data_19554 save_entry_information _Entry.Sf_category entry_information _Entry.NMR_STAR_version 3.0.9.13 _Entry.Entry_ID 19554 _Entry.PDB_ID 2MFL 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 19554 _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 89 89 ALA HA H 89 4.160 4.160 3.241 0.919 19554 2 1 1 . 1 1 89 89 ALA C C 89 179.720 179.720 178.827 0.893 19554 3 1 1 . 1 1 89 89 ALA CA C 89 54.490 54.490 53.750 0.740 19554 4 1 1 . 1 1 89 89 ALA CB C 89 18.220 18.220 17.935 0.285 19554 5 1 1 . 1 1 90 90 LYS N N 90 119.500 119.500 117.016 2.484 19554 6 1 1 . 1 1 90 90 LYS C C 90 179.090 179.090 178.497 0.593 19554 7 1 1 . 1 1 90 90 LYS H H 90 7.980 7.980 8.349 -0.369 19554 8 1 1 . 1 1 91 91 ARG N N 91 120.510 120.510 118.809 1.701 19554 9 1 1 . 1 1 91 91 ARG HA H 91 4.150 4.150 3.947 0.203 19554 10 1 1 . 1 1 91 91 ARG CA C 91 58.300 58.300 58.543 -0.243 19554 11 1 1 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.987 0.033 19554 12 1 1 . 1 1 91 91 ARG H H 91 8.010 8.010 7.276 0.734 19554 13 1 1 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.846 1.274 19554 14 1 1 . 1 1 92 92 HIS C C 92 177.360 177.360 176.545 0.815 19554 15 1 1 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.226 0.644 19554 16 1 1 . 1 1 93 93 GLU N N 93 118.470 118.470 117.263 1.207 19554 17 1 1 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.244 -0.344 19554 18 1 1 . 1 1 93 93 GLU C C 93 178.740 178.740 177.946 0.794 19554 19 1 1 . 1 1 93 93 GLU CA C 93 59.160 59.160 57.679 1.481 19554 20 1 1 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.958 -0.998 19554 21 1 1 . 1 1 93 93 GLU H H 93 8.190 8.190 7.667 0.523 19554 22 1 1 . 1 1 94 94 ALA N N 94 123.080 123.080 123.633 -0.553 19554 23 1 1 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.242 -0.172 19554 24 1 1 . 1 1 94 94 ALA C C 94 180.330 180.330 179.393 0.937 19554 25 1 1 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.327 0.613 19554 26 1 1 . 1 1 94 94 ALA CB C 94 18.250 18.250 18.418 -0.168 19554 27 1 1 . 1 1 94 94 ALA H H 94 8.090 8.090 7.362 0.728 19554 28 1 1 . 1 1 95 95 TRP N N 95 119.190 119.190 119.046 0.144 19554 29 1 1 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.514 -0.474 19554 30 1 1 . 1 1 95 95 TRP C C 95 178.590 178.590 178.653 -0.063 19554 31 1 1 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.749 2.251 19554 32 1 1 . 1 1 95 95 TRP CB C 95 29.160 29.160 28.194 0.966 19554 33 1 1 . 1 1 95 95 TRP H H 95 8.060 8.060 8.054 0.006 19554 34 1 1 . 1 1 96 96 ILE N N 96 119.570 119.570 119.546 0.024 19554 35 1 1 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.777 0.033 19554 36 1 1 . 1 1 96 96 ILE C C 96 179.300 179.300 177.439 1.861 19554 37 1 1 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.765 -0.225 19554 38 1 1 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.344 -0.214 19554 39 1 1 . 1 1 96 96 ILE H H 96 7.850 7.850 7.561 0.289 19554 40 1 1 . 1 1 97 97 THR N N 97 117.030 117.030 114.411 2.619 19554 41 1 1 . 1 1 97 97 THR HA H 97 3.830 3.830 4.223 -0.393 19554 42 1 1 . 1 1 97 97 THR C C 97 177.080 177.080 176.634 0.446 19554 43 1 1 . 1 1 97 97 THR CA C 97 66.430 66.430 65.147 1.283 19554 44 1 1 . 1 1 97 97 THR CB C 97 68.450 68.450 68.881 -0.431 19554 45 1 1 . 1 1 97 97 THR H H 97 7.900 7.900 7.958 -0.058 19554 46 1 1 . 1 1 98 98 LEU N N 98 123.110 123.110 122.497 0.613 19554 47 1 1 . 1 1 98 98 LEU HA H 98 3.930 3.930 3.815 0.115 19554 48 1 1 . 1 1 98 98 LEU C C 98 178.160 178.160 177.685 0.475 19554 49 1 1 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.362 0.368 19554 50 1 1 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.004 0.536 19554 51 1 1 . 1 1 98 98 LEU H H 98 7.830 7.830 8.017 -0.187 19554 52 1 1 . 1 1 99 99 GLU N N 99 120.520 120.520 120.204 0.316 19554 53 1 1 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.132 -0.252 19554 54 1 1 . 1 1 99 99 GLU C C 99 179.010 179.010 178.941 0.069 19554 55 1 1 . 1 1 99 99 GLU CA C 99 59.920 59.920 60.003 -0.083 19554 56 1 1 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.409 -0.059 19554 57 1 1 . 1 1 99 99 GLU H H 99 8.560 8.560 8.019 0.541 19554 58 1 1 . 1 1 100 100 LYS N N 100 119.950 119.950 117.906 2.044 19554 59 1 1 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.092 -0.062 19554 60 1 1 . 1 1 100 100 LYS C C 100 177.870 177.870 178.255 -0.385 19554 61 1 1 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.601 -0.031 19554 62 1 1 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.028 -0.308 19554 63 1 1 . 1 1 100 100 LYS H H 100 7.800 7.800 7.738 0.062 19554 64 1 1 . 1 1 101 101 ALA N N 101 120.690 120.690 122.684 -1.994 19554 65 1 1 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.055 -0.035 19554 66 1 1 . 1 1 101 101 ALA C C 101 180.990 180.990 179.612 1.378 19554 67 1 1 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.496 0.624 19554 68 1 1 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.029 -0.449 19554 69 1 1 . 1 1 101 101 ALA H H 101 7.800 7.800 7.319 0.481 19554 70 1 1 . 1 1 102 102 TYR N N 102 118.440 118.440 117.910 0.530 19554 71 1 1 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.178 0.142 19554 72 1 1 . 1 1 102 102 TYR C C 102 178.590 178.590 178.888 -0.298 19554 73 1 1 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.258 -0.448 19554 74 1 1 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.057 1.633 19554 75 1 1 . 1 1 102 102 TYR H H 102 8.580 8.580 7.802 0.778 19554 76 1 1 . 1 1 103 103 GLU N N 103 120.860 120.860 120.367 0.493 19554 77 1 1 . 1 1 103 103 GLU HA H 103 3.590 3.590 4.062 -0.472 19554 78 1 1 . 1 1 103 103 GLU C C 103 178.100 178.100 177.309 0.791 19554 79 1 1 . 1 1 103 103 GLU CA C 103 59.080 59.080 59.140 -0.060 19554 80 1 1 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.514 -0.094 19554 81 1 1 . 1 1 103 103 GLU H H 103 8.290 8.290 7.754 0.536 19554 82 1 1 . 1 1 104 104 ASP N N 104 116.120 116.120 116.856 -0.736 19554 83 1 1 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.710 -0.100 19554 84 1 1 . 1 1 104 104 ASP C C 104 174.970 174.970 174.770 0.200 19554 85 1 1 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.236 0.884 19554 86 1 1 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.920 -0.440 19554 87 1 1 . 1 1 104 104 ASP H H 104 8.120 8.120 7.678 0.442 19554 88 1 1 . 1 1 105 105 ALA N N 105 123.330 123.330 120.344 2.986 19554 89 1 1 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.076 0.074 19554 90 1 1 . 1 1 105 105 ALA C C 105 177.130 177.130 176.992 0.138 19554 91 1 1 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.892 -0.252 19554 92 1 1 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.880 -0.580 19554 93 1 1 . 1 1 105 105 ALA H H 105 7.710 7.710 7.723 -0.013 19554 94 1 1 . 1 1 106 106 GLU N N 106 118.950 118.950 119.745 -0.795 19554 95 1 1 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.211 0.089 19554 96 1 1 . 1 1 106 106 GLU C C 106 176.730 176.730 176.661 0.069 19554 97 1 1 . 1 1 106 106 GLU CA C 106 55.440 55.440 56.140 -0.700 19554 98 1 1 . 1 1 106 106 GLU CB C 106 31.760 31.760 30.629 1.131 19554 99 1 1 . 1 1 106 106 GLU H H 106 8.440 8.440 7.939 0.501 19554 100 1 1 . 1 1 107 107 THR N N 107 118.780 118.780 118.852 -0.072 19554 101 1 1 . 1 1 107 107 THR HA H 107 4.550 4.550 4.379 0.171 19554 102 1 1 . 1 1 107 107 THR C C 107 174.250 174.250 174.338 -0.088 19554 103 1 1 . 1 1 107 107 THR CA C 107 62.360 62.360 61.722 0.638 19554 104 1 1 . 1 1 107 107 THR CB C 107 69.390 69.390 69.100 0.290 19554 105 1 1 . 1 1 107 107 THR H H 107 8.740 8.740 8.283 0.457 19554 106 1 1 . 1 1 108 108 VAL N N 108 120.540 120.540 122.256 -1.716 19554 107 1 1 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.657 -0.027 19554 108 1 1 . 1 1 108 108 VAL C C 108 174.440 174.440 173.883 0.557 19554 109 1 1 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.135 -0.135 19554 110 1 1 . 1 1 108 108 VAL CB C 108 34.650 34.650 35.109 -0.459 19554 111 1 1 . 1 1 108 108 VAL H H 108 9.040 9.040 8.289 0.751 19554 112 1 1 . 1 1 109 109 THR N N 109 115.100 115.100 114.875 0.225 19554 113 1 1 . 1 1 109 109 THR HA H 109 5.380 5.380 4.619 0.761 19554 114 1 1 . 1 1 109 109 THR C C 109 174.580 174.580 173.797 0.783 19554 115 1 1 . 1 1 109 109 THR CA C 109 60.410 60.410 62.145 -1.735 19554 116 1 1 . 1 1 109 109 THR CB C 109 70.610 70.610 69.838 0.772 19554 117 1 1 . 1 1 109 109 THR H H 109 8.170 8.170 8.402 -0.232 19554 118 1 1 . 1 1 110 110 GLY N N 110 108.580 108.580 114.026 -5.446 19554 119 1 1 . 1 1 110 110 GLY C C 110 170.810 170.810 171.389 -0.579 19554 120 1 1 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.318 0.062 19554 121 1 1 . 1 1 110 110 GLY H H 110 8.780 8.780 8.165 0.615 19554 122 1 1 . 1 1 111 111 VAL N N 111 116.930 116.930 118.962 -2.032 19554 123 1 1 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.907 -0.127 19554 124 1 1 . 1 1 111 111 VAL C C 111 176.060 176.060 174.862 1.198 19554 125 1 1 . 1 1 111 111 VAL CA C 111 59.770 59.770 58.762 1.008 19554 126 1 1 . 1 1 111 111 VAL CB C 111 35.750 35.750 35.242 0.508 19554 127 1 1 . 1 1 111 111 VAL H H 111 7.810 7.810 8.032 -0.222 19554 128 1 1 . 1 1 112 112 ILE N N 112 127.060 127.060 127.915 -0.855 19554 129 1 1 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.180 0.050 19554 130 1 1 . 1 1 112 112 ILE C C 112 176.180 176.180 175.318 0.862 19554 131 1 1 . 1 1 112 112 ILE CA C 112 62.220 62.220 63.109 -0.889 19554 132 1 1 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.875 0.605 19554 133 1 1 . 1 1 112 112 ILE H H 112 9.240 9.240 7.950 1.290 19554 134 1 1 . 1 1 113 113 ASN N N 113 127.510 127.510 126.388 1.122 19554 135 1 1 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.852 0.088 19554 136 1 1 . 1 1 113 113 ASN C C 113 175.020 175.020 175.377 -0.357 19554 137 1 1 . 1 1 113 113 ASN CA C 113 52.290 52.290 54.065 -1.775 19554 138 1 1 . 1 1 113 113 ASN CB C 113 39.580 39.580 39.832 -0.252 19554 139 1 1 . 1 1 113 113 ASN H H 113 9.010 9.010 8.319 0.691 19554 140 1 1 . 1 1 114 114 GLY N N 114 107.150 107.150 107.909 -0.759 19554 141 1 1 . 1 1 114 114 GLY C C 114 171.360 171.360 172.178 -0.818 19554 142 1 1 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.390 1.130 19554 143 1 1 . 1 1 114 114 GLY H H 114 7.620 7.620 7.624 -0.004 19554 144 1 1 . 1 1 115 115 LYS N N 115 121.670 121.670 122.657 -0.987 19554 145 1 1 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.420 0.170 19554 146 1 1 . 1 1 115 115 LYS C C 115 175.950 175.950 175.258 0.692 19554 147 1 1 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.843 1.097 19554 148 1 1 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.154 -0.114 19554 149 1 1 . 1 1 115 115 LYS H H 115 8.550 8.550 8.314 0.236 19554 150 1 1 . 1 1 116 116 VAL N N 116 118.750 118.750 117.770 0.980 19554 151 1 1 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.471 -0.001 19554 152 1 1 . 1 1 116 116 VAL C C 116 175.110 175.110 175.453 -0.343 19554 153 1 1 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.421 -0.391 19554 154 1 1 . 1 1 116 116 VAL CB C 116 35.500 35.500 34.267 1.232 19554 155 1 1 . 1 1 116 116 VAL H H 116 8.070 8.070 7.816 0.254 19554 156 1 1 . 1 1 117 117 LYS N N 117 122.520 122.520 121.840 0.680 19554 157 1 1 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.004 -0.074 19554 158 1 1 . 1 1 117 117 LYS C C 117 177.970 177.970 176.984 0.986 19554 159 1 1 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.165 1.505 19554 160 1 1 . 1 1 117 117 LYS CB C 117 30.940 30.940 30.925 0.015 19554 161 1 1 . 1 1 117 117 LYS H H 117 8.250 8.250 8.528 -0.278 19554 162 1 1 . 1 1 118 118 GLY N N 118 113.440 113.440 111.673 1.767 19554 163 1 1 . 1 1 118 118 GLY C C 118 175.540 175.540 173.932 1.608 19554 164 1 1 . 1 1 118 118 GLY CA C 118 45.200 45.200 44.997 0.203 19554 165 1 1 . 1 1 118 118 GLY H H 118 8.820 8.820 7.979 0.841 19554 166 1 1 . 1 1 119 119 GLY N N 119 109.130 109.130 106.781 2.349 19554 167 1 1 . 1 1 119 119 GLY C C 119 170.530 170.530 172.015 -1.485 19554 168 1 1 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.477 3.363 19554 169 1 1 . 1 1 119 119 GLY H H 119 7.930 7.930 7.536 0.394 19554 170 1 1 . 1 1 120 120 PHE N N 120 123.370 123.370 117.620 5.750 19554 171 1 1 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.593 0.677 19554 172 1 1 . 1 1 120 120 PHE C C 120 174.260 174.260 174.602 -0.342 19554 173 1 1 . 1 1 120 120 PHE CA C 120 56.340 56.340 56.918 -0.578 19554 174 1 1 . 1 1 120 120 PHE CB C 120 43.730 43.730 42.899 0.831 19554 175 1 1 . 1 1 120 120 PHE H H 120 8.820 8.820 7.221 1.599 19554 176 1 1 . 1 1 121 121 THR N N 121 114.670 114.670 120.430 -5.760 19554 177 1 1 . 1 1 121 121 THR HA H 121 5.000 5.000 5.011 -0.011 19554 178 1 1 . 1 1 121 121 THR C C 121 173.780 173.780 173.885 -0.105 19554 179 1 1 . 1 1 121 121 THR CA C 121 60.500 60.500 61.376 -0.876 19554 180 1 1 . 1 1 121 121 THR CB C 121 69.910 69.910 69.435 0.475 19554 181 1 1 . 1 1 121 121 THR H H 121 8.670 8.670 8.881 -0.211 19554 182 1 1 . 1 1 122 122 VAL N N 122 124.340 124.340 123.331 1.009 19554 183 1 1 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.508 0.092 19554 184 1 1 . 1 1 122 122 VAL C C 122 174.240 174.240 174.359 -0.119 19554 185 1 1 . 1 1 122 122 VAL CA C 122 59.300 59.300 59.780 -0.480 19554 186 1 1 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.139 0.721 19554 187 1 1 . 1 1 122 122 VAL H H 122 8.560 8.560 7.968 0.592 19554 188 1 1 . 1 1 123 123 GLU N N 123 126.950 126.950 126.872 0.078 19554 189 1 1 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.958 -0.348 19554 190 1 1 . 1 1 123 123 GLU C C 123 175.840 175.840 175.486 0.354 19554 191 1 1 . 1 1 123 123 GLU CA C 123 55.160 55.160 55.313 -0.153 19554 192 1 1 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.662 0.248 19554 193 1 1 . 1 1 123 123 GLU H H 123 8.950 8.950 8.341 0.609 19554 194 1 1 . 1 1 124 124 LEU N N 124 129.580 129.580 128.638 0.942 19554 195 1 1 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.830 -0.170 19554 196 1 1 . 1 1 124 124 LEU C C 124 175.350 175.350 176.229 -0.879 19554 197 1 1 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.745 -0.545 19554 198 1 1 . 1 1 124 124 LEU CB C 124 42.190 42.190 42.241 -0.051 19554 199 1 1 . 1 1 124 124 LEU H H 124 8.940 8.940 8.984 -0.044 19554 200 1 1 . 1 1 125 125 ASN N N 125 121.880 121.880 120.546 1.334 19554 201 1 1 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.397 -0.207 19554 202 1 1 . 1 1 125 125 ASN C C 125 174.690 174.690 175.581 -0.891 19554 203 1 1 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.064 -0.184 19554 204 1 1 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.094 0.156 19554 205 1 1 . 1 1 125 125 ASN H H 125 8.950 8.950 9.409 -0.459 19554 206 1 1 . 1 1 126 126 GLY N N 126 103.140 103.140 101.931 1.209 19554 207 1 1 . 1 1 126 126 GLY C C 126 173.680 173.680 173.676 0.004 19554 208 1 1 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.311 -0.431 19554 209 1 1 . 1 1 126 126 GLY H H 126 8.070 8.070 8.281 -0.211 19554 210 1 1 . 1 1 127 127 ILE N N 127 122.120 122.120 122.591 -0.471 19554 211 1 1 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.890 0.080 19554 212 1 1 . 