 1 48 48 ASN CB C 48 43.413 43.413 42.647 0.766 25324 258 1 . 1 1 48 48 ASN H H 48 8.748 8.748 8.899 -0.151 25324 259 1 . 1 1 49 49 GLY N N 49 109.417 109.417 108.840 0.577 25324 260 1 . 1 1 49 49 GLY C C 49 172.126 172.126 172.213 -0.087 25324 261 1 . 1 1 49 49 GLY CA C 49 46.491 46.491 46.217 0.274 25324 262 1 . 1 1 49 49 GLY H H 49 8.744 8.744 8.924 -0.180 25324 263 1 . 1 1 50 50 THR N N 50 119.162 119.162 116.043 3.119 25324 264 1 . 1 1 50 50 THR HA H 50 5.556 5.556 5.472 0.084 25324 265 1 . 1 1 50 50 THR C C 50 171.790 171.790 172.894 -1.104 25324 266 1 . 1 1 50 50 THR CA C 50 59.371 59.371 61.206 -1.835 25324 267 1 . 1 1 50 50 THR CB C 50 72.799 72.799 72.067 0.732 25324 268 1 . 1 1 50 50 THR H H 50 8.799 8.799 8.878 -0.079 25324 269 1 . 1 1 51 51 MET N N 51 115.232 115.232 124.755 -9.523 25324 270 1 . 1 1 51 51 MET HA H 51 4.886 4.886 4.952 -0.066 25324 271 1 . 1 1 51 51 MET C C 51 172.708 172.708 174.032 -1.324 25324 272 1 . 1 1 51 51 MET CA C 51 54.722 54.722 54.227 0.495 25324 273 1 . 1 1 51 51 MET CB C 51 34.557 34.557 37.139 -2.582 25324 274 1 . 1 1 51 51 MET H H 51 9.062 9.062 9.228 -0.166 25324 275 1 . 1 1 52 52 THR N N 52 113.697 113.697 120.898 -7.201 25324 276 1 . 1 1 52 52 THR HA H 52 4.682 4.682 4.831 -0.149 25324 277 1 . 1 1 52 52 THR C C 52 173.952 173.952 173.541 0.411 25324 278 1 . 1 1 52 52 THR CA C 52 61.395 61.395 61.333 0.062 25324 279 1 . 1 1 52 52 THR CB C 52 71.734 71.734 70.904 0.830 25324 280 1 . 1 1 52 52 THR H H 52 8.685 8.685 8.778 -0.093 25324 281 1 . 1 1 53 53 TYR N N 53 129.086 129.086 125.761 3.325 25324 282 1 . 1 1 53 53 TYR HA H 53 4.800 4.800 4.853 -0.053 25324 283 1 . 1 1 53 53 TYR C C 53 175.214 175.214 176.370 -1.156 25324 284 1 . 1 1 53 53 TYR CA C 53 58.881 58.881 57.986 0.895 25324 285 1 . 1 1 53 53 TYR CB C 53 40.512 40.512 39.907 0.605 25324 286 1 . 1 1 53 53 TYR H H 53 10.112 10.112 8.754 1.358 25324 287 1 . 1 1 54 54 ALA N N 54 119.947 119.947 123.743 -3.796 25324 288 1 . 1 1 54 54 ALA HA H 54 4.002 4.002 4.278 -0.276 25324 289 1 . 1 1 54 54 ALA C C 54 178.285 178.285 177.838 0.447 25324 290 1 . 1 1 54 54 ALA CA C 54 53.971 53.971 53.373 0.598 25324 291 1 . 1 1 54 54 ALA CB C 54 18.717 18.717 18.132 0.585 25324 292 1 . 1 1 54 54 ALA H H 54 8.704 8.704 8.559 0.145 25324 293 1 . 1 1 55 55 GLY N N 55 110.940 110.940 111.830 -0.890 25324 294 1 . 1 1 55 55 GLY C C 55 173.903 173.903 174.417 -0.514 25324 295 1 . 1 1 55 55 GLY CA C 55 45.016 45.016 45.393 -0.377 25324 296 1 . 1 1 55 55 GLY H H 55 8.745 8.745 8.553 0.192 25324 297 1 . 1 1 56 56 GLU N N 56 120.073 120.073 120.491 -0.418 25324 298 1 . 1 1 56 56 GLU HA H 56 4.709 4.709 4.678 0.030 25324 299 1 . 1 1 56 56 GLU C C 56 175.906 175.906 176.349 -0.443 25324 300 1 . 1 1 56 56 GLU CA C 56 54.423 54.423 55.104 -0.682 25324 301 1 . 1 1 56 56 GLU CB C 56 32.824 32.824 32.093 0.731 25324 302 1 . 1 1 56 56 GLU H H 56 8.039 8.039 7.865 0.174 25324 303 1 . 1 1 57 57 GLY N N 57 105.298 105.298 108.394 -3.096 25324 304 1 . 1 1 57 57 GLY CA C 57 43.802 43.802 43.662 0.140 25324 305 1 . 1 1 57 57 GLY H H 57 7.937 7.937 8.301 -0.364 25324 306 1 . 1 1 58 58 PRO HA H 58 4.934 4.934 4.741 0.193 25324 307 1 . 1 1 58 58 PRO C C 58 177.785 177.785 176.423 1.362 25324 308 1 . 1 1 58 58 PRO CA C 58 63.132 63.132 63.077 0.055 25324 309 1 . 1 1 58 58 PRO CB C 58 31.840 31.840 32.387 -0.547 25324 310 1 . 1 1 59 59 ILE N N 59 117.386 117.386 117.502 -0.116 25324 311 1 . 1 1 59 59 ILE HA H 59 4.988 4.988 4.710 0.278 25324 312 1 . 1 1 59 59 ILE C C 59 175.688 175.688 175.155 0.533 25324 313 1 . 1 1 59 59 ILE CA C 59 59.543 59.543 59.123 0.420 25324 314 1 . 1 1 59 59 ILE CB C 59 42.288 42.288 41.561 0.727 25324 315 1 . 1 1 59 59 ILE H H 59 9.600 9.600 8.864 0.736 25324 316 1 . 1 1 60 60 GLY N N 60 107.164 107.164 108.019 -0.855 25324 317 1 . 1 1 60 60 GLY C C 60 173.787 173.787 172.539 1.248 25324 318 1 . 1 1 60 60 GLY CA C 60 46.235 46.235 44.449 1.786 25324 319 1 . 1 1 60 60 GLY H H 60 8.957 8.957 8.578 0.379 25324 320 1 . 1 1 61 61 PHE N N 61 124.597 124.597 126.070 -1.473 25324 321 1 . 1 1 61 61 PHE HA H 61 5.223 5.223 5.477 -0.254 25324 322 1 . 1 1 61 61 PHE C C 61 173.126 173.126 173.349 -0.223 25324 323 1 . 1 1 61 61 PHE CA C 61 56.861 56.861 56.315 0.546 25324 324 1 . 1 1 61 61 PHE CB C 61 43.217 43.217 43.250 -0.033 25324 325 1 . 1 1 61 61 PHE H H 61 8.788 8.788 9.162 -0.374 25324 326 1 . 1 1 62 62 ARG N N 62 129.706 129.706 127.758 1.948 25324 327 1 . 1 1 62 62 ARG HA H 62 5.132 5.132 5.269 -0.137 25324 328 1 . 1 1 62 62 ARG C C 62 172.456 172.456 173.048 -0.592 25324 329 1 . 1 1 62 62 ARG CA C 62 54.954 54.954 53.944 1.010 25324 330 1 . 1 1 62 62 ARG CB C 62 32.870 32.870 34.275 -1.405 25324 331 1 . 1 1 62 62 ARG H H 62 8.405 8.405 8.503 -0.098 25324 332 1 . 1 1 63 63 ALA N N 63 122.744 122.744 129.066 -6.322 25324 333 1 . 1 1 63 63 ALA HA H 63 5.345 5.345 5.366 -0.021 25324 334 1 . 1 1 63 63 ALA C C 63 176.120 176.120 175.571 0.549 25324 335 1 . 1 1 63 63 ALA CA C 63 49.919 49.919 50.067 -0.148 25324 336 1 . 1 1 63 63 ALA CB C 63 24.773 24.773 22.883 1.890 25324 337 1 . 1 1 63 63 ALA H H 63 8.628 8.628 8.825 -0.197 25324 338 1 . 1 1 64 64 THR N N 64 116.855 116.855 118.510 -1.655 25324 339 1 . 1 1 64 64 THR HA H 64 4.848 4.848 5.195 -0.347 25324 340 1 . 1 1 64 64 THR C C 64 172.957 172.957 173.748 -0.791 25324 341 1 . 1 1 64 64 THR CA C 64 61.211 61.211 61.152 0.059 25324 342 1 . 1 1 64 64 THR CB C 64 71.064 71.064 71.504 -0.440 25324 343 1 . 1 1 64 64 THR H H 64 8.315 8.315 8.664 -0.349 25324 344 1 . 1 1 65 65 LEU N N 65 129.360 129.360 129.300 0.060 25324 345 1 . 1 1 65 65 LEU HA H 65 3.362 3.362 3.898 -0.536 25324 346 1 . 1 1 65 65 LEU C C 65 176.459 176.459 176.269 0.190 25324 347 1 . 1 1 65 65 LEU CA C 65 55.687 55.687 55.115 0.572 25324 348 1 . 1 1 65 65 LEU CB C 65 41.711 41.711 41.998 -0.287 25324 349 1 . 1 1 65 65 LEU H H 65 8.877 8.877 8.932 -0.055 25324 350 1 . 1 1 66 66 LEU N N 66 128.683 128.683 126.981 1.702 25324 351 1 . 1 1 66 66 LEU HA H 66 4.376 4.376 4.281 0.095 25324 352 1 . 1 1 66 66 LEU C C 66 177.621 177.621 177.316 0.305 25324 353 1 . 1 1 66 66 LEU CA C 66 54.700 54.700 55.758 -1.058 25324 354 1 . 1 1 66 66 LEU CB C 66 42.302 42.302 42.218 0.084 25324 355 1 . 1 1 66 66 LEU H H 66 9.320 9.320 8.866 0.454 25324 356 1 . 1 1 67 67 GLY N N 67 105.361 105.361 105.174 0.187 25324 357 1 . 1 1 67 67 GLY C C 67 173.618 173.618 173.693 -0.075 25324 358 1 . 1 1 67 67 GLY CA C 67 43.367 43.367 44.884 -1.517 25324 359 1 . 1 1 67 67 GLY H H 67 6.639 6.639 7.823 -1.184 25324 360 1 . 1 1 68 68 ASN N N 68 121.848 121.848 118.206 3.642 25324 361 1 . 1 1 68 68 ASN HA H 68 4.331 4.331 4.624 -0.293 25324 362 1 . 1 1 68 68 ASN C C 68 174.316 174.316 174.864 -0.548 25324 363 1 . 1 1 68 68 ASN CA C 68 54.552 54.552 52.817 1.734 25324 364 1 . 1 1 68 68 ASN CB C 68 37.165 37.165 38.622 -1.457 25324 365 1 . 1 1 68 68 ASN H H 68 9.236 9.236 8.175 1.061 25324 366 1 . 1 1 69 69 ASN N N 69 109.509 109.509 113.763 -4.254 25324 367 1 . 1 1 69 69 ASN HA H 69 4.080 4.080 4.401 -0.321 25324 368 1 . 1 1 69 69 ASN C C 69 171.456 171.456 174.068 -2.612 25324 369 1 . 1 1 69 69 ASN CA C 69 55.750 55.750 54.612 1.138 25324 370 1 . 1 1 69 69 ASN CB C 69 37.306 37.306 38.040 -0.734 25324 371 1 . 1 1 69 69 ASN H H 69 8.651 8.651 8.634 0.017 25324 372 1 . 1 1 70 70 SER N N 70 113.479 113.479 115.014 -1.535 25324 373 1 . 1 1 70 70 SER HA H 70 5.437 5.437 5.127 0.310 25324 374 1 . 1 1 70 70 SER C C 70 173.750 173.750 173.192 0.558 25324 375 1 . 