1 1 127 127 ILE C C 127 174.370 174.370 174.807 -0.437 19554 213 1 1 . 1 1 127 127 ILE CA C 127 59.530 59.530 61.059 -1.529 19554 214 1 1 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.126 0.844 19554 215 1 1 . 1 1 127 127 ILE H H 127 7.380 7.380 7.435 -0.055 19554 216 1 1 . 1 1 128 128 ARG N N 128 126.630 126.630 124.125 2.505 19554 217 1 1 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.008 -0.368 19554 218 1 1 . 1 1 128 128 ARG C C 128 174.720 174.720 175.229 -0.509 19554 219 1 1 . 1 1 128 128 ARG CA C 128 55.650 55.650 55.038 0.612 19554 220 1 1 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.015 -0.015 19554 221 1 1 . 1 1 128 128 ARG H H 128 8.170 8.170 8.665 -0.495 19554 222 1 1 . 1 1 129 129 ALA N N 129 127.320 127.320 126.420 0.900 19554 223 1 1 . 1 1 129 129 ALA HA H 129 4.850 4.850 5.130 -0.280 19554 224 1 1 . 1 1 129 129 ALA C C 129 174.970 174.970 175.529 -0.559 19554 225 1 1 . 1 1 129 129 ALA CA C 129 49.660 49.660 49.442 0.218 19554 226 1 1 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.716 2.674 19554 227 1 1 . 1 1 129 129 ALA H H 129 9.240 9.240 8.694 0.545 19554 228 1 1 . 1 1 130 130 PHE N N 130 121.060 121.060 118.222 2.838 19554 229 1 1 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.103 0.057 19554 230 1 1 . 1 1 130 130 PHE C C 130 172.430 172.430 173.545 -1.115 19554 231 1 1 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.081 -2.081 19554 232 1 1 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.666 -0.266 19554 233 1 1 . 1 1 130 130 PHE H H 130 8.660 8.660 8.367 0.293 19554 234 1 1 . 1 1 131 131 LEU N N 131 130.250 130.250 127.344 2.906 19554 235 1 1 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.908 0.072 19554 236 1 1 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.678 -2.008 19554 237 1 1 . 1 1 131 131 LEU CB C 131 44.330 44.330 44.019 0.311 19554 238 1 1 . 1 1 131 131 LEU H H 131 8.550 8.550 8.240 0.310 19554 239 1 1 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.616 -0.616 19554 240 1 1 . 1 1 132 132 PRO C C 132 179.380 179.380 178.040 1.340 19554 241 1 1 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.941 -0.781 19554 242 1 1 . 1 1 133 133 GLY N N 133 111.470 111.470 111.226 0.244 19554 243 1 1 . 1 1 133 133 GLY C C 133 175.590 175.590 176.752 -1.162 19554 244 1 1 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.614 0.916 19554 245 1 1 . 1 1 133 133 GLY H H 133 9.140 9.140 8.869 0.271 19554 246 1 1 . 1 1 134 134 SER HA H 134 4.350 4.350 4.273 0.077 19554 247 1 1 . 1 1 134 134 SER C C 134 175.280 175.280 174.649 0.631 19554 248 1 1 . 1 1 134 134 SER CA C 134 59.210 59.210 60.485 -1.275 19554 249 1 1 . 1 1 134 134 SER CB C 134 62.730 62.730 63.281 -0.551 19554 250 1 1 . 1 1 135 135 LEU N N 135 118.770 118.770 120.176 -1.406 19554 251 1 1 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.525 0.055 19554 252 1 1 . 1 1 135 135 LEU C C 135 177.500 177.500 175.756 1.744 19554 253 1 1 . 1 1 135 135 LEU CA C 135 53.770 53.770 54.869 -1.099 19554 254 1 1 . 1 1 135 135 LEU H H 135 8.030 8.030 7.645 0.385 19554 255 1 1 . 1 1 136 136 VAL N N 136 123.080 123.080 119.969 3.111 19554 256 1 1 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.216 -0.606 19554 257 1 1 . 1 1 136 136 VAL C C 136 173.150 173.150 175.652 -2.502 19554 258 1 1 . 1 1 136 136 VAL CA C 136 65.220 65.220 63.868 1.352 19554 259 1 1 . 1 1 136 136 VAL CB C 136 32.020 32.020 34.133 -2.113 19554 260 1 1 . 1 1 136 136 VAL H H 136 7.550 7.550 7.800 -0.250 19554 261 1 1 . 1 1 137 137 ASP N N 137 117.300 117.300 121.962 -4.662 19554 262 1 1 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.905 -0.565 19554 263 1 1 . 1 1 137 137 ASP C C 137 174.840 174.840 174.972 -0.132 19554 264 1 1 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.950 -1.880 19554 265 1 1 . 1 1 137 137 ASP CB C 137 44.460 44.460 42.424 2.036 19554 266 1 1 . 1 1 137 137 ASP H H 137 7.940 7.940 7.897 0.043 19554 267 1 1 . 1 1 138 138 VAL N N 138 116.750 116.750 122.575 -5.825 19554 268 1 1 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.228 -0.088 19554 269 1 1 . 1 1 138 138 VAL CA C 138 61.190 61.190 62.114 -0.924 19554 270 1 1 . 1 1 138 138 VAL CB C 138 33.330 33.330 33.240 0.090 19554 271 1 1 . 1 1 138 138 VAL H H 138 10.000 10.000 8.486 1.514 19554 272 1 1 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.502 0.008 19554 273 1 1 . 1 1 140 140 PRO C C 140 175.860 175.860 176.473 -0.613 19554 274 1 1 . 1 1 141 141 VAL N N 141 124.910 124.910 122.424 2.486 19554 275 1 1 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.132 -0.232 19554 276 1 1 . 1 1 141 141 VAL C C 141 175.120 175.120 175.219 -0.099 19554 277 1 1 . 1 1 141 141 VAL CA C 141 62.720 62.720 62.670 0.050 19554 278 1 1 . 1 1 141 141 VAL CB C 141 31.870 31.870 32.732 -0.862 19554 279 1 1 . 1 1 141 141 VAL H H 141 8.110 8.110 8.623 -0.513 19554 280 1 1 . 1 1 142 142 ARG N N 142 119.730 119.730 120.322 -0.592 19554 281 1 1 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.548 0.072 19554 282 1 1 . 1 1 142 142 ARG C C 142 173.520 173.520 175.065 -1.545 19554 283 1 1 . 1 1 142 142 ARG CA C 142 53.020 53.020 54.625 -1.605 19554 284 1 1 . 1 1 142 142 ARG CB C 142 30.480 30.480 31.140 -0.660 19554 285 1 1 . 1 1 142 142 ARG H H 142 7.440 7.440 7.804 -0.364 19554 286 1 1 . 1 1 143 143 ASP N N 143 119.780 119.780 120.329 -0.549 19554 287 1 1 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.488 0.182 19554 288 1 1 . 1 1 143 143 ASP C C 143 175.970 175.970 175.992 -0.022 19554 289 1 1 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.782 -0.752 19554 290 1 1 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.207 0.523 19554 291 1 1 . 1 1 143 143 ASP H H 143 7.880 7.880 8.289 -0.409 19554 292 1 1 . 1 1 144 144 THR N N 144 110.060 110.060 116.689 -6.629 19554 293 1 1 . 1 1 144 144 THR HA H 144 4.110 4.110 4.021 0.089 19554 294 1 1 . 1 1 144 144 THR C C 144 175.730 175.730 175.333 0.397 19554 295 1 1 . 1 1 144 144 THR CA C 144 61.520 61.520 60.840 0.680 19554 296 1 1 . 1 1 144 144 THR CB C 144 68.610 68.610 68.884 -0.274 19554 297 1 1 . 1 1 144 144 THR H H 144 8.030 8.030 8.166 -0.136 19554 298 1 1 . 1 1 145 145 LEU N N 145 124.820 124.820 123.024 1.796 19554 299 1 1 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.356 0.344 19554 300 1 1 . 1 1 145 145 LEU C C 145 178.010 178.010 177.571 0.439 19554 301 1 1 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.128 1.222 19554 302 1 1 . 1 1 145 145 LEU CB C 145 42.100 42.100 41.276 0.824 19554 303 1 1 . 1 1 145 145 LEU H H 145 8.050 8.050 7.901 0.149 19554 304 1 1 . 1 1 146 146 HIS N N 146 116.310 116.310 114.877 1.433 19554 305 1 1 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.412 0.128 19554 306 1 1 . 1 1 146 146 HIS C C 146 175.000 175.000 176.238 -1.238 19554 307 1 1 . 1 1 146 146 HIS H H 146 8.120 8.120 8.012 0.108 19554 308 1 1 . 1 1 147 147 LEU N N 147 120.320 120.320 119.140 1.180 19554 309 1 1 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.871 0.199 19554 310 1 1 . 1 1 147 147 LEU C C 147 176.810 176.810 176.781 0.029 19554 311 1 1 . 1 1 147 147 LEU CA C 147 54.710 54.710 56.431 -1.720 19554 312 1 1 . 1 1 147 147 LEU CB C 147 41.960 41.960 42.137 -0.177 19554 313 1 1 . 1 1 147 147 LEU H H 147 7.620 7.620 7.652 -0.032 19554 314 1 1 . 1 1 148 148 GLU N N 148 118.950 118.950 116.448 2.502 19554 315 1 1 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.421 -0.641 19554 316 1 1 . 1 1 148 148 GLU C C 148 177.480 177.480 176.512 0.968 19554 317 1 1 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.533 2.897 19554 318 1 1 . 1 1 148 148 GLU CB C 148 29.680 29.680 30.926 -1.246 19554 319 1 1 . 1 1 148 148 GLU H H 148 7.760 7.760 7.420 0.340 19554 320 1 1 . 1 1 149 149 GLY N N 149 111.070 111.070 109.611 1.459 19554 321 1 1 . 1 1 149 149 GLY C C 149 173.820 173.820 174.331 -0.511 19554 322 1 1 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.317 0.213 19554 323 1 1 . 1 1 149 149 GLY H H 149 8.630 8.630 8.518 0.112 19554 324 1 1 . 1 1 150 150 LYS N N 150 119.380 119.380 122.062 -2.682 19554 325 1 1 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.172 0.158 19554 326 1 1 . 1 1 150 150 LYS C C 150 175.110 175.110 175.452 -0.342 19554 327 1 1 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.719 -1.549 19554 328 1 1 . 1 1 150 150 LYS CB C 150 33.550 33.550 32.998 0.552 19554 329 1 1 . 1 1 150 150 LYS H H 150 7.520 7.520 7.965 -0.445 19554 330 1 1 . 1 1 151 151 GLU N N 151 122.850 122.850 126.948 -4.098 19554 331 1 1 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.516 -0.046 19554 332 1 1 . 1 1 151 151 GLU C C 151 175.510 175.510 174.952 0.558 19554 333 1 1 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.381 0.959 19554 334 1 1 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.630 0.380 19554 335 1 1 . 1 1 151 151 GLU H H 151 8.410 8.410 8.571 -0.161 19554 336 1 1 . 1 1 152 152 LEU N N 152 127.520 127.520 122.442 5.078 19554 337 1 1 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.644 -0.104 19554 338 1 1 . 1 1 152 152 LEU C C 152 173.750 173.750 175.244 -1.494 19554 339 1 1 . 1 1 152 152 LEU CA C 152 52.820 52.820 52.336 0.484 19554 340 1 1 . 1 1 152 152 LEU H H 152 8.850 8.850 7.765 1.085 19554 341 1 1 . 1 1 153 153 GLU N N 153 116.500 116.500 118.821 -2.321 19554 342 1 1 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.198 0.382 19554 343 1 1 . 1 1 153 153 GLU C C 153 175.120 175.120 174.395 0.725 19554 344 1 1 . 1 1 153 153 GLU CA C 153 55.160 55.160 56.020 -0.860 19554 345 1 1 . 1 1 153 153 GLU H H 153 7.110 7.110 8.314 -1.204 19554 346 1 1 . 1 1 154 154 PHE N N 154 115.150 115.150 116.331 -1.181 19554 347 1 1 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.880 -0.020 19554 348 1 1 . 1 1 154 154 PHE C C 154 175.630 175.630 174.312 1.318 19554 349 1 1 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.737 0.453 19554 350 1 1 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.901 1.349 19554 351 1 1 . 1 1 154 154 PHE H H 154 8.910 8.910 7.847 1.063 19554 352 1 1 . 1 1 155 155 LYS N N 155 114.560 114.560 121.764 -7.204 19554 353 1 1 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.649 0.061 19554 354 1 1 . 1 1 155 155 LYS C C 155 176.500 176.500 175.401 1.099 19554 355 1 1 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.668 -2.068 19554 356 1 1 . 1 1 155 155 LYS CB C 155 33.960 33.960 34.495 -0.535 19554 357 1 1 . 1 1 155 155 LYS H H 155 8.100 8.100 8.685 -0.585 19554 358 1 1 . 1 1 156 156 VAL N N 156 124.530 124.530 127.009 -2.479 19554 359 1 1 . 1 1 156 156 VAL C C 156 175.630 175.630 175.895 -0.265 19554 360 1 1 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.760 -1.070 19554 361 1 1 . 1 1 156 156 VAL CB C 156 31.600 31.600 32.236 -0.636 19554 362 1 1 . 1 1 156 156 VAL H H 156 9.920 9.920 8.543 1.377 19554 363 1 1 . 1 1 157 157 ILE N N 157 119.590 119.590 128.144 -8.554 19554 364 1 1 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.359 0.361 19554 365 1 1 . 1 1 157 157 ILE C C 157 176.190 176.190 175.210 0.980 19554 366 1 1 . 1 1 157 157 ILE CA C 157 61.050 61.050 60.572 0.478 19554 367 1 1 . 1 1 157 157 ILE CB C 157 39.170 39.170 39.497 -0.327 19554 368 1 1 . 1 1 157 157 ILE H H 157 8.530 8.530 8.493 0.037 19554 369 1 1 . 1 1 158 158 LYS N N 158 122.460 122.460 119.746 2.714 19554 370 1 1 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.440 -0.240 19554 371 1 1 . 1 1 158 158 LYS C C 158 173.000 173.000 174.324 -1.324 19554 372 1 1 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.218 0.582 19554 373 1 1 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.702 0.938 19554 374 1 1 . 1 1 158 158 LYS H H 158 7.600 7.600 7.771 -0.171 19554 375 1 1 . 1 1 159 159 LEU N N 159 125.430 125.430 121.577 3.853 19554 376 1 1 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.652 -0.032 19554 377 1 1 . 1 1 159 159 LEU C C 159 174.390 174.390 175.448 -1.058 19554 378 1 1 . 1 1 159 159 LEU CA C 159 54.510 54.510 53.851 0.659 19554 379 1 1 . 1 1 159 159 LEU H H 159 7.950 7.950 8.244 -0.294 19554 380 1 1 . 1 1 160 160 ASP N N 160 124.740 124.740 122.845 1.895 19554 381 1 1 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.824 -0.154 19554 382 1 1 . 1 1 160 160 ASP C C 160 176.020 176.020 176.180 -0.160 19554 383 1 1 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.241 -0.621 19554 384 1 1 . 1 1 160 160 ASP CB C 160 42.050 42.050 40.979 1.071 19554 385 1 1 . 1 1 160 160 ASP H H 160 8.760 8.760 8.358 0.402 19554 386 1 1 . 1 1 161 161 GLN N N 161 126.490 126.490 121.825 4.665 19554 387 1 1 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.022 -0.902 19554 388 1 1 . 1 1 161 161 GLN C C 161 178.280 178.280 177.766 0.514 19554 389 1 1 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.495 0.275 19554 390 1 1 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.829 -0.989 19554 391 1 1 . 1 1 161 161 GLN H H 161 9.110 9.110 8.507 0.603 19554 392 1 1 . 1 1 162 162 LYS N N 162 119.150 119.150 120.767 -1.617 19554 393 1 1 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.054 -0.254 19554 394 1 1 . 1 1 162 162 LYS C C 162 177.900 177.900 177.658 0.242 19554 395 1 1 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.832 -0.132 19554 396 1 1 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.090 -0.700 19554 397 1 1 . 1 1 162 162 LYS H H 162 8.070 8.070 8.322 -0.252 19554 398 1 1 . 1 1 163 163 ARG N N 163 114.850 114.850 117.419 -2.569 19554 399 1 1 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.492 -0.342 19554 400 1 1 . 1 1 163 163 ARG C C 163 174.750 174.750 175.298 -0.548 19554 401 1 1 . 1 1 163 163 ARG CA C 163 54.800 54.800 54.953 -0.152 19554 402 1 1 . 1 1 163 163 ARG H H 163 7.010 7.010 7.628 -0.618 19554 403 1 1 . 1 1 164 164 ASN N N 164 117.810 117.810 116.116 1.694 19554 404 1 1 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.336 -0.206 19554 405 1 1 . 1 1 164 164 ASN C C 164 173.880 173.880 174.111 -0.231 19554 406 1 1 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.202 -0.242 19554 407 1 1 . 1 1 164 164 ASN CB C 164 37.530 37.530 36.165 1.365 19554 408 1 1 . 1 1 164 164 ASN H H 164 7.750 7.750 8.232 -0.482 19554 409 1 1 . 1 1 165 165 ASN N N 165 116.170 116.170 115.537 0.633 19554 410 1 1 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.901 0.159 19554 411 1 1 . 1 1 165 165 ASN C C 165 172.990 172.990 173.164 -0.174 19554 412 1 1 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.566 -0.126 19554 413 1 1 . 1 1 165 165 ASN CB C 165 41.820 41.820 42.246 -0.426 19554 414 1 1 . 1 1 165 165 ASN H H 165 8.020 8.020 7.464 0.556 19554 415 1 1 . 1 1 166 166 VAL N N 166 124.790 124.790 115.529 9.261 19554 416 1 1 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.776 -0.276 19554 417 1 1 . 1 1 166 166 VAL C C 166 174.190 174.190 174.210 -0.020 19554 418 1 1 . 1 1 166 166 VAL CA C 166 61.030 61.030 59.776 1.254 19554 419 1 1 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.384 0.236 19554 420 1 1 . 1 1 166 166 VAL H H 166 8.380 8.380 7.774 0.606 19554 421 1 1 . 