1 1 70 70 SER CA C 70 57.139 57.139 58.512 -1.373 25324 376 1 . 1 1 70 70 SER CB C 70 63.818 63.818 64.527 -0.710 25324 377 1 . 1 1 70 70 SER H H 70 7.693 7.693 7.506 0.187 25324 378 1 . 1 1 71 71 TYR N N 71 123.132 123.132 124.209 -1.077 25324 379 1 . 1 1 71 71 TYR HA H 71 5.143 5.143 5.097 0.046 25324 380 1 . 1 1 71 71 TYR CA C 71 56.648 56.648 56.641 0.007 25324 381 1 . 1 1 71 71 TYR CB C 71 42.445 42.445 42.106 0.339 25324 382 1 . 1 1 71 71 TYR H H 71 9.326 9.326 9.557 -0.231 25324 383 1 . 1 1 72 72 GLU N N 72 122.396 122.396 123.158 -0.762 25324 384 1 . 1 1 72 72 GLU HA H 72 4.806 4.806 4.759 0.047 25324 385 1 . 1 1 72 72 GLU C C 72 175.698 175.698 175.176 0.522 25324 386 1 . 1 1 72 72 GLU CA C 72 55.167 55.167 55.455 -0.288 25324 387 1 . 1 1 72 72 GLU CB C 72 30.184 30.184 31.523 -1.339 25324 388 1 . 1 1 72 72 GLU H H 72 8.624 8.624 9.115 -0.491 25324 389 1 . 1 1 73 73 VAL N N 73 128.513 128.513 127.855 0.658 25324 390 1 . 1 1 73 73 VAL HA H 73 4.199 4.199 4.400 -0.201 25324 391 1 . 1 1 73 73 VAL C C 73 175.369 175.369 174.673 0.696 25324 392 1 . 1 1 73 73 VAL CA C 73 61.480 61.480 61.019 0.461 25324 393 1 . 1 1 73 73 VAL CB C 73 33.333 33.333 33.032 0.301 25324 394 1 . 1 1 73 73 VAL H H 73 8.564 8.564 9.122 -0.558 25324 395 1 . 1 1 74 74 GLU N N 74 124.842 124.842 126.558 -1.716 25324 396 1 . 1 1 74 74 GLU HA H 74 5.087 5.087 5.057 0.030 25324 397 1 . 1 1 74 74 GLU C C 74 174.415 174.415 174.924 -0.509 25324 398 1 . 1 1 74 74 GLU CA C 74 54.337 54.337 54.869 -0.532 25324 399 1 . 1 1 74 74 GLU CB C 74 35.157 35.157 33.198 1.959 25324 400 1 . 1 1 74 74 GLU H H 74 9.011 9.011 9.014 -0.003 25324 401 1 . 1 1 75 75 ASN N N 75 116.136 116.136 121.849 -5.713 25324 402 1 . 1 1 75 75 ASN HA H 75 6.139 6.139 5.680 0.459 25324 403 1 . 1 1 75 75 ASN C C 75 172.703 172.703 173.710 -1.007 25324 404 1 . 1 1 75 75 ASN CA C 75 51.825 51.825 51.995 -0.170 25324 405 1 . 1 1 75 75 ASN CB C 75 45.896 45.896 42.526 3.370 25324 406 1 . 1 1 75 75 ASN H H 75 9.424 9.424 9.152 0.272 25324 407 1 . 1 1 76 76 GLN N N 76 120.762 120.762 121.664 -0.902 25324 408 1 . 1 1 76 76 GLN HA H 76 4.040 4.040 4.402 -0.362 25324 409 1 . 1 1 76 76 GLN C C 76 173.113 173.113 173.999 -0.886 25324 410 1 . 1 1 76 76 GLN CA C 76 54.223 54.223 54.333 -0.110 25324 411 1 . 1 1 76 76 GLN CB C 76 30.348 30.348 30.992 -0.644 25324 412 1 . 1 1 76 76 GLN H H 76 7.106 7.106 8.798 -1.692 25324 413 1 . 1 1 77 77 TRP N N 77 125.598 125.598 124.522 1.076 25324 414 1 . 1 1 77 77 TRP HA H 77 5.152 5.152 5.083 0.069 25324 415 1 . 1 1 77 77 TRP C C 77 175.502 175.502 175.589 -0.087 25324 416 1 . 1 1 77 77 TRP CA C 77 55.764 55.764 56.523 -0.759 25324 417 1 . 1 1 77 77 TRP CB C 77 29.999 29.999 30.583 -0.584 25324 418 1 . 1 1 77 77 TRP H H 77 8.181 8.181 8.060 0.121 25324 419 1 . 1 1 78 78 GLY N N 78 107.901 107.901 108.773 -0.872 25324 420 1 . 1 1 78 78 GLY C C 78 174.611 174.611 174.334 0.277 25324 421 1 . 1 1 78 78 GLY CA C 78 44.902 44.902 45.094 -0.192 25324 422 1 . 1 1 78 78 GLY H H 78 8.778 8.778 8.656 0.122 25324 423 1 . 1 1 79 79 GLY N N 79 109.844 109.844 107.920 1.924 25324 424 1 . 1 1 79 79 GLY C C 79 173.782 173.782 173.867 -0.085 25324 425 1 . 1 1 79 79 GLY CA C 79 43.793 43.793 44.569 -0.776 25324 426 1 . 1 1 79 79 GLY H H 79 8.198 8.198 7.705 0.493 25324 427 1 . 1 1 80 80 ASP N N 80 115.837 115.837 119.104 -3.267 25324 428 1 . 1 1 80 80 ASP HA H 80 4.241 4.241 4.437 -0.196 25324 429 1 . 1 1 80 80 ASP C C 80 177.285 177.285 176.480 0.805 25324 430 1 . 1 1 80 80 ASP CA C 80 56.183 56.183 55.421 0.762 25324 431 1 . 1 1 80 80 ASP CB C 80 40.523 40.523 40.972 -0.449 25324 432 1 . 1 1 80 80 ASP H H 80 8.132 8.132 8.457 -0.325 25324 433 1 . 1 1 81 81 SER N N 81 112.690 112.690 115.034 -2.344 25324 434 1 . 1 1 81 81 SER HA H 81 4.513 4.513 4.304 0.209 25324 435 1 . 1 1 81 81 SER C C 81 173.684 173.684 173.992 -0.308 25324 436 1 . 1 1 81 81 SER CA C 81 57.232 57.232 58.468 -1.236 25324 437 1 . 1 1 81 81 SER CB C 81 63.170 63.170 63.195 -0.025 25324 438 1 . 1 1 81 81 SER H H 81 8.179 8.179 8.141 0.038 25324 439 1 . 1 1 82 82 ALA N N 82 126.310 126.310 125.227 1.083 25324 440 1 . 1 1 82 82 ALA HA H 82 4.403 4.403 4.382 0.021 25324 441 1 . 1 1 82 82 ALA CA C 82 50.466 50.466 50.466 -0.000 25324 442 1 . 1 1 82 82 ALA CB C 82 18.198 18.198 18.363 -0.165 25324 443 1 . 1 1 82 82 ALA H H 82 7.274 7.274 7.361 -0.087 25324 444 1 . 1 1 83 83 PRO HA H 83 4.373 4.373 4.264 0.109 25324 445 1 . 1 1 83 83 PRO C C 83 175.378 175.378 175.428 -0.050 25324 446 1 . 1 1 83 83 PRO CA C 83 62.327 62.327 62.333 -0.006 25324 447 1 . 1 1 83 83 PRO CB C 83 32.164 32.164 32.394 -0.230 25324 448 1 . 1 1 84 84 TRP N N 84 120.106 120.106 118.251 1.855 25324 449 1 . 1 1 84 84 TRP HA H 84 4.271 4.271 4.427 -0.156 25324 450 1 . 1 1 84 84 TRP C C 84 176.358 176.358 175.880 0.478 25324 451 1 . 1 1 84 84 TRP CA C 84 56.946 56.946 56.959 -0.013 25324 452 1 . 1 1 84 84 TRP CB C 84 29.716 29.716 30.567 -0.851 25324 453 1 . 1 1 84 84 TRP H H 84 8.329 8.329 7.989 0.341 25324 454 1 . 1 1 85 85 HIS N N 85 118.543 118.543 120.717 -2.174 25324 455 1 . 1 1 85 85 HIS HA H 85 4.918 4.918 4.905 0.014 25324 456 1 . 1 1 85 85 HIS C C 85 174.950 174.950 174.933 0.017 25324 457 1 . 1 1 85 85 HIS CA C 85 53.469 53.469 54.979 -1.510 25324 458 1 . 1 1 85 85 HIS CB C 85 31.673 31.673 33.073 -1.400 25324 459 1 . 1 1 85 85 HIS H H 85 9.204 9.204 8.972 0.232 25324 460 1 . 1 1 86 86 SER N N 86 117.803 117.803 117.543 0.260 25324 461 1 . 1 1 86 86 SER HA H 86 4.412 4.412 4.243 0.169 25324 462 1 . 1 1 86 86 SER C C 86 175.691 175.691 174.746 0.945 25324 463 1 . 1 1 86 86 SER CA C 86 60.257 60.257 59.520 0.737 25324 464 1 . 1 1 86 86 SER CB C 86 63.015 63.015 63.527 -0.512 25324 465 1 . 1 1 86 86 SER H H 86 9.168 9.168 8.892 0.276 25324 466 1 . 1 1 87 87 GLY N N 87 115.773 115.773 111.715 4.058 25324 467 1 . 1 1 87 87 GLY C C 87 174.288 174.288 173.809 0.479 25324 468 1 . 1 1 87 87 GLY CA C 87 44.701 44.701 45.005 -0.304 25324 469 1 . 1 1 87 87 GLY H H 87 9.284 9.284 8.959 0.325 25324 470 1 . 1 1 88 88 GLY N N 88 109.162 109.162 108.284 0.878 25324 471 1 . 1 1 88 88 GLY C C 88 171.120 171.120 171.810 -0.690 25324 472 1 . 1 1 88 88 GLY CA C 88 44.594 44.594 45.068 -0.473 25324 473 1 . 1 1 88 88 GLY H H 88 8.054 8.054 8.000 0.054 25324 474 1 . 1 1 89 89 ASN N N 89 117.048 117.048 119.886 -2.838 25324 475 1 . 1 1 89 89 ASN HA H 89 6.038 6.038 5.741 0.297 25324 476 1 . 1 1 89 89 ASN C C 89 175.287 175.287 174.830 0.457 25324 477 1 . 1 1 89 89 ASN CA C 89 51.865 51.865 52.915 -1.050 25324 478 1 . 1 1 89 89 ASN CB C 89 39.605 39.605 40.804 -1.199 25324 479 1 . 1 1 89 89 ASN H H 89 8.516 8.516 8.617 -0.101 25324 480 1 . 1 1 90 90 TRP N N 90 125.844 125.844 124.323 1.521 25324 481 1 . 1 1 90 90 TRP HA H 90 5.253 5.253 5.158 0.095 25324 482 1 . 1 1 90 90 TRP C C 90 175.278 175.278 175.154 0.124 25324 483 1 . 1 1 90 90 TRP CA C 90 54.268 54.268 54.477 -0.209 25324 484 1 . 1 1 90 90 TRP CB C 90 31.958 31.958 32.219 -0.261 25324 485 1 . 1 1 90 90 TRP H H 90 9.282 9.282 9.329 -0.047 25324 486 1 . 1 1 91 91 ILE N N 91 123.134 123.134 121.196 1.938 25324 487 1 . 1 1 91 91 ILE HA H 91 5.446 5.446 4.926 0.520 25324 488 1 . 1 1 91 91 ILE C C 91 175.489 175.489 175.287 0.201 25324 489 1 . 1 1 91 91 ILE CA C 91 60.826 60.826 60.520 0.306 25324 490 1 . 1 1 91 91 ILE CB C 91 39.676 39.676 38.632 1.044 25324 491 1 . 1 1 91 91 ILE H H 91 9.318 9.318 8.678 0.640 25324 492 1 . 