1 1 167 167 VAL N N 167 128.000 128.000 119.378 8.622 19554 422 1 1 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.539 0.711 19554 423 1 1 . 1 1 167 167 VAL C C 167 176.000 176.000 174.265 1.735 19554 424 1 1 . 1 1 167 167 VAL CA C 167 60.610 60.610 60.433 0.177 19554 425 1 1 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.042 -0.142 19554 426 1 1 . 1 1 167 167 VAL H H 167 8.710 8.710 7.967 0.743 19554 427 1 1 . 1 1 168 168 VAL N N 168 118.360 118.360 117.764 0.596 19554 428 1 1 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.371 0.869 19554 429 1 1 . 1 1 168 168 VAL C C 168 172.800 172.800 175.949 -3.149 19554 430 1 1 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.949 -2.088 19554 431 1 1 . 1 1 168 168 VAL CB C 168 35.350 35.350 34.029 1.321 19554 432 1 1 . 1 1 168 168 VAL H H 168 8.560 8.560 8.291 0.269 19554 433 1 1 . 1 1 169 169 SER N N 169 106.720 106.720 119.116 -12.396 19554 434 1 1 . 1 1 169 169 SER HA H 169 4.480 4.480 4.451 0.029 19554 435 1 1 . 1 1 169 169 SER C C 169 175.950 175.950 174.726 1.224 19554 436 1 1 . 1 1 169 169 SER CA C 169 55.550 55.550 58.394 -2.844 19554 437 1 1 . 1 1 169 169 SER CB C 169 64.980 64.980 64.566 0.414 19554 438 1 1 . 1 1 169 169 SER H H 169 8.600 8.600 8.311 0.289 19554 439 1 1 . 1 1 170 170 ARG N N 170 129.620 129.620 125.368 4.252 19554 440 1 1 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.282 0.428 19554 441 1 1 . 1 1 170 170 ARG C C 170 177.870 177.870 178.511 -0.641 19554 442 1 1 . 1 1 170 170 ARG CA C 170 57.150 57.150 58.708 -1.558 19554 443 1 1 . 1 1 170 170 ARG H H 170 7.610 7.610 8.761 -1.151 19554 444 1 1 . 1 1 171 171 ARG N N 171 122.230 122.230 119.512 2.718 19554 445 1 1 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.146 -0.676 19554 446 1 1 . 1 1 171 171 ARG C C 171 175.760 175.760 177.861 -2.101 19554 447 1 1 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.722 0.708 19554 448 1 1 . 1 1 171 171 ARG CB C 171 30.410 30.410 29.246 1.164 19554 449 1 1 . 1 1 171 171 ARG H H 171 8.260 8.260 8.564 -0.304 19554 450 1 1 . 1 1 172 172 ALA N N 172 116.490 116.490 122.760 -6.270 19554 451 1 1 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.170 -0.120 19554 452 1 1 . 1 1 172 172 ALA C C 172 179.480 179.480 179.443 0.037 19554 453 1 1 . 1 1 172 172 ALA CA C 172 54.010 54.010 54.238 -0.228 19554 454 1 1 . 1 1 172 172 ALA CB C 172 18.890 18.890 17.961 0.929 19554 455 1 1 . 1 1 172 172 ALA H H 172 7.760 7.760 7.970 -0.210 19554 456 1 1 . 1 1 173 173 VAL N N 173 116.440 116.440 120.351 -3.911 19554 457 1 1 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.676 -0.206 19554 458 1 1 . 1 1 173 173 VAL C C 173 177.680 177.680 177.100 0.580 19554 459 1 1 . 1 1 173 173 VAL CA C 173 65.080 65.080 65.378 -0.298 19554 460 1 1 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.678 0.202 19554 461 1 1 . 1 1 173 173 VAL H H 173 7.210 7.210 8.004 -0.794 19554 462 1 1 . 1 1 174 174 ILE N N 174 119.790 119.790 115.579 4.211 19554 463 1 1 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.696 -0.016 19554 464 1 1 . 1 1 174 174 ILE C C 174 178.310 178.310 177.514 0.796 19554 465 1 1 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.310 -0.540 19554 466 1 1 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.253 1.197 19554 467 1 1 . 1 1 174 174 ILE H H 174 7.160 7.160 7.726 -0.566 19554 468 1 1 . 1 1 175 175 GLU N N 175 117.810 117.810 119.573 -1.763 19554 469 1 1 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.163 -0.133 19554 470 1 1 . 1 1 175 175 GLU C C 175 177.170 177.170 178.547 -1.377 19554 471 1 1 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.007 -0.817 19554 472 1 1 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.722 -0.082 19554 473 1 1 . 1 1 175 175 GLU H H 175 8.250 8.250 8.174 0.076 19554 474 1 1 . 1 1 176 176 SER N N 176 114.300 114.300 115.517 -1.217 19554 475 1 1 . 1 1 176 176 SER HA H 176 4.320 4.320 3.909 0.411 19554 476 1 1 . 1 1 176 176 SER C C 176 174.930 174.930 176.863 -1.933 19554 477 1 1 . 1 1 176 176 SER CA C 176 59.060 59.060 60.841 -1.781 19554 478 1 1 . 1 1 176 176 SER CB C 176 63.640 63.640 63.026 0.614 19554 479 1 1 . 1 1 176 176 SER H H 176 7.460 7.460 7.476 -0.016 19554 480 1 1 . 1 1 177 177 GLU N N 177 121.860 121.860 121.427 0.433 19554 481 1 1 . 1 1 177 177 GLU HA H 177 4.170 4.170 3.901 0.269 19554 482 1 1 . 1 1 177 177 GLU C C 177 176.340 176.340 176.807 -0.467 19554 483 1 1 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.838 -2.198 19554 484 1 1 . 1 1 177 177 GLU CB C 177 29.750 29.750 30.087 -0.338 19554 485 1 1 . 1 1 177 177 GLU H H 177 7.890 7.890 8.238 -0.348 19554 486 1 1 . 1 1 178 178 ASN N N 178 119.030 119.030 114.538 4.492 19554 487 1 1 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.716 -0.016 19554 488 1 1 . 1 1 178 178 ASN C C 178 174.230 174.230 174.131 0.099 19554 489 1 1 . 1 1 178 178 ASN CA C 178 53.010 53.010 52.814 0.196 19554 490 1 1 . 1 1 178 178 ASN CB C 178 39.080 39.080 39.728 -0.648 19554 491 1 1 . 1 1 178 178 ASN H H 178 8.110 8.110 7.477 0.633 19554 492 1 2 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.107 0.053 19554 493 1 2 . 1 1 89 89 ALA C C 89 179.720 179.720 178.908 0.812 19554 494 1 2 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.274 0.216 19554 495 1 2 . 1 1 89 89 ALA CB C 89 18.220 18.220 17.980 0.239 19554 496 1 2 . 1 1 90 90 LYS N N 90 119.500 119.500 118.005 1.495 19554 497 1 2 . 1 1 90 90 LYS C C 90 179.090 179.090 178.874 0.216 19554 498 1 2 . 1 1 90 90 LYS H H 90 7.980 7.980 8.548 -0.568 19554 499 1 2 . 1 1 91 91 ARG N N 91 120.510 120.510 119.593 0.917 19554 500 1 2 . 1 1 91 91 ARG HA H 91 4.150 4.150 4.023 0.127 19554 501 1 2 . 1 1 91 91 ARG CA C 91 58.300 58.300 58.318 -0.018 19554 502 1 2 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.815 0.205 19554 503 1 2 . 1 1 91 91 ARG H H 91 8.010 8.010 7.502 0.508 19554 504 1 2 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.344 1.776 19554 505 1 2 . 1 1 92 92 HIS C C 92 177.360 177.360 176.002 1.358 19554 506 1 2 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.385 0.485 19554 507 1 2 . 1 1 93 93 GLU N N 93 118.470 118.470 117.746 0.724 19554 508 1 2 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.244 -0.344 19554 509 1 2 . 1 1 93 93 GLU C C 93 178.740 178.740 178.355 0.385 19554 510 1 2 . 1 1 93 93 GLU CA C 93 59.160 59.160 58.186 0.974 19554 511 1 2 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.971 -1.011 19554 512 1 2 . 1 1 93 93 GLU H H 93 8.190 8.190 7.641 0.549 19554 513 1 2 . 1 1 94 94 ALA N N 94 123.080 123.080 123.441 -0.361 19554 514 1 2 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.277 -0.207 19554 515 1 2 . 1 1 94 94 ALA C C 94 180.330 180.330 179.946 0.384 19554 516 1 2 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.231 0.709 19554 517 1 2 . 1 1 94 94 ALA CB C 94 18.250 18.250 17.877 0.373 19554 518 1 2 . 1 1 94 94 ALA H H 94 8.090 8.090 7.404 0.686 19554 519 1 2 . 1 1 95 95 TRP N N 95 119.190 119.190 118.882 0.308 19554 520 1 2 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.474 -0.434 19554 521 1 2 . 1 1 95 95 TRP C C 95 178.590 178.590 177.504 1.086 19554 522 1 2 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.389 2.611 19554 523 1 2 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.912 1.248 19554 524 1 2 . 1 1 95 95 TRP H H 95 8.060 8.060 7.774 0.286 19554 525 1 2 . 1 1 96 96 ILE N N 96 119.570 119.570 118.558 1.012 19554 526 1 2 . 1 1 96 96 ILE HA H 96 3.810 3.810 4.320 -0.510 19554 527 1 2 . 1 1 96 96 ILE C C 96 179.300 179.300 178.360 0.940 19554 528 1 2 . 1 1 96 96 ILE CA C 96 64.540 64.540 63.594 0.946 19554 529 1 2 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.064 0.066 19554 530 1 2 . 1 1 96 96 ILE H H 96 7.850 7.850 7.547 0.303 19554 531 1 2 . 1 1 97 97 THR N N 97 117.030 117.030 112.647 4.383 19554 532 1 2 . 1 1 97 97 THR HA H 97 3.830 3.830 4.282 -0.452 19554 533 1 2 . 1 1 97 97 THR C C 97 177.080 177.080 176.508 0.572 19554 534 1 2 . 1 1 97 97 THR CA C 97 66.430 66.430 64.997 1.433 19554 535 1 2 . 1 1 97 97 THR CB C 97 68.450 68.450 69.225 -0.775 19554 536 1 2 . 1 1 97 97 THR H H 97 7.900 7.900 8.141 -0.241 19554 537 1 2 . 1 1 98 98 LEU N N 98 123.110 123.110 123.047 0.063 19554 538 1 2 . 1 1 98 98 LEU HA H 98 3.930 3.930 3.995 -0.065 19554 539 1 2 . 1 1 98 98 LEU C C 98 178.160 178.160 178.539 -0.379 19554 540 1 2 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.846 -0.116 19554 541 1 2 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.447 0.094 19554 542 1 2 . 1 1 98 98 LEU H H 98 7.830 7.830 7.876 -0.046 19554 543 1 2 . 1 1 99 99 GLU N N 99 120.520 120.520 117.600 2.920 19554 544 1 2 . 1 1 99 99 GLU HA H 99 3.880 3.880 3.981 -0.101 19554 545 1 2 . 1 1 99 99 GLU C C 99 179.010 179.010 178.237 0.773 19554 546 1 2 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.166 0.754 19554 547 1 2 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.111 0.239 19554 548 1 2 . 1 1 99 99 GLU H H 99 8.560 8.560 7.983 0.577 19554 549 1 2 . 1 1 100 100 LYS N N 100 119.950 119.950 116.822 3.128 19554 550 1 2 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.375 -0.345 19554 551 1 2 . 1 1 100 100 LYS C C 100 177.870 177.870 178.885 -1.015 19554 552 1 2 . 1 1 100 100 LYS CA C 100 58.570 58.570 57.931 0.639 19554 553 1 2 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.542 -0.822 19554 554 1 2 . 1 1 100 100 LYS H H 100 7.800 7.800 7.704 0.096 19554 555 1 2 . 1 1 101 101 ALA N N 101 120.690 120.690 123.544 -2.854 19554 556 1 2 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.213 -0.193 19554 557 1 2 . 1 1 101 101 ALA C C 101 180.990 180.990 179.082 1.908 19554 558 1 2 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.063 1.057 19554 559 1 2 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.256 -0.676 19554 560 1 2 . 1 1 101 101 ALA H H 101 7.800 7.800 8.010 -0.210 19554 561 1 2 . 1 1 102 102 TYR N N 102 118.440 118.440 119.792 -1.352 19554 562 1 2 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.143 0.177 19554 563 1 2 . 1 1 102 102 TYR C C 102 178.590 178.590 177.620 0.970 19554 564 1 2 . 1 1 102 102 TYR CA C 102 59.810 59.810 59.837 -0.026 19554 565 1 2 . 1 1 102 102 TYR CB C 102 38.690 38.690 38.106 0.584 19554 566 1 2 . 1 1 102 102 TYR H H 102 8.580 8.580 8.636 -0.056 19554 567 1 2 . 1 1 103 103 GLU N N 103 120.860 120.860 118.824 2.036 19554 568 1 2 . 1 1 103 103 GLU HA H 103 3.590 3.590 3.783 -0.193 19554 569 1 2 . 1 1 103 103 GLU C C 103 178.100 178.100 177.245 0.855 19554 570 1 2 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.514 0.567 19554 571 1 2 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.323 0.097 19554 572 1 2 . 1 1 103 103 GLU H H 103 8.290 8.290 7.831 0.459 19554 573 1 2 . 1 1 104 104 ASP N N 104 116.120 116.120 116.436 -0.316 19554 574 1 2 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.630 -0.020 19554 575 1 2 . 1 1 104 104 ASP C C 104 174.970 174.970 175.456 -0.486 19554 576 1 2 . 1 1 104 104 ASP CA C 104 54.120 54.120 54.151 -0.031 19554 577 1 2 . 1 1 104 104 ASP CB C 104 40.480 40.480 41.106 -0.626 19554 578 1 2 . 1 1 104 104 ASP H H 104 8.120 8.120 7.807 0.313 19554 579 1 2 . 1 1 105 105 ALA N N 105 123.330 123.330 120.184 3.146 19554 580 1 2 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.083 0.067 19554 581 1 2 . 1 1 105 105 ALA C C 105 177.130 177.130 177.257 -0.127 19554 582 1 2 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.781 -0.141 19554 583 1 2 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.649 -0.349 19554 584 1 2 . 1 1 105 105 ALA H H 105 7.710 7.710 7.438 0.272 19554 585 1 2 . 1 1 106 106 GLU N N 106 118.950 118.950 118.661 0.289 19554 586 1 2 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.317 -0.017 19554 587 1 2 . 1 1 106 106 GLU C C 106 176.730 176.730 177.020 -0.290 19554 588 1 2 . 1 1 106 106 GLU CA C 106 55.440 55.440 56.740 -1.300 19554 589 1 2 . 1 1 106 106 GLU CB C 106 31.760 31.760 30.731 1.029 19554 590 1 2 . 1 1 106 106 GLU H H 106 8.440 8.440 8.386 0.054 19554 591 1 2 . 1 1 107 107 THR N N 107 118.780 118.780 110.420 8.360 19554 592 1 2 . 1 1 107 107 THR HA H 107 4.550 4.550 4.507 0.043 19554 593 1 2 . 1 1 107 107 THR C C 107 174.250 174.250 174.245 0.005 19554 594 1 2 . 1 1 107 107 THR CA C 107 62.360 62.360 60.403 1.957 19554 595 1 2 . 1 1 107 107 THR CB C 107 69.390 69.390 70.756 -1.366 19554 596 1 2 . 1 1 107 107 THR H H 107 8.740 8.740 8.187 0.553 19554 597 1 2 . 1 1 108 108 VAL N N 108 120.540 120.540 114.363 6.177 19554 598 1 2 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.681 -0.051 19554 599 1 2 . 1 1 108 108 VAL C C 108 174.440 174.440 174.023 0.417 19554 600 1 2 . 1 1 108 108 VAL CA C 108 59.000 59.000 60.141 -1.141 19554 601 1 2 . 1 1 108 108 VAL CB C 108 34.650 34.650 35.080 -0.430 19554 602 1 2 . 1 1 108 108 VAL H H 108 9.040 9.040 8.841 0.199 19554 603 1 2 . 1 1 109 109 THR N N 109 115.100 115.100 114.768 0.332 19554 604 1 2 . 1 1 109 109 THR HA H 109 5.380 5.380 4.553 0.827 19554 605 1 2 . 1 1 109 109 THR C C 109 174.580 174.580 173.136 1.444 19554 606 1 2 . 1 1 109 109 THR CA C 109 60.410 60.410 61.987 -1.577 19554 607 1 2 . 1 1 109 109 THR CB C 109 70.610 70.610 70.479 0.131 19554 608 1 2 . 1 1 109 109 THR H H 109 8.170 8.170 8.254 -0.084 19554 609 1 2 . 1 1 110 110 GLY N N 110 108.580 108.580 112.480 -3.900 19554 610 1 2 . 1 1 110 110 GLY C C 110 170.810 170.810 171.555 -0.745 19554 611 1 2 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.215 0.165 19554 612 1 2 . 1 1 110 110 GLY H H 110 8.780 8.780 8.202 0.578 19554 613 1 2 . 1 1 111 111 VAL N N 111 116.930 116.930 121.061 -4.131 19554 614 1 2 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.837 -0.057 19554 615 1 2 . 1 1 111 111 VAL C C 111 176.060 176.060 175.432 0.628 19554 616 1 2 . 1 1 111 111 VAL CA C 111 59.770 59.770 59.611 0.159 19554 617 1 2 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.386 1.364 19554 618 1 2 . 1 1 111 111 VAL H H 111 7.810 7.810 8.479 -0.669 19554 619 1 2 . 1 1 112 112 ILE N N 112 127.060 127.060 129.333 -2.273 19554 620 1 2 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.116 0.114 19554 621 1 2 . 1 1 112 112 ILE C C 112 176.180 176.180 175.576 0.604 19554 622 1 2 . 1 1 112 112 ILE CA C 112 62.220 62.220 63.075 -0.855 19554 623 1 2 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.519 0.961 19554 624 1 2 . 1 1 112 112 ILE H H 112 9.240 9.240 8.186 1.054 19554 625 1 2 . 1 1 113 113 ASN N N 113 127.510 127.510 125.870 1.640 19554 626 1 2 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.827 0.113 19554 627 1 2 . 1 1 113 113 ASN C C 113 175.020 175.020 175.370 -0.350 19554 628 1 2 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.639 -1.349 19554 629 1 2 . 1 1 113 113 ASN CB C 113 39.580 39.580 39.600 -0.020 19554 630 1 2 . 1 1 113 113 ASN H H 113 9.010 9.010 8.383 0.627 19554 631 1 2 . 1 1 114 114 GLY N N 114 107.150 107.150 108.076 -0.926 19554 632 1 2 . 1 1 114 114 GLY C C 114 171.360 171.360 172.216 -0.856 19554 633 1 2 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.617 0.902 19554 634 1 2 . 