1 1 92 92 LEU N N 92 123.452 123.452 128.879 -5.427 25324 493 1 . 1 1 92 92 LEU HA H 92 3.942 3.942 3.707 0.235 25324 494 1 . 1 1 92 92 LEU C C 92 173.620 173.620 174.456 -0.836 25324 495 1 . 1 1 92 92 LEU CA C 92 52.256 52.256 53.622 -1.366 25324 496 1 . 1 1 92 92 LEU CB C 92 43.508 43.508 41.847 1.660 25324 497 1 . 1 1 92 92 LEU H H 92 8.463 8.463 8.895 -0.432 25324 498 1 . 1 1 93 93 GLY N N 93 103.987 103.987 107.827 -3.840 25324 499 1 . 1 1 93 93 GLY C C 93 172.284 172.284 174.155 -1.872 25324 500 1 . 1 1 93 93 GLY CA C 93 43.500 43.500 45.548 -2.048 25324 501 1 . 1 1 93 93 GLY H H 93 2.937 2.937 7.173 -4.236 25324 502 1 . 1 1 94 94 SER N N 94 110.274 110.274 117.290 -7.016 25324 503 1 . 1 1 94 94 SER HA H 94 4.711 4.711 4.739 -0.028 25324 504 1 . 1 1 94 94 SER C C 94 174.784 174.784 175.035 -0.251 25324 505 1 . 1 1 94 94 SER CA C 94 56.555 56.555 59.177 -2.622 25324 506 1 . 1 1 94 94 SER CB C 94 65.051 65.051 64.505 0.546 25324 507 1 . 1 1 94 94 SER H H 94 7.919 7.919 9.255 -1.336 25324 508 1 . 1 1 95 95 ARG N N 95 123.020 123.020 121.449 1.571 25324 509 1 . 1 1 95 95 ARG HA H 95 4.672 4.672 4.491 0.182 25324 510 1 . 1 1 95 95 ARG C C 95 176.120 176.120 176.851 -0.731 25324 511 1 . 1 1 95 95 ARG CA C 95 55.374 55.374 55.172 0.202 25324 512 1 . 1 1 95 95 ARG CB C 95 31.848 31.848 31.421 0.427 25324 513 1 . 1 1 95 95 ARG H H 95 9.148 9.148 7.758 1.390 25324 514 1 . 1 1 96 96 GLU N N 96 120.357 120.357 122.647 -2.290 25324 515 1 . 1 1 96 96 GLU HA H 96 4.282 4.282 4.070 0.212 25324 516 1 . 1 1 96 96 GLU C C 96 176.278 176.278 176.351 -0.073 25324 517 1 . 1 1 96 96 GLU CA C 96 56.530 56.530 58.877 -2.347 25324 518 1 . 1 1 96 96 GLU CB C 96 30.153 30.153 29.480 0.672 25324 519 1 . 1 1 96 96 GLU H H 96 8.610 8.610 8.833 -0.223 25324 520 1 . 1 1 97 97 ASN N N 97 117.678 117.678 116.438 1.240 25324 521 1 . 1 1 97 97 ASN HA H 97 4.612 4.612 4.826 -0.214 25324 522 1 . 1 1 97 97 ASN C C 97 173.949 173.949 174.197 -0.248 25324 523 1 . 1 1 97 97 ASN CA C 97 53.015 53.015 52.795 0.220 25324 524 1 . 1 1 97 97 ASN CB C 97 38.166 38.166 38.500 -0.334 25324 525 1 . 1 1 97 97 ASN H H 97 8.533 8.533 8.198 0.335 25324 526 1 . 1 1 98 98 GLN N N 98 118.592 118.592 119.413 -0.821 25324 527 1 . 1 1 98 98 GLN HA H 98 4.360 4.360 4.460 -0.100 25324 528 1 . 1 1 98 98 GLN C C 98 173.116 173.116 173.854 -0.738 25324 529 1 . 1 1 98 98 GLN CA C 98 55.628 55.628 55.669 -0.041 25324 530 1 . 1 1 98 98 GLN CB C 98 30.869 30.869 31.230 -0.360 25324 531 1 . 1 1 98 98 GLN H H 98 7.663 7.663 7.541 0.122 25324 532 1 . 1 1 99 99 ASN N N 99 122.855 122.855 120.788 2.067 25324 533 1 . 1 1 99 99 ASN HA H 99 5.135 5.135 5.015 0.120 25324 534 1 . 1 1 99 99 ASN C C 99 175.287 175.287 175.001 0.286 25324 535 1 . 1 1 99 99 ASN CA C 99 52.990 52.990 52.736 0.254 25324 536 1 . 1 1 99 99 ASN CB C 99 40.491 40.491 40.331 0.160 25324 537 1 . 1 1 99 99 ASN H H 99 8.759 8.759 8.567 0.192 25324 538 1 . 1 1 100 100 VAL N N 100 121.385 121.385 118.968 2.417 25324 539 1 . 1 1 100 100 VAL HA H 100 3.748 3.748 3.884 -0.136 25324 540 1 . 1 1 100 100 VAL C C 100 174.956 174.956 176.303 -1.347 25324 541 1 . 1 1 100 100 VAL CA C 100 63.843 63.843 63.319 0.524 25324 542 1 . 1 1 100 100 VAL CB C 100 32.443 32.443 31.549 0.894 25324 543 1 . 1 1 100 100 VAL H H 100 8.717 8.717 8.042 0.675 25324 544 1 . 1 1 101 101 VAL N N 101 112.736 112.736 120.085 -7.349 25324 545 1 . 1 1 101 101 VAL HA H 101 4.645 4.645 4.451 0.194 25324 546 1 . 1 1 101 101 VAL C C 101 175.577 175.577 174.615 0.962 25324 547 1 . 1 1 101 101 VAL CA C 101 59.963 59.963 61.486 -1.523 25324 548 1 . 1 1 101 101 VAL CB C 101 33.041 33.041 33.571 -0.530 25324 549 1 . 1 1 101 101 VAL H H 101 8.802 8.802 8.799 0.003 25324 550 1 . 1 1 102 102 ALA N N 102 122.104 122.104 121.313 0.791 25324 551 1 . 