1 1 114 114 GLY H H 114 7.620 7.620 7.524 0.096 19554 635 1 2 . 1 1 115 115 LYS N N 115 121.670 121.670 121.660 0.010 19554 636 1 2 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.396 0.194 19554 637 1 2 . 1 1 115 115 LYS C C 115 175.950 175.950 174.562 1.388 19554 638 1 2 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.203 1.737 19554 639 1 2 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.173 -0.133 19554 640 1 2 . 1 1 115 115 LYS H H 115 8.550 8.550 8.090 0.460 19554 641 1 2 . 1 1 116 116 VAL N N 116 118.750 118.750 118.099 0.651 19554 642 1 2 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.488 -0.018 19554 643 1 2 . 1 1 116 116 VAL C C 116 175.110 175.110 174.789 0.321 19554 644 1 2 . 1 1 116 116 VAL CA C 116 59.030 59.030 58.844 0.186 19554 645 1 2 . 1 1 116 116 VAL CB C 116 35.500 35.500 33.568 1.933 19554 646 1 2 . 1 1 116 116 VAL H H 116 8.070 8.070 7.794 0.276 19554 647 1 2 . 1 1 117 117 LYS N N 117 122.520 122.520 122.320 0.200 19554 648 1 2 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.087 -0.157 19554 649 1 2 . 1 1 117 117 LYS C C 117 177.970 177.970 177.185 0.785 19554 650 1 2 . 1 1 117 117 LYS CA C 117 58.670 58.670 56.677 1.993 19554 651 1 2 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.001 -0.061 19554 652 1 2 . 1 1 117 117 LYS H H 117 8.250 8.250 8.454 -0.204 19554 653 1 2 . 1 1 118 118 GLY N N 118 113.440 113.440 113.556 -0.116 19554 654 1 2 . 1 1 118 118 GLY C C 118 175.540 175.540 173.474 2.066 19554 655 1 2 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.086 0.114 19554 656 1 2 . 1 1 118 118 GLY H H 118 8.820 8.820 7.904 0.916 19554 657 1 2 . 1 1 119 119 GLY N N 119 109.130 109.130 106.133 2.997 19554 658 1 2 . 1 1 119 119 GLY C C 119 170.530 170.530 172.166 -1.636 19554 659 1 2 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.291 3.549 19554 660 1 2 . 1 1 119 119 GLY H H 119 7.930 7.930 7.478 0.452 19554 661 1 2 . 1 1 120 120 PHE N N 120 123.370 123.370 117.426 5.944 19554 662 1 2 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.565 0.705 19554 663 1 2 . 1 1 120 120 PHE C C 120 174.260 174.260 174.276 -0.016 19554 664 1 2 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.046 -0.706 19554 665 1 2 . 1 1 120 120 PHE CB C 120 43.730 43.730 42.927 0.803 19554 666 1 2 . 1 1 120 120 PHE H H 120 8.820 8.820 7.734 1.086 19554 667 1 2 . 1 1 121 121 THR N N 121 114.670 114.670 120.925 -6.255 19554 668 1 2 . 1 1 121 121 THR HA H 121 5.000 5.000 4.921 0.079 19554 669 1 2 . 1 1 121 121 THR C C 121 173.780 173.780 173.958 -0.178 19554 670 1 2 . 1 1 121 121 THR CA C 121 60.500 60.500 60.917 -0.417 19554 671 1 2 . 1 1 121 121 THR CB C 121 69.910 69.910 69.547 0.363 19554 672 1 2 . 1 1 121 121 THR H H 121 8.670 8.670 8.708 -0.038 19554 673 1 2 . 1 1 122 122 VAL N N 122 124.340 124.340 120.535 3.805 19554 674 1 2 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.263 0.337 19554 675 1 2 . 1 1 122 122 VAL C C 122 174.240 174.240 174.011 0.229 19554 676 1 2 . 1 1 122 122 VAL CA C 122 59.300 59.300 61.090 -1.790 19554 677 1 2 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.495 0.365 19554 678 1 2 . 1 1 122 122 VAL H H 122 8.560 8.560 7.900 0.660 19554 679 1 2 . 1 1 123 123 GLU N N 123 126.950 126.950 126.340 0.610 19554 680 1 2 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.986 -0.376 19554 681 1 2 . 1 1 123 123 GLU C C 123 175.840 175.840 175.820 0.020 19554 682 1 2 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.764 0.396 19554 683 1 2 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.558 0.352 19554 684 1 2 . 1 1 123 123 GLU H H 123 8.950 8.950 8.266 0.684 19554 685 1 2 . 1 1 124 124 LEU N N 124 129.580 129.580 128.718 0.862 19554 686 1 2 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.647 0.013 19554 687 1 2 . 1 1 124 124 LEU C C 124 175.350 175.350 176.471 -1.121 19554 688 1 2 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.852 -0.652 19554 689 1 2 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.563 0.627 19554 690 1 2 . 1 1 124 124 LEU H H 124 8.940 8.940 8.853 0.087 19554 691 1 2 . 1 1 125 125 ASN N N 125 121.880 121.880 119.620 2.260 19554 692 1 2 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.436 -0.246 19554 693 1 2 . 1 1 125 125 ASN C C 125 174.690 174.690 175.423 -0.733 19554 694 1 2 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.205 -0.325 19554 695 1 2 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.716 -0.466 19554 696 1 2 . 1 1 125 125 ASN H H 125 8.950 8.950 8.974 -0.024 19554 697 1 2 . 1 1 126 126 GLY N N 126 103.140 103.140 103.650 -0.510 19554 698 1 2 . 1 1 126 126 GLY C C 126 173.680 173.680 174.580 -0.900 19554 699 1 2 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.006 -0.126 19554 700 1 2 . 1 1 126 126 GLY H H 126 8.070 8.070 8.136 -0.066 19554 701 1 2 . 1 1 127 127 ILE N N 127 122.120 122.120 121.783 0.337 19554 702 1 2 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.989 -0.019 19554 703 1 2 . 1 1 127 127 ILE C C 127 174.370 174.370 175.423 -1.053 19554 704 1 2 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.029 -0.499 19554 705 1 2 . 1 1 127 127 ILE CB C 127 38.970 38.970 37.755 1.215 19554 706 1 2 . 1 1 127 127 ILE H H 127 7.380 7.380 7.871 -0.491 19554 707 1 2 . 1 1 128 128 ARG N N 128 126.630 126.630 124.707 1.923 19554 708 1 2 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.101 -0.461 19554 709 1 2 . 1 1 128 128 ARG C C 128 174.720 174.720 174.988 -0.268 19554 710 1 2 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.724 0.926 19554 711 1 2 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.955 -0.955 19554 712 1 2 . 1 1 128 128 ARG H H 128 8.170 8.170 8.455 -0.285 19554 713 1 2 . 1 1 129 129 ALA N N 129 127.320 127.320 127.807 -0.487 19554 714 1 2 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.427 0.423 19554 715 1 2 . 1 1 129 129 ALA C C 129 174.970 174.970 175.228 -0.258 19554 716 1 2 . 1 1 129 129 ALA CA C 129 49.660 49.660 50.411 -0.751 19554 717 1 2 . 1 1 129 129 ALA CB C 129 24.390 24.390 20.980 3.410 19554 718 1 2 . 1 1 129 129 ALA H H 129 9.240 9.240 8.502 0.738 19554 719 1 2 . 1 1 130 130 PHE N N 130 121.060 121.060 118.510 2.550 19554 720 1 2 . 1 1 130 130 PHE HA H 130 5.160 5.160 4.949 0.211 19554 721 1 2 . 1 1 130 130 PHE C C 130 172.430 172.430 173.656 -1.226 19554 722 1 2 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.136 -2.136 19554 723 1 2 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.058 0.342 19554 724 1 2 . 1 1 130 130 PHE H H 130 8.660 8.660 8.333 0.327 19554 725 1 2 . 1 1 131 131 LEU N N 131 130.250 130.250 128.294 1.956 19554 726 1 2 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.844 0.136 19554 727 1 2 . 1 1 131 131 LEU CA C 131 49.670 49.670 52.087 -2.417 19554 728 1 2 . 1 1 131 131 LEU CB C 131 44.330 44.330 43.646 0.684 19554 729 1 2 . 1 1 131 131 LEU H H 131 8.550 8.550 8.796 -0.246 19554 730 1 2 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.600 -0.600 19554 731 1 2 . 1 1 132 132 PRO C C 132 179.380 179.380 178.175 1.205 19554 732 1 2 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.795 -0.635 19554 733 1 2 . 1 1 133 133 GLY N N 133 111.470 111.470 108.470 3.000 19554 734 1 2 . 1 1 133 133 GLY C C 133 175.590 175.590 176.002 -0.412 19554 735 1 2 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.830 0.700 19554 736 1 2 . 1 1 133 133 GLY H H 133 9.140 9.140 8.765 0.375 19554 737 1 2 . 1 1 134 134 SER HA H 134 4.350 4.350 4.449 -0.099 19554 738 1 2 . 1 1 134 134 SER C C 134 175.280 175.280 174.428 0.852 19554 739 1 2 . 1 1 134 134 SER CA C 134 59.210 59.210 60.308 -1.098 19554 740 1 2 . 1 1 134 134 SER CB C 134 62.730 62.730 63.074 -0.344 19554 741 1 2 . 1 1 135 135 LEU N N 135 118.770 118.770 123.306 -4.536 19554 742 1 2 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.739 -0.159 19554 743 1 2 . 1 1 135 135 LEU C C 135 177.500 177.500 176.455 1.045 19554 744 1 2 . 1 1 135 135 LEU CA C 135 53.770 53.770 53.779 -0.008 19554 745 1 2 . 1 1 135 135 LEU H H 135 8.030 8.030 7.459 0.571 19554 746 1 2 . 1 1 136 136 VAL N N 136 123.080 123.080 120.207 2.873 19554 747 1 2 . 1 1 136 136 VAL HA H 136 3.610 3.610 3.878 -0.268 19554 748 1 2 . 1 1 136 136 VAL C C 136 173.150 173.150 175.399 -2.249 19554 749 1 2 . 1 1 136 136 VAL CA C 136 65.220 65.220 64.153 1.067 19554 750 1 2 . 1 1 136 136 VAL CB C 136 32.020 32.020 32.384 -0.364 19554 751 1 2 . 1 1 136 136 VAL H H 136 7.550 7.550 7.622 -0.072 19554 752 1 2 . 1 1 137 137 ASP N N 137 117.300 117.300 115.064 2.236 19554 753 1 2 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.673 -0.333 19554 754 1 2 . 1 1 137 137 ASP C C 137 174.840 174.840 174.565 0.275 19554 755 1 2 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.338 -1.268 19554 756 1 2 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.654 2.805 19554 757 1 2 . 1 1 137 137 ASP H H 137 7.940 7.940 8.007 -0.067 19554 758 1 2 . 1 1 138 138 VAL N N 138 116.750 116.750 116.845 -0.095 19554 759 1 2 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.231 -0.091 19554 760 1 2 . 1 1 138 138 VAL CA C 138 61.190 61.190 61.639 -0.449 19554 761 1 2 . 1 1 138 138 VAL CB C 138 33.330 33.330 32.680 0.650 19554 762 1 2 . 1 1 138 138 VAL H H 138 10.000 10.000 8.044 1.956 19554 763 1 2 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.514 -0.004 19554 764 1 2 . 1 1 140 140 PRO C C 140 175.860 175.860 176.071 -0.211 19554 765 1 2 . 1 1 141 141 VAL N N 141 124.910 124.910 122.188 2.722 19554 766 1 2 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.301 -0.401 19554 767 1 2 . 1 1 141 141 VAL C C 141 175.120 175.120 176.024 -0.904 19554 768 1 2 . 1 1 141 141 VAL CA C 141 62.720 62.720 59.730 2.990 19554 769 1 2 . 1 1 141 141 VAL CB C 141 31.870 31.870 34.852 -2.982 19554 770 1 2 . 1 1 141 141 VAL H H 141 8.110 8.110 8.416 -0.306 19554 771 1 2 . 1 1 142 142 ARG N N 142 119.730 119.730 124.114 -4.384 19554 772 1 2 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.126 0.494 19554 773 1 2 . 1 1 142 142 ARG C C 142 173.520 173.520 175.711 -2.191 19554 774 1 2 . 1 1 142 142 ARG CA C 142 53.020 53.020 57.759 -4.739 19554 775 1 2 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.135 0.345 19554 776 1 2 . 1 1 142 142 ARG H H 142 7.440 7.440 8.507 -1.067 19554 777 1 2 . 1 1 143 143 ASP N N 143 119.780 119.780 120.640 -0.860 19554 778 1 2 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.730 -0.060 19554 779 1 2 . 1 1 143 143 ASP C C 143 175.970 175.970 175.974 -0.004 19554 780 1 2 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.372 -0.342 19554 781 1 2 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.313 0.417 19554 782 1 2 . 1 1 143 143 ASP H H 143 7.880 7.880 8.135 -0.255 19554 783 1 2 . 1 1 144 144 THR N N 144 110.060 110.060 114.824 -4.764 19554 784 1 2 . 1 1 144 144 THR HA H 144 4.110 4.110 4.403 -0.293 19554 785 1 2 . 1 1 144 144 THR C C 144 175.730 175.730 175.261 0.469 19554 786 1 2 . 1 1 144 144 THR CA C 144 61.520 61.520 61.567 -0.047 19554 787 1 2 . 1 1 144 144 THR CB C 144 68.610 68.610 69.054 -0.444 19554 788 1 2 . 1 1 144 144 THR H H 144 8.030 8.030 8.546 -0.516 19554 789 1 2 . 1 1 145 145 LEU N N 145 124.820 124.820 122.793 2.027 19554 790 1 2 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.456 0.244 19554 791 1 2 . 1 1 145 145 LEU C C 145 178.010 178.010 176.656 1.354 19554 792 1 2 . 1 1 145 145 LEU CA C 145 57.350 57.350 55.537 1.813 19554 793 1 2 . 1 1 145 145 LEU CB C 145 42.100 42.100 42.622 -0.522 19554 794 1 2 . 1 1 145 145 LEU H H 145 8.050 8.050 7.928 0.122 19554 795 1 2 . 1 1 146 146 HIS N N 146 116.310 116.310 114.575 1.735 19554 796 1 2 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.587 -0.047 19554 797 1 2 . 1 1 146 146 HIS C C 146 175.000 175.000 174.469 0.531 19554 798 1 2 . 1 1 146 146 HIS H H 146 8.120 8.120 8.489 -0.369 19554 799 1 2 . 1 1 147 147 LEU N N 147 120.320 120.320 121.083 -0.763 19554 800 1 2 . 1 1 147 147 LEU HA H 147 4.070 4.070 4.351 -0.281 19554 801 1 2 . 1 1 147 147 LEU C C 147 176.810 176.810 175.532 1.278 19554 802 1 2 . 1 1 147 147 LEU CA C 147 54.710 54.710 54.297 0.413 19554 803 1 2 . 1 1 147 147 LEU CB C 147 41.960 41.960 41.630 0.330 19554 804 1 2 . 1 1 147 147 LEU H H 147 7.620 7.620 7.466 0.154 19554 805 1 2 . 1 1 148 148 GLU N N 148 118.950 118.950 118.428 0.522 19554 806 1 2 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.480 -0.700 19554 807 1 2 . 1 1 148 148 GLU C C 148 177.480 177.480 176.137 1.343 19554 808 1 2 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.928 2.502 19554 809 1 2 . 1 1 148 148 GLU CB C 148 29.680 29.680 30.695 -1.016 19554 810 1 2 . 1 1 148 148 GLU H H 148 7.760 7.760 7.525 0.235 19554 811 1 2 . 1 1 149 149 GLY N N 149 111.070 111.070 110.742 0.328 19554 812 1 2 . 1 1 149 149 GLY C C 149 173.820 173.820 174.150 -0.330 19554 813 1 2 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.375 0.155 19554 814 1 2 . 1 1 149 149 GLY H H 149 8.630 8.630 8.551 0.079 19554 815 1 2 . 1 1 150 150 LYS N N 150 119.380 119.380 120.363 -0.983 19554 816 1 2 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.299 0.031 19554 817 1 2 . 1 1 150 150 LYS C C 150 175.110 175.110 175.349 -0.239 19554 818 1 2 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.081 -0.911 19554 819 1 2 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.203 0.347 19554 820 1 2 . 1 1 150 150 LYS H H 150 7.520 7.520 7.958 -0.438 19554 821 1 2 . 1 1 151 151 GLU N N 151 122.850 122.850 123.882 -1.032 19554 822 1 2 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.428 0.042 19554 823 1 2 . 1 1 151 151 GLU C C 151 175.510 175.510 174.932 0.578 19554 824 1 2 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.248 1.092 19554 825 1 2 . 1 1 151 151 GLU CB C 151 30.010 30.010 30.155 -0.145 19554 826 1 2 . 1 1 151 151 GLU H H 151 8.410 8.410 8.431 -0.021 19554 827 1 2 . 1 1 152 152 LEU N N 152 127.520 127.520 126.182 1.338 19554 828 1 2 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.517 0.023 19554 829 1 2 . 1 1 152 152 LEU C C 152 173.750 173.750 174.427 -0.677 19554 830 1 2 . 1 1 152 152 LEU CA C 152 52.820 52.820 54.096 -1.276 19554 831 1 2 . 1 1 152 152 LEU H H 152 8.850 8.850 7.888 0.962 19554 832 1 2 . 1 1 153 153 GLU N N 153 116.500 116.500 122.645 -6.145 19554 833 1 2 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.269 0.311 19554 834 1 2 . 1 1 153 153 GLU C C 153 175.120 175.120 174.886 0.234 19554 835 1 2 . 1 1 153 153 GLU CA C 153 55.160 55.160 56.007 -0.847 19554 836 1 2 . 1 1 153 153 GLU H H 153 7.110 7.110 8.108 -0.998 19554 837 1 2 . 1 1 154 154 PHE N N 154 115.150 115.150 121.296 -6.146 19554 838 1 2 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.805 0.055 19554 839 1 2 . 1 1 154 154 PHE C C 154 175.630 175.630 173.886 1.744 19554 840 1 2 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.604 0.586 19554 841 1 2 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.157 2.093 19554 842 1 2 . 1 1 154 154 PHE H H 154 8.910 8.910 8.352 0.558 19554 843 1 2 . 