1 1 102 102 ALA HA H 102 4.807 4.807 5.113 -0.306 25324 552 1 . 1 1 102 102 ALA C C 102 176.046 176.046 174.952 1.094 25324 553 1 . 1 1 102 102 ALA CA C 102 53.254 53.254 50.911 2.343 25324 554 1 . 1 1 102 102 ALA CB C 102 21.625 21.625 22.206 -0.581 25324 555 1 . 1 1 102 102 ALA H H 102 7.677 7.677 7.747 -0.070 25324 556 1 . 1 1 103 103 ILE N N 103 118.218 118.218 121.839 -3.621 25324 557 1 . 1 1 103 103 ILE HA H 103 4.027 4.027 4.366 -0.339 25324 558 1 . 1 1 103 103 ILE C C 103 173.118 173.118 173.865 -0.747 25324 559 1 . 1 1 103 103 ILE CA C 103 62.227 62.227 60.362 1.865 25324 560 1 . 1 1 103 103 ILE CB C 103 42.471 42.471 41.482 0.989 25324 561 1 . 1 1 103 103 ILE H H 103 8.102 8.102 8.559 -0.457 25324 562 1 . 1 1 104 104 ASN N N 104 125.938 125.938 126.662 -0.724 25324 563 1 . 1 1 104 104 ASN HA H 104 5.686 5.686 5.342 0.344 25324 564 1 . 1 1 104 104 ASN C C 104 174.870 174.870 173.620 1.250 25324 565 1 . 1 1 104 104 ASN CA C 104 52.553 52.553 52.272 0.281 25324 566 1 . 1 1 104 104 ASN CB C 104 38.852 38.852 40.234 -1.382 25324 567 1 . 1 1 104 104 ASN H H 104 8.668 8.668 8.988 -0.320 25324 568 1 . 1 1 105 105 VAL N N 105 114.631 114.631 119.496 -4.865 25324 569 1 . 1 1 105 105 VAL HA H 105 5.205 5.205 5.064 0.141 25324 570 1 . 1 1 105 105 VAL C C 105 174.788 174.788 173.535 1.253 25324 571 1 . 1 1 105 105 VAL CA C 105 57.979 57.979 60.106 -2.127 25324 572 1 . 1 1 105 105 VAL CB C 105 36.040 36.040 35.406 0.634 25324 573 1 . 1 1 105 105 VAL H H 105 8.933 8.933 8.844 0.089 25324 574 1 . 1 1 106 106 GLU N N 106 118.347 118.347 124.678 -6.331 25324 575 1 . 1 1 106 106 GLU HA H 106 5.080 5.080 5.180 -0.100 25324 576 1 . 1 1 106 106 GLU C C 106 174.777 174.777 174.820 -0.043 25324 577 1 . 1 1 106 106 GLU CA C 106 54.967 54.967 55.109 -0.142 25324 578 1 . 1 1 106 106 GLU CB C 106 33.643 33.643 33.591 0.052 25324 579 1 . 1 1 106 106 GLU H H 106 8.814 8.814 8.774 0.040 25324 580 1 . 1 1 107 107 SER N N 107 115.335 115.335 119.270 -3.935 25324 581 1 . 1 1 107 107 SER HA H 107 5.266 5.266 4.848 0.419 25324 582 1 . 1 1 107 107 SER C C 107 175.787 175.787 174.231 1.556 25324 583 1 . 1 1 107 107 SER CA C 107 55.888 55.888 57.283 -1.395 25324 584 1 . 1 1 107 107 SER CB C 107 65.921 65.921 65.333 0.588 25324 585 1 . 1 1 107 107 SER H H 107 8.576 8.576 8.645 -0.069 25324 586 1 . 1 1 108 108 GLY N N 108 117.567 117.567 110.915 6.652 25324 587 1 . 1 1 108 108 GLY C C 108 173.959 173.959 174.361 -0.402 25324 588 1 . 1 1 108 108 GLY CA C 108 44.677 44.677 45.142 -0.465 25324 589 1 . 1 1 108 108 GLY H H 108 9.532 9.532 8.670 0.862 25324 590 1 . 1 1 109 109 ASP N N 109 122.108 122.108 121.815 0.293 25324 591 1 . 1 1 109 109 ASP HA H 109 4.801 4.801 4.757 0.044 25324 592 1 . 1 1 109 109 ASP C C 109 176.203 176.203 175.773 0.430 25324 593 1 . 1 1 109 109 ASP CA C 109 52.134 52.134 53.552 -1.417 25324 594 1 . 1 1 109 109 ASP CB C 109 39.342 39.342 41.820 -2.478 25324 595 1 . 1 1 109 109 ASP H H 109 8.605 8.605 7.886 0.719 25324 596 1 . 1 1 110 110 ASP N N 110 116.197 116.197 118.867 -2.670 25324 597 1 . 1 1 110 110 ASP HA H 110 4.222 4.222 4.519 -0.297 25324 598 1 . 1 1 110 110 ASP C C 110 175.951 175.951 176.206 -0.255 25324 599 1 . 1 1 110 110 ASP CA C 110 55.198 55.198 54.300 0.898 25324 600 1 . 1 1 110 110 ASP CB C 110 38.630 38.630 40.259 -1.629 25324 601 1 . 1 1 110 110 ASP H H 110 9.087 9.087 8.469 0.618 25324 602 1 . 1 1 111 111 GLY N N 111 103.841 103.841 106.264 -2.423 25324 603 1 . 1 1 111 111 GLY C C 111 173.924 173.924 175.016 -1.092 25324 604 1 . 1 1 111 111 GLY CA C 111 45.163 45.163 45.405 -0.242 25324 605 1 . 1 1 111 111 GLY H H 111 8.930 8.930 8.139 0.791 25324 606 1 . 1 1 112 112 GLN N N 112 121.626 121.626 119.438 2.189 25324 607 1 . 1 1 112 112 GLN HA H 112 4.070 4.070 4.113 -0.043 25324 608 1 . 1 1 112 112 GLN C C 112 176.431 176.431 175.290 1.141 25324 609 1 . 1 1 112 112 GLN CA C 112 58.273 58.273 58.532 -0.259 25324 610 1 . 1 1 112 112 GLN CB C 112 27.693 27.693 29.371 -1.678 25324 611 1 . 1 1 112 112 GLN H H 112 7.351 7.351 8.276 -0.925 25324 612 1 . 1 1 113 113 THR N N 113 112.322 112.322 108.310 4.012 25324 613 1 . 1 1 113 113 THR HA H 113 5.331 5.331 5.234 0.097 25324 614 1 . 1 1 113 113 THR C C 113 174.452 174.452 173.072 1.380 25324 615 1 . 1 1 113 113 THR CA C 113 59.739 59.739 59.792 -0.053 25324 616 1 . 1 1 113 113 THR CB C 113 71.773 71.773 71.404 0.369 25324 617 1 . 1 1 113 113 THR H H 113 10.053 10.053 7.662 2.391 25324 618 1 . 1 1 114 114 LEU N N 114 122.083 122.083 124.905 -2.822 25324 619 1 . 1 1 114 114 LEU HA H 114 4.581 4.581 4.707 -0.126 25324 620 1 . 1 1 114 114 LEU C C 114 175.113 175.113 174.862 0.251 25324 621 1 . 1 1 114 114 LEU CA C 114 52.905 52.905 53.965 -1.060 25324 622 1 . 1 1 114 114 LEU CB C 114 47.033 47.033 44.034 2.999 25324 623 1 . 1 1 114 114 LEU H H 114 8.978 8.978 8.927 0.051 25324 624 1 . 1 1 115 115 ASN N N 115 118.846 118.846 121.530 -2.684 25324 625 1 . 1 1 115 115 ASN HA H 115 5.770 5.770 5.773 -0.003 25324 626 1 . 1 1 115 115 ASN C C 115 174.788 174.788 174.912 -0.124 25324 627 1 . 1 1 115 115 ASN CA C 115 52.342 52.342 51.807 0.535 25324 628 1 . 1 1 115 115 ASN CB C 115 43.414 43.414 42.337 1.077 25324 629 1 . 1 1 115 115 ASN H H 115 8.837 8.837 8.255 0.582 25324 630 1 . 1 1 116 116 GLY N N 116 109.661 109.661 108.517 1.144 25324 631 1 . 1 1 116 116 GLY C C 116 172.452 172.452 172.548 -0.096 25324 632 1 . 1 1 116 116 GLY CA C 116 46.471 46.471 46.232 0.239 25324 633 1 . 1 1 116 116 GLY H H 116 8.625 8.625 8.846 -0.221 25324 634 1 . 1 1 117 117 THR N N 117 120.009 120.009 114.087 5.922 25324 635 1 . 1 1 117 117 THR HA H 117 5.556 5.556 5.591 -0.035 25324 636 1 . 1 1 117 117 THR C C 117 171.619 171.619 173.245 -1.626 25324 637 1 . 1 1 117 117 THR CA C 117 59.373 59.373 60.264 -0.891 25324 638 1 . 1 1 117 117 THR CB C 117 72.777 72.777 72.725 0.052 25324 639 1 . 1 1 117 117 THR H H 117 8.911 8.911 9.012 -0.101 25324 640 1 . 1 1 118 118 MET N N 118 115.550 115.550 117.683 -2.133 25324 641 1 . 1 1 118 118 MET HA H 118 4.889 4.889 5.254 -0.365 25324 642 1 . 1 1 118 118 MET C C 118 172.707 172.707 173.999 -1.292 25324 643 1 . 1 1 118 118 MET CA C 118 54.714 54.714 54.701 0.013 25324 644 1 . 1 1 118 118 MET CB C 118 33.663 33.663 37.235 -3.572 25324 645 1 . 1 1 118 118 MET H H 118 9.159 9.159 9.372 -0.213 25324 646 1 . 1 1 119 119 THR N N 119 113.716 113.716 116.312 -2.596 25324 647 1 . 1 1 119 119 THR HA H 119 4.682 4.682 4.970 -0.287 25324 648 1 . 1 1 119 119 THR C C 119 173.952 173.952 173.403 0.549 25324 649 1 . 1 1 119 119 THR CA C 119 61.395 61.395 61.582 -0.186 25324 650 1 . 1 1 119 119 THR CB C 119 71.746 71.746 71.734 0.012 25324 651 1 . 1 1 119 119 THR H H 119 8.685 8.685 8.743 -0.058 25324 652 1 . 1 1 120 120 TYR N N 120 129.153 129.153 125.427 3.726 25324 653 1 . 1 1 120 120 TYR HA H 120 4.800 4.800 4.898 -0.098 25324 654 1 . 1 1 120 120 TYR C C 120 175.214 175.214 176.605 -1.391 25324 655 1 . 1 1 120 120 TYR CA C 120 58.877 58.877 58.087 0.790 25324 656 1 . 1 1 120 120 TYR CB C 120 40.502 40.502 40.295 0.207 25324 657 1 . 1 1 120 120 TYR H H 120 10.107 10.107 8.556 1.551 25324 658 1 . 1 1 121 121 ALA N N 121 119.947 119.947 124.340 -4.393 25324 659 1 . 1 1 121 121 ALA HA H 121 4.004 4.004 4.234 -0.230 25324 660 1 . 1 1 121 121 ALA C C 121 178.456 178.456 177.560 0.896 25324 661 1 . 1 1 121 121 ALA CA C 121 53.956 53.956 53.886 0.070 25324 662 1 . 1 1 121 121 ALA CB C 121 18.710 18.710 18.705 0.005 25324 663 1 . 