1 1 155 155 LYS N N 155 114.560 114.560 118.797 -4.237 19554 844 1 2 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.590 0.120 19554 845 1 2 . 1 1 155 155 LYS C C 155 176.500 176.500 175.451 1.049 19554 846 1 2 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.660 -2.060 19554 847 1 2 . 1 1 155 155 LYS CB C 155 33.960 33.960 35.096 -1.136 19554 848 1 2 . 1 1 155 155 LYS H H 155 8.100 8.100 8.490 -0.390 19554 849 1 2 . 1 1 156 156 VAL N N 156 124.530 124.530 123.919 0.611 19554 850 1 2 . 1 1 156 156 VAL C C 156 175.630 175.630 175.435 0.195 19554 851 1 2 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.434 -0.744 19554 852 1 2 . 1 1 156 156 VAL CB C 156 31.600 31.600 30.743 0.857 19554 853 1 2 . 1 1 156 156 VAL H H 156 9.920 9.920 8.174 1.746 19554 854 1 2 . 1 1 157 157 ILE N N 157 119.590 119.590 126.558 -6.968 19554 855 1 2 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.388 0.332 19554 856 1 2 . 1 1 157 157 ILE C C 157 176.190 176.190 175.116 1.074 19554 857 1 2 . 1 1 157 157 ILE CA C 157 61.050 61.050 60.575 0.475 19554 858 1 2 . 1 1 157 157 ILE CB C 157 39.170 39.170 38.901 0.269 19554 859 1 2 . 1 1 157 157 ILE H H 157 8.530 8.530 8.818 -0.288 19554 860 1 2 . 1 1 158 158 LYS N N 158 122.460 122.460 119.699 2.761 19554 861 1 2 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.287 -0.087 19554 862 1 2 . 1 1 158 158 LYS C C 158 173.000 173.000 173.695 -0.695 19554 863 1 2 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.166 0.634 19554 864 1 2 . 1 1 158 158 LYS CB C 158 35.640 35.640 35.259 0.381 19554 865 1 2 . 1 1 158 158 LYS H H 158 7.600 7.600 8.097 -0.497 19554 866 1 2 . 1 1 159 159 LEU N N 159 125.430 125.430 121.252 4.178 19554 867 1 2 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.823 -0.203 19554 868 1 2 . 1 1 159 159 LEU C C 159 174.390 174.390 174.499 -0.109 19554 869 1 2 . 1 1 159 159 LEU CA C 159 54.510 54.510 53.974 0.536 19554 870 1 2 . 1 1 159 159 LEU H H 159 7.950 7.950 7.794 0.156 19554 871 1 2 . 1 1 160 160 ASP N N 160 124.740 124.740 123.986 0.754 19554 872 1 2 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.873 -0.203 19554 873 1 2 . 1 1 160 160 ASP C C 160 176.020 176.020 175.709 0.311 19554 874 1 2 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.553 -0.933 19554 875 1 2 . 1 1 160 160 ASP CB C 160 42.050 42.050 42.393 -0.343 19554 876 1 2 . 1 1 160 160 ASP H H 160 8.760 8.760 8.154 0.606 19554 877 1 2 . 1 1 161 161 GLN N N 161 126.490 126.490 124.428 2.062 19554 878 1 2 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.046 -0.926 19554 879 1 2 . 1 1 161 161 GLN C C 161 178.280 178.280 177.269 1.011 19554 880 1 2 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.647 0.123 19554 881 1 2 . 1 1 161 161 GLN CB C 161 27.840 27.840 29.105 -1.265 19554 882 1 2 . 1 1 161 161 GLN H H 161 9.110 9.110 8.828 0.282 19554 883 1 2 . 1 1 162 162 LYS N N 162 119.150 119.150 118.154 0.996 19554 884 1 2 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.197 -0.397 19554 885 1 2 . 1 1 162 162 LYS C C 162 177.900 177.900 177.603 0.297 19554 886 1 2 . 1 1 162 162 LYS CA C 162 58.700 58.700 57.885 0.816 19554 887 1 2 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.423 -1.033 19554 888 1 2 . 1 1 162 162 LYS H H 162 8.070 8.070 8.103 -0.033 19554 889 1 2 . 1 1 163 163 ARG N N 163 114.850 114.850 116.312 -1.462 19554 890 1 2 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.287 -0.137 19554 891 1 2 . 1 1 163 163 ARG C C 163 174.750 174.750 176.409 -1.659 19554 892 1 2 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.838 -1.038 19554 893 1 2 . 1 1 163 163 ARG H H 163 7.010 7.010 7.501 -0.491 19554 894 1 2 . 1 1 164 164 ASN N N 164 117.810 117.810 117.303 0.507 19554 895 1 2 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.388 -0.258 19554 896 1 2 . 1 1 164 164 ASN C C 164 173.880 173.880 173.665 0.215 19554 897 1 2 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.290 -0.330 19554 898 1 2 . 1 1 164 164 ASN CB C 164 37.530 37.530 37.539 -0.009 19554 899 1 2 . 1 1 164 164 ASN H H 164 7.750 7.750 8.139 -0.389 19554 900 1 2 . 1 1 165 165 ASN N N 165 116.170 116.170 117.711 -1.541 19554 901 1 2 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.904 0.156 19554 902 1 2 . 1 1 165 165 ASN C C 165 172.990 172.990 172.503 0.487 19554 903 1 2 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.767 -0.327 19554 904 1 2 . 1 1 165 165 ASN CB C 165 41.820 41.820 41.771 0.049 19554 905 1 2 . 1 1 165 165 ASN H H 165 8.020 8.020 7.616 0.404 19554 906 1 2 . 1 1 166 166 VAL N N 166 124.790 124.790 122.585 2.205 19554 907 1 2 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.359 0.141 19554 908 1 2 . 1 1 166 166 VAL C C 166 174.190 174.190 174.928 -0.738 19554 909 1 2 . 1 1 166 166 VAL CA C 166 61.030 61.030 60.731 0.299 19554 910 1 2 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.517 0.103 19554 911 1 2 . 1 1 166 166 VAL H H 166 8.380 8.380 8.375 0.005 19554 912 1 2 . 1 1 167 167 VAL N N 167 128.000 128.000 119.699 8.301 19554 913 1 2 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.672 0.578 19554 914 1 2 . 1 1 167 167 VAL C C 167 176.000 176.000 173.322 2.678 19554 915 1 2 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.433 1.177 19554 916 1 2 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.855 -0.955 19554 917 1 2 . 1 1 167 167 VAL H H 167 8.710 8.710 7.849 0.861 19554 918 1 2 . 1 1 168 168 VAL N N 168 118.360 118.360 118.631 -0.271 19554 919 1 2 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.450 0.790 19554 920 1 2 . 1 1 168 168 VAL C C 168 172.800 172.800 176.325 -3.525 19554 921 1 2 . 1 1 168 168 VAL CA C 168 57.860 57.860 60.164 -2.304 19554 922 1 2 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.938 1.412 19554 923 1 2 . 1 1 168 168 VAL H H 168 8.560 8.560 8.096 0.464 19554 924 1 2 . 1 1 169 169 SER N N 169 106.720 106.720 120.203 -13.483 19554 925 1 2 . 1 1 169 169 SER HA H 169 4.480 4.480 4.794 -0.314 19554 926 1 2 . 1 1 169 169 SER C C 169 175.950 175.950 174.305 1.645 19554 927 1 2 . 1 1 169 169 SER CA C 169 55.550 55.550 57.666 -2.116 19554 928 1 2 . 1 1 169 169 SER CB C 169 64.980 64.980 64.419 0.561 19554 929 1 2 . 1 1 169 169 SER H H 169 8.600 8.600 8.743 -0.143 19554 930 1 2 . 1 1 170 170 ARG N N 170 129.620 129.620 119.518 10.102 19554 931 1 2 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.395 0.315 19554 932 1 2 . 1 1 170 170 ARG C C 170 177.870 177.870 178.691 -0.821 19554 933 1 2 . 1 1 170 170 ARG CA C 170 57.150 57.150 57.796 -0.646 19554 934 1 2 . 1 1 170 170 ARG H H 170 7.610 7.610 8.698 -1.088 19554 935 1 2 . 1 1 171 171 ARG N N 171 122.230 122.230 121.245 0.985 19554 936 1 2 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.273 -0.803 19554 937 1 2 . 1 1 171 171 ARG C C 171 175.760 175.760 177.973 -2.213 19554 938 1 2 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.052 1.378 19554 939 1 2 . 1 1 171 171 ARG CB C 171 30.410 30.410 29.919 0.490 19554 940 1 2 . 1 1 171 171 ARG H H 171 8.260 8.260 8.704 -0.444 19554 941 1 2 . 1 1 172 172 ALA N N 172 116.490 116.490 120.181 -3.691 19554 942 1 2 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.259 -0.209 19554 943 1 2 . 1 1 172 172 ALA C C 172 179.480 179.480 178.905 0.575 19554 944 1 2 . 1 1 172 172 ALA CA C 172 54.010 54.010 53.842 0.168 19554 945 1 2 . 1 1 172 172 ALA CB C 172 18.890 18.890 17.942 0.948 19554 946 1 2 . 1 1 172 172 ALA H H 172 7.760 7.760 8.420 -0.660 19554 947 1 2 . 1 1 173 173 VAL N N 173 116.440 116.440 120.621 -4.181 19554 948 1 2 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.663 -0.193 19554 949 1 2 . 1 1 173 173 VAL C C 173 177.680 177.680 176.844 0.836 19554 950 1 2 . 1 1 173 173 VAL CA C 173 65.080 65.080 66.070 -0.990 19554 951 1 2 . 1 1 173 173 VAL CB C 173 31.880 31.880 32.253 -0.373 19554 952 1 2 . 1 1 173 173 VAL H H 173 7.210 7.210 7.267 -0.057 19554 953 1 2 . 1 1 174 174 ILE N N 174 119.790 119.790 115.992 3.798 19554 954 1 2 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.892 -0.212 19554 955 1 2 . 1 1 174 174 ILE C C 174 178.310 178.310 177.450 0.860 19554 956 1 2 . 1 1 174 174 ILE CA C 174 63.770 63.770 63.920 -0.150 19554 957 1 2 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.007 1.443 19554 958 1 2 . 1 1 174 174 ILE H H 174 7.160 7.160 7.315 -0.155 19554 959 1 2 . 1 1 175 175 GLU N N 175 117.810 117.810 121.236 -3.426 19554 960 1 2 . 1 1 175 175 GLU HA H 175 4.030 4.030 3.921 0.109 19554 961 1 2 . 1 1 175 175 GLU C C 175 177.170 177.170 179.291 -2.121 19554 962 1 2 . 1 1 175 175 GLU CA C 175 57.190 57.190 59.502 -2.312 19554 963 1 2 . 1 1 175 175 GLU CB C 175 29.640 29.640 28.761 0.879 19554 964 1 2 . 1 1 175 175 GLU H H 175 8.250 8.250 8.469 -0.219 19554 965 1 2 . 1 1 176 176 SER N N 176 114.300 114.300 114.624 -0.324 19554 966 1 2 . 1 1 176 176 SER HA H 176 4.320 4.320 4.073 0.247 19554 967 1 2 . 1 1 176 176 SER C C 176 174.930 174.930 176.831 -1.901 19554 968 1 2 . 1 1 176 176 SER CA C 176 59.060 59.060 61.267 -2.207 19554 969 1 2 . 1 1 176 176 SER CB C 176 63.640 63.640 62.757 0.883 19554 970 1 2 . 1 1 176 176 SER H H 176 7.460 7.460 7.949 -0.489 19554 971 1 2 . 1 1 177 177 GLU N N 177 121.860 121.860 121.025 0.835 19554 972 1 2 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.034 0.136 19554 973 1 2 . 1 1 177 177 GLU C C 177 176.340 176.340 177.839 -1.499 19554 974 1 2 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.811 -2.171 19554 975 1 2 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.957 -0.207 19554 976 1 2 . 1 1 177 177 GLU H H 177 7.890 7.890 7.683 0.207 19554 977 1 2 . 1 1 178 178 ASN N N 178 119.030 119.030 117.318 1.712 19554 978 1 2 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.867 -0.167 19554 979 1 2 . 1 1 178 178 ASN C C 178 174.230 174.230 174.602 -0.372 19554 980 1 2 . 1 1 178 178 ASN CA C 178 53.010 53.010 51.995 1.015 19554 981 1 2 . 1 1 178 178 ASN CB C 178 39.080 39.080 38.908 0.172 19554 982 1 2 . 1 1 178 178 ASN H H 178 8.110 8.110 8.150 -0.040 19554 983 1 3 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.022 0.138 19554 984 1 3 . 1 1 89 89 ALA C C 89 179.720 179.720 178.495 1.225 19554 985 1 3 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.184 0.306 19554 986 1 3 . 1 1 89 89 ALA CB C 89 18.220 18.220 19.122 -0.902 19554 987 1 3 . 1 1 90 90 LYS N N 90 119.500 119.500 117.304 2.196 19554 988 1 3 . 1 1 90 90 LYS C C 90 179.090 179.090 178.133 0.957 19554 989 1 3 . 1 1 90 90 LYS H H 90 7.980 7.980 8.476 -0.496 19554 990 1 3 . 1 1 91 91 ARG N N 91 120.510 120.510 119.072 1.438 19554 991 1 3 . 1 1 91 91 ARG HA H 91 4.150 4.150 3.972 0.178 19554 992 1 3 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.667 0.633 19554 993 1 3 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.307 0.713 19554 994 1 3 . 1 1 91 91 ARG H H 91 8.010 8.010 7.629 0.381 19554 995 1 3 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.638 1.482 19554 996 1 3 . 1 1 92 92 HIS C C 92 177.360 177.360 176.245 1.115 19554 997 1 3 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.497 0.373 19554 998 1 3 . 1 1 93 93 GLU N N 93 118.470 118.470 117.632 0.838 19554 999 1 3 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.181 -0.281 19554 1000 1 3 . 1 1 93 93 GLU C C 93 178.740 178.740 178.261 0.479 19554 1001 1 3 . 1 1 93 93 GLU CA C 93 59.160 59.160 58.243 0.917 19554 1002 1 3 . 1 1 93 93 GLU CB C 93 28.960 28.960 30.087 -1.127 19554 1003 1 3 . 1 1 93 93 GLU H H 93 8.190 8.190 7.629 0.561 19554 1004 1 3 . 1 1 94 94 ALA N N 94 123.080 123.080 123.072 0.008 19554 1005 1 3 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.195 -0.125 19554 1006 1 3 . 1 1 94 94 ALA C C 94 180.330 180.330 179.661 0.669 19554 1007 1 3 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.277 0.663 19554 1008 1 3 . 1 1 94 94 ALA CB C 94 18.250 18.250 18.201 0.049 19554 1009 1 3 . 1 1 94 94 ALA H H 94 8.090 8.090 7.353 0.737 19554 1010 1 3 . 1 1 95 95 TRP N N 95 119.190 119.190 119.704 -0.514 19554 1011 1 3 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.397 -0.357 19554 1012 1 3 . 1 1 95 95 TRP C C 95 178.590 178.590 178.732 -0.142 19554 1013 1 3 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.914 2.086 19554 1014 1 3 . 1 1 95 95 TRP CB C 95 29.160 29.160 28.343 0.817 19554 1015 1 3 . 1 1 95 95 TRP H H 95 8.060 8.060 8.016 0.044 19554 1016 1 3 . 1 1 96 96 ILE N N 96 119.570 119.570 116.155 3.415 19554 1017 1 3 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.785 0.025 19554 1018 1 3 . 1 1 96 96 ILE C C 96 179.300 179.300 176.892 2.408 19554 1019 1 3 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.424 0.116 19554 1020 1 3 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.098 0.032 19554 1021 1 3 . 1 1 96 96 ILE H H 96 7.850 7.850 7.431 0.419 19554 1022 1 3 . 1 1 97 97 THR N N 97 117.030 117.030 115.074 1.956 19554 1023 1 3 . 1 1 97 97 THR HA H 97 3.830 3.830 4.245 -0.415 19554 1024 1 3 . 1 1 97 97 THR C C 97 177.080 177.080 176.768 0.312 19554 1025 1 3 . 1 1 97 97 THR CA C 97 66.430 66.430 65.423 1.007 19554 1026 1 3 . 1 1 97 97 THR CB C 97 68.450 68.450 69.096 -0.646 19554 1027 1 3 . 1 1 97 97 THR H H 97 7.900 7.900 8.002 -0.102 19554 1028 1 3 . 1 1 98 98 LEU N N 98 123.110 123.110 120.948 2.162 19554 1029 1 3 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.070 -0.140 19554 1030 1 3 . 1 1 98 98 LEU C C 98 178.160 178.160 178.046 0.114 19554 1031 1 3 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.386 0.344 19554 1032 1 3 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.133 0.407 19554 1033 1 3 . 1 1 98 98 LEU H H 98 7.830 7.830 7.884 -0.054 19554 1034 1 3 . 1 1 99 99 GLU N N 99 120.520 120.520 118.005 2.515 19554 1035 1 3 . 1 1 99 99 GLU HA H 99 3.880 3.880 3.952 -0.072 19554 1036 1 3 . 1 1 99 99 GLU C C 99 179.010 179.010 178.506 0.504 19554 1037 1 3 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.397 0.523 19554 1038 1 3 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.131 0.219 19554 1039 1 3 . 1 1 99 99 GLU H H 99 8.560 8.560 8.384 0.176 19554 1040 1 3 . 1 1 100 100 LYS N N 100 119.950 119.950 117.387 2.563 19554 1041 1 3 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.261 -0.231 19554 1042 1 3 . 1 1 100 100 LYS C C 100 177.870 177.870 177.946 -0.076 19554 1043 1 3 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.271 0.299 19554 1044 1 3 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.767 -1.047 19554 1045 1 3 . 1 1 100 100 LYS H H 100 7.800 7.800 7.616 0.184 19554 1046 1 3 . 1 1 101 101 ALA N N 101 120.690 120.690 124.332 -3.642 19554 1047 1 3 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.334 -0.314 19554 1048 1 3 . 1 1 101 101 ALA C C 101 180.990 180.990 180.040 0.950 19554 1049 1 3 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.843 0.277 19554 1050 1 3 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.236 -0.656 19554 1051 1 3 . 1 1 101 101 ALA H H 101 7.800 7.800 7.216 0.584 19554 1052 1 3 . 1 1 102 102 TYR N N 102 118.440 118.440 119.639 -1.199 19554 1053 1 3 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.135 0.185 19554 1054 1 3 . 1 1 102 102 TYR C C 102 178.590 178.590 178.380 0.210 19554 1055 1 3 . 1 1 102 102 TYR CA C 102 59.810 59.810 59.949 -0.139 19554 1056 1 3 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.901 0.789 19554 1057 1 3 . 1 1 102 102 TYR H H 102 8.580 8.580 7.947 0.633 19554 1058 1 3 . 1 1 103 103 GLU N N 103 120.860 120.860 118.497 2.363 19554 1059 1 3 . 1 1 103 103 GLU HA H 103 3.590 3.590 3.836 -0.246 19554 1060 1 3 . 1 1 103 103 GLU C C 103 178.100 178.100 176.778 1.322 19554 1061 1 3 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.680 0.400 19554 1062 1 3 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.456 -0.036 19554 1063 1 3 . 1 1 103 103 GLU H H 103 8.290 8.290 7.845 0.445 19554 1064 1 3 . 1 1 104 104 ASP N N 104 116.120 116.120 116.348 -0.228 19554 1065 1 3 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.734 -0.124 19554 1066 1 3 . 1 1 104 104 ASP C C 104 174.970 174.970 174.795 0.175 19554 1067 1 3 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.361 0.759 19554 1068 1 3 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.488 -0.008 19554 1069 1 3 . 1 1 104 104 ASP H H 104 8.120 8.120 7.734 0.386 19554 1070 1 3 . 1 1 105 105 ALA N N 105 123.330 123.330 121.204 2.126 19554 1071 1 3 . 1 1 105 105 ALA HA H 105 4.150 4.150 3.998 0.152 19554 1072 1 3 . 1 1 105 105 ALA C C 105 177.130 177.130 177.260 -0.130 19554 1073 1 3 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.959 -0.320 19554 1074 1 3 . 1 1 105 105 ALA CB C 105 16.300 16.300 17.203 -0.903 19554 1075 1 3 . 1 1 105 105 ALA H H 105 7.710 7.710 7.420 0.290 19554 1076 1 3 . 1 1 106 106 GLU N N 106 118.950 118.950 120.129 -1.179 19554 1077 1 3 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.271 0.029 19554 1078 1 3 . 1 1 106 106 GLU C C 106 176.730 176.730 176.595 0.135 19554 1079 1 3 . 1 1 106 106 GLU CA C 106 55.440 55.440 56.940 -1.500 19554 1080 1 3 . 1 1 106 106 GLU CB C 106 31.760 31.760 31.211 0.549 19554 1081 1 3 . 1 1 106 106 GLU H H 106 8.440 8.440 8.052 0.388 19554 1082 1 3 . 1 1 107 107 THR N N 107 118.780 118.780 116.540 2.240 19554 1083 1 3 . 1 1 107 107 THR HA H 107 4.550 4.550 4.384 0.166 19554 1084 1 3 . 1 1 107 107 THR C C 107 174.250 174.250 173.697 0.553 19554 1085 1 3 . 1 1 107 107 THR CA C 107 62.360 62.360 60.747 1.613 19554 1086 1 3 . 1 1 107 107 THR CB C 107 69.390 69.390 69.527 -0.137 19554 1087 1 3 . 1 1 107 107 THR H H 107 8.740 8.740 8.208 0.532 19554 1088 1 3 . 1 1 108 108 VAL N N 108 120.540 120.540 117.974 2.566 19554 1089 1 3 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.743 -0.113 19554 1090 1 3 . 1 1 108 108 VAL C C 108 174.440 174.440 173.860 0.580 19554 1091 1 3 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.926 -0.926 19554 1092 1 3 . 1 1 108 108 VAL CB C 108 34.650 34.650 35.449 -0.799 19554 1093 1 3 . 1 1 108 108 VAL H H 108 9.040 9.040 8.648 0.392 19554 1094 1 3 . 1 1 109 109 THR N N 109 115.100 115.100 114.139 0.961 19554 1095 1 3 . 1 1 109 109 THR HA H 109 5.380 5.380 4.575 0.805 19554 1096 1 3 . 1 1 109 109 THR C C 109 174.580 174.580 172.981 1.599 19554 1097 1 3 . 1 1 109 109 THR CA C 109 60.410 60.410 61.691 -1.281 19554 1098 1 3 . 1 1 109 109 THR CB C 109 70.610 70.610 69.712 0.898 19554 1099 1 3 . 1 1 109 109 THR H H 109 8.170 8.170 8.371 -0.201 19554 1100 1 3 . 1 1 110 110 GLY N N 110 108.580 108.580 114.421 -5.841 19554 1101 1 3 . 1 1 110 110 GLY C C 110 170.810 170.810 171.585 -0.775 19554 1102 1 3 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.462 -0.082 19554 1103 1 3 . 1 1 110 110 GLY H H 110 8.780 8.780 8.272 0.508 19554 1104 1 3 . 1 1 111 111 VAL N N 111 116.930 116.930 121.009 -4.079 19554 1105 1 3 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.764 0.016 19554 1106 1 3 . 1 1 111 111 VAL C C 111 176.060 176.060 175.834 0.226 19554 1107 1 3 . 1 1 111 111 VAL CA C 111 59.770 59.770 59.738 0.032 19554 1108 1 3 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.300 1.450 19554 1109 1 3 . 1 1 111 111 VAL H H 111 7.810 7.810 8.567 -0.757 19554 1110 1 3 . 1 1 112 112 ILE N N 112 127.060 127.060 129.324 -2.264 19554 1111 1 3 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.107 0.123 19554 1112 1 3 . 1 1 112 112 ILE C C 112 176.180 176.180 175.368 0.812 19554 1113 1 3 . 1 1 112 112 ILE CA C 112 62.220 62.220 62.966 -0.746 19554 1114 1 3 . 1 1 112 112 ILE CB C 112 37.480 37.480 35.947 1.533 19554 1115 1 3 . 1 1 112 112 ILE H H 112 9.240 9.240 8.126 1.114 19554 1116 1 3 . 1 1 113 113 ASN N N 113 127.510 127.510 126.238 1.272 19554 1117 1 3 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.772 0.168 19554 1118 1 3 . 1 1 113 113 ASN C C 113 175.020 175.020 175.626 -0.606 19554 1119 1 3 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.695 -1.405 19554 1120 1 3 . 1 1 113 113 ASN CB C 113 39.580 39.580 40.150 -0.570 19554 1121 1 3 . 1 1 113 113 ASN H H 113 9.010 9.010 8.216 0.794 19554 1122 1 3 . 1 1 114 114 GLY N N 114 107.150 107.150 108.116 -0.966 19554 1123 1 3 . 1 1 114 114 GLY C C 114 171.360 171.360 172.006 -0.646 19554 1124 1 3 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.532 0.988 19554 1125 1 3 . 1 1 114 114 GLY H H 114 7.620 7.620 7.582 0.038 19554 1126 1 3 . 1 1 115 115 LYS N N 115 121.670 121.670 121.633 0.037 19554 1127 1 3 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.394 0.196 19554 1128 1 3 . 1 1 115 115 LYS C C 115 175.950 175.950 174.841 1.109 19554 1129 1 3 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.623 1.317 19554 1130 1 3 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.809 -0.769 19554 1131 1 3 . 1 1 115 115 LYS H H 115 8.550 8.550 8.110 0.440 19554 1132 1 3 . 1 1 116 116 VAL N N 116 118.750 118.750 116.368 2.382 19554 1133 1 3 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.436 0.034 19554 1134 1 3 . 1 1 116 116 VAL C C 116 175.110 175.110 174.879 0.231 19554 1135 1 3 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.195 -0.165 19554 1136 1 3 . 1 1 116 116 VAL CB C 116 35.500 35.500 34.340 1.160 19554 1137 1 3 . 1 1 116 116 VAL H H 116 8.070 8.070 8.308 -0.238 19554 1138 1 3 . 1 1 117 117 LYS N N 117 122.520 122.520 121.851 0.669 19554 1139 1 3 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.001 -0.071 19554 1140 1 3 . 1 1 117 117 LYS C C 117 177.970 177.970 177.107 0.863 19554 1141 1 3 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.263 1.407 19554 1142 1 3 . 1 1 117 117 LYS CB C 117 30.940 30.940 30.696 0.244 19554 1143 1 3 . 1 1 117 117 LYS H H 117 8.250 8.250 8.445 -0.195 19554 1144 1 3 . 1 1 118 118 GLY N N 118 113.440 113.440 112.815 0.625 19554 1145 1 3 . 1 1 118 118 GLY C C 118 175.540 175.540 173.643 1.897 19554 1146 1 3 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.335 -0.135 19554 1147 1 3 . 1 1 118 118 GLY H H 118 8.820 8.820 7.931 0.889 19554 1148 1 3 . 1 1 119 119 GLY N N 119 109.130 109.130 106.487 2.643 19554 1149 1 3 . 1 1 119 119 GLY C C 119 170.530 170.530 172.281 -1.751 19554 1150 1 3 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.301 3.539 19554 1151 1 3 . 1 1 119 119 GLY H H 119 7.930 7.930 7.483 0.447 19554 1152 1 3 . 1 1 120 120 PHE N N 120 123.370 123.370 117.017 6.353 19554 1153 1 3 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.611 0.659 19554 1154 1 3 . 1 1 120 120 PHE C C 120 174.260 174.260 174.182 0.078 19554 1155 1 3 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.177 -0.837 19554 1156 1 3 . 1 1 120 120 PHE CB C 120 43.730 43.730 43.891 -0.161 19554 1157 1 3 . 1 1 120 120 PHE H H 120 8.820 8.820 7.804 1.016 19554 1158 1 3 . 1 1 121 121 THR N N 121 114.670 114.670 116.258 -1.588 19554 1159 1 3 . 1 1 121 121 THR HA H 121 5.000 5.000 5.035 -0.035 19554 1160 1 3 . 1 1 121 121 THR C C 121 173.780 173.780 173.314 0.466 19554 1161 1 3 . 1 1 121 121 THR CA C 121 60.500 60.500 60.788 -0.288 19554 1162 1 3 . 1 1 121 121 THR CB C 121 69.910 69.910 71.344 -1.434 19554 1163 1 3 . 1 1 121 121 THR H H 121 8.670 8.670 8.783 -0.113 19554 1164 1 3 . 1 1 122 122 VAL N N 122 124.340 124.340 119.916 4.424 19554 1165 1 3 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.374 0.226 19554 1166 1 3 . 1 1 122 122 VAL C C 122 174.240 174.240 173.931 0.309 19554 1167 1 3 . 1 1 122 122 VAL CA C 122 59.300 59.300 60.536 -1.236 19554 1168 1 3 . 1 1 122 122 VAL CB C 122 35.860 35.860 36.091 -0.231 19554 1169 1 3 . 1 1 122 122 VAL H H 122 8.560 8.560 8.305 0.255 19554 1170 1 3 . 1 1 123 123 GLU N N 123 126.950 126.950 124.055 2.895 19554 1171 1 3 . 1 1 123 123 GLU HA H 123 4.610 4.610 5.139 -0.529 19554 1172 1 3 . 1 1 123 123 GLU C C 123 175.840 175.840 175.966 -0.126 19554 1173 1 3 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.656 0.504 19554 1174 1 3 . 1 1 123 123 GLU CB C 123 30.910 30.910 31.356 -0.446 19554 1175 1 3 . 1 1 123 123 GLU H H 123 8.950 8.950 8.597 0.353 19554 1176 1 3 . 1 1 124 124 LEU N N 124 129.580 129.580 128.594 0.986 19554 1177 1 3 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.746 -0.086 19554 1178 1 3 . 1 1 124 124 LEU C C 124 175.350 175.350 176.390 -1.040 19554 1179 1 3 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.543 -0.343 19554 1180 1 3 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.421 0.769 19554 1181 1 3 . 1 1 124 124 LEU H H 124 8.940 8.940 8.866 0.074 19554 1182 1 3 . 1 1 125 125 ASN N N 125 121.880 121.880 119.688 2.192 19554 1183 1 3 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.458 -0.268 19554 1184 1 3 . 1 1 125 125 ASN C C 125 174.690 174.690 175.842 -1.152 19554 1185 1 3 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.022 -0.142 19554 1186 1 3 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.529 -0.279 19554 1187 1 3 . 1 1 125 125 ASN H H 125 8.950 8.950 9.043 -0.093 19554 1188 1 3 . 1 1 126 126 GLY N N 126 103.140 103.140 103.305 -0.165 19554 1189 1 3 . 1 1 126 126 GLY C C 126 173.680 173.680 174.330 -0.650 19554 1190 1 3 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.288 -0.408 19554 1191 1 3 . 1 1 126 126 GLY H H 126 8.070 8.070 8.417 -0.347 19554 1192 1 3 . 1 1 127 127 ILE N N 127 122.120 122.120 122.209 -0.089 19554 1193 1 3 . 1 1 127 127 ILE HA H 127 3.970 3.970 4.012 -0.042 19554 1194 1 3 . 1 1 127 127 ILE C C 127 174.370 174.370 175.710 -1.340 19554 1195 1 3 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.134 -0.604 19554 1196 1 3 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.026 0.944 19554 1197 1 3 . 1 1 127 127 ILE H H 127 7.380 7.380 7.681 -0.301 19554 1198 1 3 . 1 1 128 128 ARG N N 128 126.630 126.630 124.174 2.456 19554 1199 1 3 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.219 -0.579 19554 1200 1 3 . 1 1 128 128 ARG C C 128 174.720 174.720 175.099 -0.379 19554 1201 1 3 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.652 0.998 19554 1202 1 3 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.446 -0.446 19554 1203 1 3 . 1 1 128 128 ARG H H 128 8.170 8.170 8.530 -0.360 19554 1204 1 3 . 1 1 129 129 ALA N N 129 127.320 127.320 126.108 1.212 19554 1205 1 3 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.384 0.466 19554 1206 1 3 . 1 1 129 129 ALA C C 129 174.970 174.970 175.831 -0.861 19554 1207 1 3 . 1 1 129 129 ALA CA C 129 49.660 49.660 50.127 -0.467 19554 1208 1 3 . 1 1 129 129 ALA CB C 129 24.390 24.390 20.920 3.470 19554 1209 1 3 . 1 1 129 129 ALA H H 129 9.240 9.240 8.542 0.698 19554 1210 1 3 . 1 1 130 130 PHE N N 130 121.060 121.060 120.710 0.350 19554 1211 1 3 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.194 -0.034 19554 1212 1 3 . 1 1 130 130 PHE C C 130 172.430 172.430 173.923 -1.493 19554 1213 1 3 . 1 1 130 130 PHE CA C 130 55.000 55.000 56.190 -1.190 19554 1214 1 3 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.073 0.327 19554 1215 1 3 . 1 1 130 130 PHE H H 130 8.660 8.660 8.364 0.296 19554 1216 1 3 . 1 1 131 131 LEU N N 131 130.250 130.250 128.632 1.618 19554 1217 1 3 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.876 0.104 19554 1218 1 3 . 1 1 131 131 LEU CA C 131 49.670 49.670 50.876 -1.206 19554 1219 1 3 . 1 1 131 131 LEU CB C 131 44.330 44.330 41.796 2.534 19554 1220 1 3 . 1 1 131 131 LEU H H 131 8.550 8.550 8.210 0.340 19554 1221 1 3 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.643 -0.643 19554 1222 1 3 . 1 1 132 132 PRO C C 132 179.380 179.380 178.439 0.941 19554 1223 1 3 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.991 -0.831 19554 1224 1 3 . 1 1 133 133 GLY N N 133 111.470 111.470 112.804 -1.334 19554 1225 1 3 . 1 1 133 133 GLY C C 133 175.590 175.590 176.271 -0.681 19554 1226 1 3 . 1 1 133 133 GLY CA C 133 47.530 47.530 47.314 0.216 19554 1227 1 3 . 1 1 133 133 GLY H H 133 9.140 9.140 8.967 0.173 19554 1228 1 3 . 1 1 134 134 SER HA H 134 4.350 4.350 4.264 0.086 19554 1229 1 3 . 1 1 134 134 SER C C 134 175.280 175.280 175.472 -0.192 19554 1230 1 3 . 1 1 134 134 SER CA C 134 59.210 59.210 60.800 -1.590 19554 1231 1 3 . 1 1 134 134 SER CB C 134 62.730 62.730 62.877 -0.147 19554 1232 1 3 . 1 1 135 135 LEU N N 135 118.770 118.770 121.039 -2.269 19554 1233 1 3 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.288 0.292 19554 1234 1 3 . 1 1 135 135 LEU C C 135 177.500 177.500 178.310 -0.810 19554 1235 1 3 . 1 1 135 135 LEU CA C 135 53.770 53.770 56.754 -2.984 19554 1236 1 3 . 1 1 135 135 LEU H H 135 8.030 8.030 8.210 -0.180 19554 1237 1 3 . 1 1 136 136 VAL N N 136 123.080 123.080 117.377 5.703 19554 1238 1 3 . 1 1 136 136 VAL HA H 136 3.610 3.610 3.888 -0.278 19554 1239 1 3 . 1 1 136 136 VAL C C 136 173.150 173.150 176.062 -2.912 19554 1240 1 3 . 1 1 136 136 VAL CA C 136 65.220 65.220 64.960 0.260 19554 1241 1 3 . 1 1 136 136 VAL CB C 136 32.020 32.020 31.991 0.029 19554 1242 1 3 . 1 1 136 136 VAL H H 136 7.550 7.550 7.583 -0.033 19554 1243 1 3 . 1 1 137 137 ASP N N 137 117.300 117.300 119.109 -1.809 19554 1244 1 3 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.770 -0.430 19554 1245 1 3 . 1 1 137 137 ASP C C 137 174.840 174.840 175.101 -0.261 19554 1246 1 3 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.337 -1.266 19554 1247 1 3 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.593 2.867 19554 1248 1 3 . 1 1 137 137 ASP H H 137 7.940 7.940 7.674 0.266 19554 1249 1 3 . 1 1 138 138 VAL N N 138 116.750 116.750 121.069 -4.319 19554 1250 1 3 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.078 0.062 19554 1251 1 3 . 1 1 138 138 VAL CA C 138 61.190 61.190 62.733 -1.543 19554 1252 1 3 . 1 1 138 138 VAL CB C 138 33.330 33.330 33.541 -0.211 19554 1253 1 3 . 1 1 138 138 VAL H H 138 10.000 10.000 8.046 1.954 19554 1254 1 3 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.562 -0.052 19554 1255 1 3 . 1 1 140 140 PRO C C 140 175.860 175.860 176.075 -0.215 19554 1256 1 3 . 1 1 141 141 VAL N N 141 124.910 124.910 118.491 6.419 19554 1257 1 3 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.500 -0.600 19554 1258 1 3 . 1 1 141 141 VAL C C 141 175.120 175.120 175.042 0.078 19554 1259 1 3 . 1 1 141 141 VAL CA C 141 62.720 62.720 60.468 2.252 19554 1260 1 3 . 1 1 141 141 VAL CB C 141 31.870 31.870 33.851 -1.981 19554 1261 1 3 . 1 1 141 141 VAL H H 141 8.110 8.110 7.909 0.201 19554 1262 1 3 . 1 1 142 142 ARG N N 142 119.730 119.730 121.626 -1.896 19554 1263 1 3 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.488 0.132 19554 1264 1 3 . 