1 1 121 121 ALA H H 121 8.704 8.704 8.476 0.228 25324 664 1 . 1 1 122 122 GLY N N 122 111.186 111.186 108.244 2.942 25324 665 1 . 1 1 122 122 GLY C C 122 173.949 173.949 173.945 0.004 25324 666 1 . 1 1 122 122 GLY CA C 122 45.002 45.002 45.281 -0.279 25324 667 1 . 1 1 122 122 GLY H H 122 8.792 8.792 8.524 0.268 25324 668 1 . 1 1 123 123 GLU N N 123 120.099 120.099 120.094 0.005 25324 669 1 . 1 1 123 123 GLU HA H 123 4.705 4.705 4.580 0.125 25324 670 1 . 1 1 123 123 GLU C C 123 175.912 175.912 176.077 -0.165 25324 671 1 . 1 1 123 123 GLU CA C 123 54.414 54.414 55.339 -0.925 25324 672 1 . 1 1 123 123 GLU CB C 123 32.784 32.784 32.005 0.779 25324 673 1 . 1 1 123 123 GLU H H 123 8.072 8.072 7.903 0.169 25324 674 1 . 1 1 124 124 GLY N N 124 105.303 105.303 109.105 -3.802 25324 675 1 . 1 1 124 124 GLY CA C 124 43.802 43.802 43.961 -0.159 25324 676 1 . 1 1 124 124 GLY H H 124 7.939 7.939 8.215 -0.276 25324 677 1 . 1 1 125 125 PRO HA H 125 4.935 4.935 4.914 0.021 25324 678 1 . 1 1 125 125 PRO C C 125 177.788 177.788 176.413 1.375 25324 679 1 . 1 1 125 125 PRO CA C 125 63.131 63.131 63.009 0.122 25324 680 1 . 1 1 125 125 PRO CB C 125 31.859 31.859 32.053 -0.194 25324 681 1 . 1 1 126 126 ILE N N 126 117.387 117.387 118.334 -0.947 25324 682 1 . 1 1 126 126 ILE HA H 126 4.899 4.899 4.721 0.177 25324 683 1 . 1 1 126 126 ILE C C 126 175.625 175.625 175.010 0.615 25324 684 1 . 1 1 126 126 ILE CA C 126 59.453 59.453 59.105 0.348 25324 685 1 . 1 1 126 126 ILE CB C 126 42.548 42.548 41.527 1.021 25324 686 1 . 1 1 126 126 ILE H H 126 9.599 9.599 8.935 0.664 25324 687 1 . 1 1 127 127 GLY N N 127 106.753 106.753 108.112 -1.359 25324 688 1 . 1 1 127 127 GLY C C 127 173.627 173.627 172.732 0.895 25324 689 1 . 1 1 127 127 GLY CA C 127 46.283 46.283 44.621 1.662 25324 690 1 . 1 1 127 127 GLY H H 127 8.840 8.840 8.665 0.175 25324 691 1 . 1 1 128 128 PHE N N 128 124.826 124.826 126.160 -1.334 25324 692 1 . 1 1 128 128 PHE HA H 128 4.944 4.944 5.248 -0.304 25324 693 1 . 1 1 128 128 PHE C C 128 173.087 173.087 173.287 -0.200 25324 694 1 . 1 1 128 128 PHE CA C 128 57.009 57.009 56.621 0.388 25324 695 1 . 1 1 128 128 PHE CB C 128 43.160 43.160 43.379 -0.219 25324 696 1 . 1 1 128 128 PHE H H 128 8.924 8.924 9.160 -0.236 25324 697 1 . 1 1 129 129 LYS N N 129 131.518 131.518 128.109 3.409 25324 698 1 . 1 1 129 129 LYS HA H 129 4.883 4.883 4.820 0.063 25324 699 1 . 1 1 129 129 LYS C C 129 173.863 173.863 173.992 -0.129 25324 700 1 . 1 1 129 129 LYS CA C 129 55.735 55.735 54.439 1.296 25324 701 1 . 1 1 129 129 LYS CB C 129 34.721 34.721 35.496 -0.775 25324 702 1 . 1 1 129 129 LYS H H 129 8.201 8.201 8.369 -0.168 25324 703 1 . 1 1 130 130 GLY N N 130 114.030 114.030 113.129 0.901 25324 704 1 . 1 1 130 130 GLY C C 130 171.951 171.951 172.522 -0.571 25324 705 1 . 1 1 130 130 GLY CA C 130 43.787 43.787 43.785 0.001 25324 706 1 . 1 1 130 130 GLY H H 130 9.325 9.325 8.736 0.589 25324 707 1 . 1 1 131 131 THR N N 131 120.583 120.583 120.276 0.307 25324 708 1 . 1 1 131 131 THR HA H 131 4.939 4.939 5.004 -0.065 25324 709 1 . 1 1 131 131 THR C C 131 173.118 173.118 173.692 -0.574 25324 710 1 . 1 1 131 131 THR CA C 131 61.266 61.266 61.189 0.077 25324 711 1 . 1 1 131 131 THR CB C 131 70.392 70.392 72.026 -1.634 25324 712 1 . 1 1 131 131 THR H H 131 8.916 8.916 8.686 0.230 25324 713 1 . 1 1 132 132 LEU N N 132 130.774 130.774 129.031 1.743 25324 714 1 . 1 1 132 132 LEU HA H 132 3.500 3.500 3.908 -0.408 25324 715 1 . 1 1 132 132 LEU C C 132 176.574 176.574 176.564 0.010 25324 716 1 . 1 1 132 132 LEU CA C 132 56.187 56.187 55.341 0.846 25324 717 1 . 1 1 132 132 LEU CB C 132 42.447 42.447 42.208 0.239 25324 718 1 . 1 1 132 132 LEU H H 132 8.527 8.527 8.700 -0.173 25324 stop_ save_