1 1 142 142 ARG C C 142 173.520 173.520 175.560 -2.040 19554 1265 1 3 . 1 1 142 142 ARG CA C 142 53.020 53.020 56.750 -3.730 19554 1266 1 3 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.330 0.150 19554 1267 1 3 . 1 1 142 142 ARG H H 142 7.440 7.440 8.912 -1.472 19554 1268 1 3 . 1 1 143 143 ASP N N 143 119.780 119.780 121.796 -2.016 19554 1269 1 3 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.661 0.009 19554 1270 1 3 . 1 1 143 143 ASP C C 143 175.970 175.970 175.947 0.023 19554 1271 1 3 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.405 -0.375 19554 1272 1 3 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.483 0.247 19554 1273 1 3 . 1 1 143 143 ASP H H 143 7.880 7.880 8.205 -0.325 19554 1274 1 3 . 1 1 144 144 THR N N 144 110.060 110.060 115.773 -5.713 19554 1275 1 3 . 1 1 144 144 THR HA H 144 4.110 4.110 4.539 -0.429 19554 1276 1 3 . 1 1 144 144 THR C C 144 175.730 175.730 174.742 0.988 19554 1277 1 3 . 1 1 144 144 THR CA C 144 61.520 61.520 62.749 -1.229 19554 1278 1 3 . 1 1 144 144 THR CB C 144 68.610 68.610 68.859 -0.249 19554 1279 1 3 . 1 1 144 144 THR H H 144 8.030 8.030 8.491 -0.461 19554 1280 1 3 . 1 1 145 145 LEU N N 145 124.820 124.820 122.252 2.568 19554 1281 1 3 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.278 0.422 19554 1282 1 3 . 1 1 145 145 LEU C C 145 178.010 178.010 177.245 0.765 19554 1283 1 3 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.228 1.122 19554 1284 1 3 . 1 1 145 145 LEU CB C 145 42.100 42.100 42.032 0.068 19554 1285 1 3 . 1 1 145 145 LEU H H 145 8.050 8.050 7.890 0.160 19554 1286 1 3 . 1 1 146 146 HIS N N 146 116.310 116.310 117.325 -1.015 19554 1287 1 3 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.317 0.223 19554 1288 1 3 . 1 1 146 146 HIS C C 146 175.000 175.000 176.020 -1.020 19554 1289 1 3 . 1 1 146 146 HIS H H 146 8.120 8.120 8.215 -0.095 19554 1290 1 3 . 1 1 147 147 LEU N N 147 120.320 120.320 118.907 1.413 19554 1291 1 3 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.698 0.372 19554 1292 1 3 . 1 1 147 147 LEU C C 147 176.810 176.810 176.786 0.024 19554 1293 1 3 . 1 1 147 147 LEU CA C 147 54.710 54.710 56.221 -1.511 19554 1294 1 3 . 1 1 147 147 LEU CB C 147 41.960 41.960 42.326 -0.366 19554 1295 1 3 . 1 1 147 147 LEU H H 147 7.620 7.620 7.254 0.366 19554 1296 1 3 . 1 1 148 148 GLU N N 148 118.950 118.950 115.895 3.055 19554 1297 1 3 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.170 -0.390 19554 1298 1 3 . 1 1 148 148 GLU C C 148 177.480 177.480 176.235 1.245 19554 1299 1 3 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.518 2.912 19554 1300 1 3 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.934 -2.254 19554 1301 1 3 . 1 1 148 148 GLU H H 148 7.760 7.760 7.424 0.336 19554 1302 1 3 . 1 1 149 149 GLY N N 149 111.070 111.070 109.921 1.149 19554 1303 1 3 . 1 1 149 149 GLY C C 149 173.820 173.820 174.531 -0.711 19554 1304 1 3 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.398 0.132 19554 1305 1 3 . 1 1 149 149 GLY H H 149 8.630 8.630 8.238 0.392 19554 1306 1 3 . 1 1 150 150 LYS N N 150 119.380 119.380 122.642 -3.262 19554 1307 1 3 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.125 0.205 19554 1308 1 3 . 1 1 150 150 LYS C C 150 175.110 175.110 175.605 -0.495 19554 1309 1 3 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.890 -1.720 19554 1310 1 3 . 1 1 150 150 LYS CB C 150 33.550 33.550 32.975 0.575 19554 1311 1 3 . 1 1 150 150 LYS H H 150 7.520 7.520 8.164 -0.644 19554 1312 1 3 . 1 1 151 151 GLU N N 151 122.850 122.850 126.105 -3.255 19554 1313 1 3 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.536 -0.066 19554 1314 1 3 . 1 1 151 151 GLU C C 151 175.510 175.510 175.102 0.408 19554 1315 1 3 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.078 1.262 19554 1316 1 3 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.436 0.575 19554 1317 1 3 . 1 1 151 151 GLU H H 151 8.410 8.410 8.589 -0.179 19554 1318 1 3 . 1 1 152 152 LEU N N 152 127.520 127.520 125.659 1.861 19554 1319 1 3 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.598 -0.058 19554 1320 1 3 . 1 1 152 152 LEU C C 152 173.750 173.750 174.686 -0.936 19554 1321 1 3 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.183 -0.363 19554 1322 1 3 . 1 1 152 152 LEU H H 152 8.850 8.850 7.578 1.272 19554 1323 1 3 . 1 1 153 153 GLU N N 153 116.500 116.500 117.413 -0.913 19554 1324 1 3 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.437 0.143 19554 1325 1 3 . 1 1 153 153 GLU C C 153 175.120 175.120 174.828 0.292 19554 1326 1 3 . 1 1 153 153 GLU CA C 153 55.160 55.160 55.005 0.155 19554 1327 1 3 . 1 1 153 153 GLU H H 153 7.110 7.110 8.338 -1.228 19554 1328 1 3 . 1 1 154 154 PHE N N 154 115.150 115.150 118.628 -3.478 19554 1329 1 3 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.862 -0.002 19554 1330 1 3 . 1 1 154 154 PHE C C 154 175.630 175.630 174.303 1.327 19554 1331 1 3 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.715 0.475 19554 1332 1 3 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.554 1.696 19554 1333 1 3 . 1 1 154 154 PHE H H 154 8.910 8.910 8.041 0.869 19554 1334 1 3 . 1 1 155 155 LYS N N 155 114.560 114.560 118.888 -4.328 19554 1335 1 3 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.640 0.070 19554 1336 1 3 . 1 1 155 155 LYS C C 155 176.500 176.500 174.520 1.980 19554 1337 1 3 . 1 1 155 155 LYS CA C 155 53.600 53.600 54.982 -1.382 19554 1338 1 3 . 1 1 155 155 LYS CB C 155 33.960 33.960 36.663 -2.703 19554 1339 1 3 . 1 1 155 155 LYS H H 155 8.100 8.100 8.580 -0.480 19554 1340 1 3 . 1 1 156 156 VAL N N 156 124.530 124.530 121.613 2.917 19554 1341 1 3 . 1 1 156 156 VAL C C 156 175.630 175.630 174.715 0.915 19554 1342 1 3 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.761 -1.071 19554 1343 1 3 . 1 1 156 156 VAL CB C 156 31.600 31.600 32.507 -0.907 19554 1344 1 3 . 1 1 156 156 VAL H H 156 9.920 9.920 8.073 1.847 19554 1345 1 3 . 1 1 157 157 ILE N N 157 119.590 119.590 127.900 -8.310 19554 1346 1 3 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.360 0.360 19554 1347 1 3 . 1 1 157 157 ILE C C 157 176.190 176.190 174.239 1.951 19554 1348 1 3 . 1 1 157 157 ILE CA C 157 61.050 61.050 60.551 0.499 19554 1349 1 3 . 1 1 157 157 ILE CB C 157 39.170 39.170 40.551 -1.381 19554 1350 1 3 . 1 1 157 157 ILE H H 157 8.530 8.530 8.606 -0.076 19554 1351 1 3 . 1 1 158 158 LYS N N 158 122.460 122.460 119.210 3.250 19554 1352 1 3 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.124 0.076 19554 1353 1 3 . 1 1 158 158 LYS C C 158 173.000 173.000 173.473 -0.473 19554 1354 1 3 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.611 0.189 19554 1355 1 3 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.873 0.767 19554 1356 1 3 . 1 1 158 158 LYS H H 158 7.600 7.600 7.898 -0.298 19554 1357 1 3 . 1 1 159 159 LEU N N 159 125.430 125.430 121.173 4.257 19554 1358 1 3 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.841 -0.221 19554 1359 1 3 . 1 1 159 159 LEU C C 159 174.390 174.390 174.459 -0.069 19554 1360 1 3 . 1 1 159 159 LEU CA C 159 54.510 54.510 54.451 0.059 19554 1361 1 3 . 1 1 159 159 LEU H H 159 7.950 7.950 7.998 -0.048 19554 1362 1 3 . 1 1 160 160 ASP N N 160 124.740 124.740 121.702 3.038 19554 1363 1 3 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.989 -0.319 19554 1364 1 3 . 1 1 160 160 ASP C C 160 176.020 176.020 176.232 -0.212 19554 1365 1 3 . 1 1 160 160 ASP CA C 160 52.620 52.620 52.910 -0.290 19554 1366 1 3 . 1 1 160 160 ASP CB C 160 42.050 42.050 44.088 -2.038 19554 1367 1 3 . 1 1 160 160 ASP H H 160 8.760 8.760 8.102 0.658 19554 1368 1 3 . 1 1 161 161 GLN N N 161 126.490 126.490 123.878 2.612 19554 1369 1 3 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.244 -1.124 19554 1370 1 3 . 1 1 161 161 GLN C C 161 178.280 178.280 177.173 1.107 19554 1371 1 3 . 1 1 161 161 GLN CA C 161 58.770 58.770 57.805 0.965 19554 1372 1 3 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.787 -0.947 19554 1373 1 3 . 1 1 161 161 GLN H H 161 9.110 9.110 8.788 0.322 19554 1374 1 3 . 1 1 162 162 LYS N N 162 119.150 119.150 119.649 -0.499 19554 1375 1 3 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.131 -0.331 19554 1376 1 3 . 1 1 162 162 LYS C C 162 177.900 177.900 178.156 -0.256 19554 1377 1 3 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.605 0.095 19554 1378 1 3 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.484 -1.094 19554 1379 1 3 . 1 1 162 162 LYS H H 162 8.070 8.070 8.024 0.046 19554 1380 1 3 . 1 1 163 163 ARG N N 163 114.850 114.850 116.987 -2.137 19554 1381 1 3 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.324 -0.174 19554 1382 1 3 . 1 1 163 163 ARG C C 163 174.750 174.750 176.018 -1.268 19554 1383 1 3 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.610 -0.810 19554 1384 1 3 . 1 1 163 163 ARG H H 163 7.010 7.010 8.199 -1.189 19554 1385 1 3 . 1 1 164 164 ASN N N 164 117.810 117.810 116.165 1.645 19554 1386 1 3 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.389 -0.259 19554 1387 1 3 . 1 1 164 164 ASN C C 164 173.880 173.880 173.533 0.347 19554 1388 1 3 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.013 -0.053 19554 1389 1 3 . 1 1 164 164 ASN CB C 164 37.530 37.530 37.759 -0.229 19554 1390 1 3 . 1 1 164 164 ASN H H 164 7.750 7.750 8.095 -0.345 19554 1391 1 3 . 1 1 165 165 ASN N N 165 116.170 116.170 116.454 -0.284 19554 1392 1 3 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.973 0.087 19554 1393 1 3 . 1 1 165 165 ASN C C 165 172.990 172.990 172.611 0.379 19554 1394 1 3 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.989 -0.549 19554 1395 1 3 . 1 1 165 165 ASN CB C 165 41.820 41.820 42.063 -0.243 19554 1396 1 3 . 1 1 165 165 ASN H H 165 8.020 8.020 7.673 0.347 19554 1397 1 3 . 1 1 166 166 VAL N N 166 124.790 124.790 123.309 1.481 19554 1398 1 3 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.408 0.092 19554 1399 1 3 . 1 1 166 166 VAL C C 166 174.190 174.190 173.214 0.976 19554 1400 1 3 . 1 1 166 166 VAL CA C 166 61.030 61.030 60.473 0.557 19554 1401 1 3 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.311 0.309 19554 1402 1 3 . 1 1 166 166 VAL H H 166 8.380 8.380 8.529 -0.149 19554 1403 1 3 . 1 1 167 167 VAL N N 167 128.000 128.000 121.681 6.319 19554 1404 1 3 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.560 0.690 19554 1405 1 3 . 1 1 167 167 VAL C C 167 176.000 176.000 173.765 2.235 19554 1406 1 3 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.751 0.859 19554 1407 1 3 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.864 -0.964 19554 1408 1 3 . 1 1 167 167 VAL H H 167 8.710 8.710 7.735 0.975 19554 1409 1 3 . 1 1 168 168 VAL N N 168 118.360 118.360 115.695 2.665 19554 1410 1 3 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.577 0.663 19554 1411 1 3 . 1 1 168 168 VAL C C 168 172.800 172.800 175.281 -2.481 19554 1412 1 3 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.625 -1.765 19554 1413 1 3 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.848 1.502 19554 1414 1 3 . 1 1 168 168 VAL H H 168 8.560 8.560 7.599 0.961 19554 1415 1 3 . 1 1 169 169 SER N N 169 106.720 106.720 119.362 -12.642 19554 1416 1 3 . 1 1 169 169 SER HA H 169 4.480 4.480 4.681 -0.201 19554 1417 1 3 . 1 1 169 169 SER C C 169 175.950 175.950 176.068 -0.118 19554 1418 1 3 . 1 1 169 169 SER CA C 169 55.550 55.550 57.301 -1.752 19554 1419 1 3 . 1 1 169 169 SER CB C 169 64.980 64.980 65.032 -0.052 19554 1420 1 3 . 1 1 169 169 SER H H 169 8.600 8.600 8.527 0.073 19554 1421 1 3 . 1 1 170 170 ARG N N 170 129.620 129.620 123.399 6.221 19554 1422 1 3 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.139 0.571 19554 1423 1 3 . 1 1 170 170 ARG C C 170 177.870 177.870 177.907 -0.037 19554 1424 1 3 . 1 1 170 170 ARG CA C 170 57.150 57.150 59.147 -1.997 19554 1425 1 3 . 1 1 170 170 ARG H H 170 7.610 7.610 8.870 -1.260 19554 1426 1 3 . 1 1 171 171 ARG N N 171 122.230 122.230 118.658 3.572 19554 1427 1 3 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.267 -0.797 19554 1428 1 3 . 1 1 171 171 ARG C C 171 175.760 175.760 178.126 -2.366 19554 1429 1 3 . 1 1 171 171 ARG CA C 171 59.430 59.430 57.708 1.722 19554 1430 1 3 . 1 1 171 171 ARG CB C 171 30.410 30.410 30.133 0.277 19554 1431 1 3 . 1 1 171 171 ARG H H 171 8.260 8.260 8.395 -0.135 19554 1432 1 3 . 1 1 172 172 ALA N N 172 116.490 116.490 122.487 -5.997 19554 1433 1 3 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.152 -0.102 19554 1434 1 3 . 1 1 172 172 ALA C C 172 179.480 179.480 179.225 0.255 19554 1435 1 3 . 1 1 172 172 ALA CA C 172 54.010 54.010 55.166 -1.156 19554 1436 1 3 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.106 0.784 19554 1437 1 3 . 1 1 172 172 ALA H H 172 7.760 7.760 8.011 -0.251 19554 1438 1 3 . 1 1 173 173 VAL N N 173 116.440 116.440 117.766 -1.326 19554 1439 1 3 . 1 1 173 173 VAL HA H 173 3.470 3.470 4.075 -0.605 19554 1440 1 3 . 1 1 173 173 VAL C C 173 177.680 177.680 177.237 0.443 19554 1441 1 3 . 1 1 173 173 VAL CA C 173 65.080 65.080 64.118 0.962 19554 1442 1 3 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.638 0.242 19554 1443 1 3 . 1 1 173 173 VAL H H 173 7.210 7.210 7.576 -0.366 19554 1444 1 3 . 1 1 174 174 ILE N N 174 119.790 119.790 120.682 -0.892 19554 1445 1 3 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.696 -0.016 19554 1446 1 3 . 1 1 174 174 ILE C C 174 178.310 178.310 177.987 0.323 19554 1447 1 3 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.163 -0.393 19554 1448 1 3 . 1 1 174 174 ILE CB C 174 38.450 38.450 36.636 1.814 19554 1449 1 3 . 1 1 174 174 ILE H H 174 7.160 7.160 7.839 -0.679 19554 1450 1 3 . 1 1 175 175 GLU N N 175 117.810 117.810 120.653 -2.843 19554 1451 1 3 . 1 1 175 175 GLU HA H 175 4.030 4.030 3.924 0.106 19554 1452 1 3 . 1 1 175 175 GLU C C 175 177.170 177.170 179.257 -2.087 19554 1453 1 3 . 1 1 175 175 GLU CA C 175 57.190 57.190 59.748 -2.558 19554 1454 1 3 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.264 0.376 19554 1455 1 3 . 1 1 175 175 GLU H H 175 8.250 8.250 7.736 0.514 19554 1456 1 3 . 1 1 176 176 SER N N 176 114.300 114.300 114.131 0.169 19554 1457 1 3 . 1 1 176 176 SER HA H 176 4.320 4.320 4.110 0.210 19554 1458 1 3 . 1 1 176 176 SER C C 176 174.930 174.930 176.743 -1.813 19554 1459 1 3 . 1 1 176 176 SER CA C 176 59.060 59.060 61.794 -2.734 19554 1460 1 3 . 1 1 176 176 SER CB C 176 63.640 63.640 62.944 0.696 19554 1461 1 3 . 1 1 176 176 SER H H 176 7.460 7.460 7.689 -0.229 19554 1462 1 3 . 1 1 177 177 GLU N N 177 121.860 121.860 121.082 0.778 19554 1463 1 3 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.006 0.164 19554 1464 1 3 . 1 1 177 177 GLU C C 177 176.340 176.340 178.203 -1.863 19554 1465 1 3 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.680 -2.040 19554 1466 1 3 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.896 -0.146 19554 1467 1 3 . 1 1 177 177 GLU H H 177 7.890 7.890 7.562 0.328 19554 1468 1 3 . 1 1 178 178 ASN N N 178 119.030 119.030 118.162 0.868 19554 1469 1 3 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.762 -0.062 19554 1470 1 3 . 1 1 178 178 ASN C C 178 174.230 174.230 175.037 -0.807 19554 1471 1 3 . 1 1 178 178 ASN CA C 178 53.010 53.010 51.691 1.319 19554 1472 1 3 . 1 1 178 178 ASN CB C 178 39.080 39.080 37.632 1.448 19554 1473 1 3 . 1 1 178 178 ASN H H 178 8.110 8.110 7.975 0.135 19554 1474 1 4 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.135 0.025 19554 1475 1 4 . 1 1 89 89 ALA C C 89 179.720 179.720 179.174 0.546 19554 1476 1 4 . 1 1 89 89 ALA CA C 89 54.490 54.490 53.931 0.559 19554 1477 1 4 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.743 -0.523 19554 1478 1 4 . 1 1 90 90 LYS N N 90 119.500 119.500 118.361 1.139 19554 1479 1 4 . 1 1 90 90 LYS C C 90 179.090 179.090 178.481 0.609 19554 1480 1 4 . 1 1 90 90 LYS H H 90 7.980 7.980 8.461 -0.481 19554 1481 1 4 . 1 1 91 91 ARG N N 91 120.510 120.510 118.608 1.902 19554 1482 1 4 . 1 1 91 91 ARG HA H 91 4.150 4.150 3.903 0.247 19554 1483 1 4 . 1 1 91 91 ARG CA C 91 58.300 58.300 58.029 0.271 19554 1484 1 4 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.106 0.914 19554 1485 1 4 . 1 1 91 91 ARG H H 91 8.010 8.010 8.463 -0.453 19554 1486 1 4 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.652 1.468 19554 1487 1 4 . 1 1 92 92 HIS C C 92 177.360 177.360 176.223 1.137 19554 1488 1 4 . 1 1 92 92 HIS CB C 92 29.870 29.870 28.442 1.428 19554 1489 1 4 . 1 1 93 93 GLU N N 93 118.470 118.470 118.670 -0.200 19554 1490 1 4 . 1 1 93 93 GLU HA H 93 3.900 3.900 3.900 0.000 19554 1491 1 4 . 1 1 93 93 GLU C C 93 178.740 178.740 178.159 0.581 19554 1492 1 4 . 1 1 93 93 GLU CA C 93 59.160 59.160 57.916 1.244 19554 1493 1 4 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.724 -0.764 19554 1494 1 4 . 1 1 93 93 GLU H H 93 8.190 8.190 7.139 1.051 19554 1495 1 4 . 1 1 94 94 ALA N N 94 123.080 123.080 123.072 0.008 19554 1496 1 4 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.152 -0.082 19554 1497 1 4 . 1 1 94 94 ALA C C 94 180.330 180.330 179.846 0.484 19554 1498 1 4 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.453 0.487 19554 1499 1 4 . 1 1 94 94 ALA CB C 94 18.250 18.250 17.962 0.288 19554 1500 1 4 . 1 1 94 94 ALA H H 94 8.090 8.090 7.416 0.674 19554 1501 1 4 . 1 1 95 95 TRP N N 95 119.190 119.190 119.296 -0.106 19554 1502 1 4 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.418 -0.378 19554 1503 1 4 . 1 1 95 95 TRP C C 95 178.590 178.590 177.926 0.664 19554 1504 1 4 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.696 2.304 19554 1505 1 4 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.706 1.454 19554 1506 1 4 . 1 1 95 95 TRP H H 95 8.060 8.060 7.957 0.103 19554 1507 1 4 . 1 1 96 96 ILE N N 96 119.570 119.570 118.908 0.662 19554 1508 1 4 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.644 0.166 19554 1509 1 4 . 1 1 96 96 ILE C C 96 179.300 179.300 178.150 1.150 19554 1510 1 4 . 1 1 96 96 ILE CA C 96 64.540 64.540 65.114 -0.574 19554 1511 1 4 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.595 -0.465 19554 1512 1 4 . 1 1 96 96 ILE H H 96 7.850 7.850 7.580 0.270 19554 1513 1 4 . 1 1 97 97 THR N N 97 117.030 117.030 114.304 2.726 19554 1514 1 4 . 1 1 97 97 THR HA H 97 3.830 3.830 4.160 -0.330 19554 1515 1 4 . 1 1 97 97 THR C C 97 177.080 177.080 176.695 0.385 19554 1516 1 4 . 1 1 97 97 THR CA C 97 66.430 66.430 65.862 0.568 19554 1517 1 4 . 1 1 97 97 THR CB C 97 68.450 68.450 69.174 -0.725 19554 1518 1 4 . 1 1 97 97 THR H H 97 7.900 7.900 7.996 -0.096 19554 1519 1 4 . 1 1 98 98 LEU N N 98 123.110 123.110 119.733 3.377 19554 1520 1 4 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.243 -0.313 19554 1521 1 4 . 1 1 98 98 LEU C C 98 178.160 178.160 178.807 -0.647 19554 1522 1 4 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.532 0.198 19554 1523 1 4 . 1 1 98 98 LEU CB C 98 41.540 41.540 40.812 0.728 19554 1524 1 4 . 1 1 98 98 LEU H H 98 7.830 7.830 7.753 0.077 19554 1525 1 4 . 1 1 99 99 GLU N N 99 120.520 120.520 120.564 -0.044 19554 1526 1 4 . 1 1 99 99 GLU HA H 99 3.880 3.880 3.826 0.054 19554 1527 1 4 . 1 1 99 99 GLU C C 99 179.010 179.010 179.054 -0.044 19554 1528 1 4 . 1 1 99 99 GLU CA C 99 59.920 59.920 60.011 -0.091 19554 1529 1 4 . 1 1 99 99 GLU CB C 99 29.350 29.350 28.965 0.385 19554 1530 1 4 . 1 1 99 99 GLU H H 99 8.560 8.560 8.645 -0.085 19554 1531 1 4 . 1 1 100 100 LYS N N 100 119.950 119.950 117.818 2.132 19554 1532 1 4 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.167 -0.137 19554 1533 1 4 . 1 1 100 100 LYS C C 100 177.870 177.870 178.738 -0.868 19554 1534 1 4 . 1 1 100 100 LYS CA C 100 58.570 58.570 59.093 -0.522 19554 1535 1 4 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.178 -0.458 19554 1536 1 4 . 1 1 100 100 LYS H H 100 7.800 7.800 7.705 0.095 19554 1537 1 4 . 1 1 101 101 ALA N N 101 120.690 120.690 121.565 -0.875 19554 1538 1 4 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.207 -0.187 19554 1539 1 4 . 1 1 101 101 ALA C C 101 180.990 180.990 180.022 0.968 19554 1540 1 4 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.669 0.451 19554 1541 1 4 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.526 -0.946 19554 1542 1 4 . 1 1 101 101 ALA H H 101 7.800 7.800 7.776 0.024 19554 1543 1 4 . 1 1 102 102 TYR N N 102 118.440 118.440 119.333 -0.893 19554 1544 1 4 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.195 0.125 19554 1545 1 4 . 1 1 102 102 TYR C C 102 178.590 178.590 178.551 0.039 19554 1546 1 4 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.764 -0.954 19554 1547 1 4 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.769 0.921 19554 1548 1 4 . 1 1 102 102 TYR H H 102 8.580 8.580 7.797 0.783 19554 1549 1 4 . 1 1 103 103 GLU N N 103 120.860 120.860 119.555 1.305 19554 1550 1 4 . 1 1 103 103 GLU HA H 103 3.590 3.590 4.090 -0.500 19554 1551 1 4 . 1 1 103 103 GLU C C 103 178.100 178.100 177.079 1.021 19554 1552 1 4 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.877 0.203 19554 1553 1 4 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.417 0.003 19554 1554 1 4 . 1 1 103 103 GLU H H 103 8.290 8.290 8.067 0.223 19554 1555 1 4 . 1 1 104 104 ASP N N 104 116.120 116.120 117.476 -1.356 19554 1556 1 4 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.737 -0.127 19554 1557 1 4 . 1 1 104 104 ASP C C 104 174.970 174.970 174.923 0.047 19554 1558 1 4 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.466 0.654 19554 1559 1 4 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.162 0.318 19554 1560 1 4 . 1 1 104 104 ASP H H 104 8.120 8.120 7.506 0.614 19554 1561 1 4 . 1 1 105 105 ALA N N 105 123.330 123.330 119.872 3.458 19554 1562 1 4 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.020 0.130 19554 1563 1 4 . 1 1 105 105 ALA C C 105 177.130 177.130 175.863 1.267 19554 1564 1 4 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.863 -0.223 19554 1565 1 4 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.921 -0.621 19554 1566 1 4 . 1 1 105 105 ALA H H 105 7.710 7.710 7.770 -0.060 19554 1567 1 4 . 1 1 106 106 GLU N N 106 118.950 118.950 118.669 0.281 19554 1568 1 4 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.201 0.099 19554 1569 1 4 . 1 1 106 106 GLU C C 106 176.730 176.730 176.036 0.694 19554 1570 1 4 . 1 1 106 106 GLU CA C 106 55.440 55.440 55.777 -0.337 19554 1571 1 4 . 1 1 106 106 GLU CB C 106 31.760 31.760 31.461 0.299 19554 1572 1 4 . 1 1 106 106 GLU H H 106 8.440 8.440 7.845 0.595 19554 1573 1 4 . 1 1 107 107 THR N N 107 118.780 118.780 114.791 3.989 19554 1574 1 4 . 1 1 107 107 THR HA H 107 4.550 4.550 4.517 0.033 19554 1575 1 4 . 1 1 107 107 THR C C 107 174.250 174.250 174.666 -0.416 19554 1576 1 4 . 1 1 107 107 THR CA C 107 62.360 62.360 62.148 0.212 19554 1577 1 4 . 1 1 107 107 THR CB C 107 69.390 69.390 69.482 -0.092 19554 1578 1 4 . 1 1 107 107 THR H H 107 8.740 8.740 8.184 0.556 19554 1579 1 4 . 1 1 108 108 VAL N N 108 120.540 120.540 119.475 1.065 19554 1580 1 4 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.603 0.027 19554 1581 1 4 . 1 1 108 108 VAL C C 108 174.440 174.440 173.523 0.917 19554 1582 1 4 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.960 -0.960 19554 1583 1 4 . 1 1 108 108 VAL CB C 108 34.650 34.650 34.871 -0.221 19554 1584 1 4 . 1 1 108 108 VAL H H 108 9.040 9.040 8.021 1.019 19554 1585 1 4 . 1 1 109 109 THR N N 109 115.100 115.100 115.958 -0.858 19554 1586 1 4 . 1 1 109 109 THR HA H 109 5.380 5.380 4.670 0.710 19554 1587 1 4 . 1 1 109 109 THR C C 109 174.580 174.580 173.610 0.970 19554 1588 1 4 . 1 1 109 109 THR CA C 109 60.410 60.410 62.248 -1.838 19554 1589 1 4 . 1 1 109 109 THR CB C 109 70.610 70.610 70.240 0.370 19554 1590 1 4 . 1 1 109 109 THR H H 109 8.170 8.170 8.330 -0.160 19554 1591 1 4 . 1 1 110 110 GLY N N 110 108.580 108.580 115.083 -6.503 19554 1592 1 4 . 1 1 110 110 GLY C C 110 170.810 170.810 171.755 -0.945 19554 1593 1 4 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.232 0.148 19554 1594 1 4 . 1 1 110 110 GLY H H 110 8.780 8.780 8.120 0.660 19554 1595 1 4 . 1 1 111 111 VAL N N 111 116.930 116.930 120.950 -4.020 19554 1596 1 4 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.810 -0.030 19554 1597 1 4 . 1 1 111 111 VAL C C 111 176.060 176.060 175.706 0.354 19554 1598 1 4 . 1 1 111 111 VAL CA C 111 59.770 59.770 60.267 -0.498 19554 1599 1 4 . 1 1 111 111 VAL CB C 111 35.750 35.750 35.042 0.708 19554 1600 1 4 . 1 1 111 111 VAL H H 111 7.810 7.810 8.425 -0.615 19554 1601 1 4 . 1 1 112 112 ILE N N 112 127.060 127.060 129.005 -1.945 19554 1602 1 4 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.142 0.088 19554 1603 1 4 . 1 1 112 112 ILE C C 112 176.180 176.180 175.469 0.711 19554 1604 1 4 . 1 1 112 112 ILE CA C 112 62.220 62.220 63.008 -0.788 19554 1605 1 4 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.585 0.895 19554 1606 1 4 . 1 1 112 112 ILE H H 112 9.240 9.240 8.062 1.178 19554 1607 1 4 . 1 1 113 113 ASN N N 113 127.510 127.510 126.166 1.344 19554 1608 1 4 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.850 0.090 19554 1609 1 4 . 1 1 113 113 ASN C C 113 175.020 175.020 175.733 -0.713 19554 1610 1 4 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.935 -1.645 19554 1611 1 4 . 1 1 113 113 ASN CB C 113 39.580 39.580 41.006 -1.426 19554 1612 1 4 . 1 1 113 113 ASN H H 113 9.010 9.010 8.110 0.900 19554 1613 1 4 . 1 1 114 114 GLY N N 114 107.150 107.150 108.145 -0.995 19554 1614 1 4 . 1 1 114 114 GLY C C 114 171.360 171.360 172.136 -0.776 19554 1615 1 4 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.544 0.976 19554 1616 1 4 . 1 1 114 114 GLY H H 114 7.620 7.620 7.773 -0.153 19554 1617 1 4 . 1 1 115 115 LYS N N 115 121.670 121.670 122.830 -1.160 19554 1618 1 4 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.416 0.174 19554 1619 1 4 . 1 1 115 115 LYS C C 115 175.950 175.950 174.790 1.160 19554 1620 1 4 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.711 1.229 19554 1621 1 4 . 1 1 115 115 LYS CB C 115 34.040 34.040 33.932 0.108 19554 1622 1 4 . 1 1 115 115 LYS H H 115 8.550 8.550 8.234 0.316 19554 1623 1 4 . 1 1 116 116 VAL N N 116 118.750 118.750 119.709 -0.959 19554 1624 1 4 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.449 0.021 19554 1625 1 4 . 1 1 116 116 VAL C C 116 175.110 175.110 174.902 0.208 19554 1626 1 4 . 1 1 116 116 VAL CA C 116 59.030 59.030 58.836 0.194 19554 1627 1 4 . 1 1 116 116 VAL CB C 116 35.500 35.500 33.253 2.247 19554 1628 1 4 . 1 1 116 116 VAL H H 116 8.070 8.070 7.722 0.348 19554 1629 1 4 . 1 1 117 117 LYS N N 117 122.520 122.520 121.811 0.709 19554 1630 1 4 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.033 -0.103 19554 1631 1 4 . 1 1 117 117 LYS C C 117 177.970 177.970 176.945 1.025 19554 1632 1 4 . 1 1 117 117 LYS CA C 117 58.670 58.670 56.606 2.064 19554 1633 1 4 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.113 -0.173 19554 1634 1 4 . 1 1 117 117 LYS H H 117 8.250 8.250 8.406 -0.156 19554 1635 1 4 . 1 1 118 118 GLY N N 118 113.440 113.440 112.388 1.052 19554 1636 1 4 . 1 1 118 118 GLY C C 118 175.540 175.540 173.806 1.734 19554 1637 1 4 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.142 0.058 19554 1638 1 4 . 1 1 118 118 GLY H H 118 8.820 8.820 7.967 0.853 19554 1639 1 4 . 1 1 119 119 GLY N N 119 109.130 109.130 106.685 2.445 19554 1640 1 4 . 1 1 119 119 GLY C C 119 170.530 170.530 172.300 -1.770 19554 1641 1 4 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.652 3.188 19554 1642 1 4 . 1 1 119 119 GLY H H 119 7.930 7.930 7.548 0.382 19554 1643 1 4 . 1 1 120 120 PHE N N 120 123.370 123.370 116.597 6.773 19554 1644 1 4 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.620 0.650 19554 1645 1 4 . 1 1 120 120 PHE C C 120 174.260 174.260 174.068 0.192 19554 1646 1 4 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.040 -0.700 19554 1647 1 4 . 1 1 120 120 PHE CB C 120 43.730 43.730 43.548 0.182 19554 1648 1 4 . 1 1 120 120 PHE H H 120 8.820 8.820 7.317 1.503 19554 1649 1 4 . 1 1 121 121 THR N N 121 114.670 114.670 117.111 -2.441 19554 1650 1 4 . 1 1 121 121 THR HA H 121 5.000 5.000 5.150 -0.150 19554 1651 1 4 . 1 1 121 121 THR C C 121 173.780 173.780 174.048 -0.268 19554 1652 1 4 . 1 1 121 121 THR CA C 121 60.500 60.500 60.020 0.480 19554 1653 1 4 . 1 1 121 121 THR CB C 121 69.910 69.910 70.245 -0.335 19554 1654 1 4 . 1 1 121 121 THR H H 121 8.670 8.670 9.027 -0.357 19554 1655 1 4 . 1 1 122 122 VAL N N 122 124.340 124.340 122.000 2.340 19554 1656 1 4 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.342 0.258 19554 1657 1 4 . 1 1 122 122 VAL C C 122 174.240 174.240 174.228 0.012 19554 1658 1 4 . 1 1 122 122 VAL CA C 122 59.300 59.300 60.318 -1.018 19554 1659 1 4 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.809 0.051 19554 1660 1 4 . 1 1 122 122 VAL H H 122 8.560 8.560 8.241 0.319 19554 1661 1 4 . 1 1 123 123 GLU N N 123 126.950 126.950 124.684 2.266 19554 1662 1 4 . 1 1 123 123 GLU HA H 123 4.610 4.610 5.160 -0.550 19554 1663 1 4 . 1 1 123 123 GLU C C 123 175.840 175.840 175.206 0.634 19554 1664 1 4 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.929 0.231 19554 1665 1 4 . 1 1 123 123 GLU CB C 123 30.910 30.910 31.858 -0.948 19554 1666 1 4 . 1 1 123 123 GLU H H 123 8.950 8.950 8.194 0.756 19554 1667 1 4 . 1 1 124 124 LEU N N 124 129.580 129.580 126.646 2.934 19554 1668 1 4 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.794 -0.134 19554 1669 1 4 . 1 1 124 124 LEU C C 124 175.350 175.350 175.921 -0.571 19554 1670 1 4 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.980 -0.780 19554 1671 1 4 . 1 1 124 124 LEU CB C 124 42.190 42.190 42.438 -0.248 19554 1672 1 4 . 1 1 124 124 LEU H H 124 8.940 8.940 8.953 -0.013 19554 1673 1 4 . 1 1 125 125 ASN N N 125 121.880 121.880 118.260 3.620 19554 1674 1 4 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.459 -0.269 19554 1675 1 4 . 1 1 125 125 ASN C C 125 174.690 174.690 175.539 -0.849 19554 1676 1 4 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.157 -0.277 19554 1677 1 4 . 1 1 125 125 ASN CB C 125 37.250 37.250 36.938 0.312 19554 1678 1 4 . 1 1 125 125 ASN H H 125 8.950 8.950 9.229 -0.279 19554 1679 1 4 . 1 1 126 126 GLY N N 126 103.140 103.140 103.471 -0.331 19554 1680 1 4 . 1 1 126 126 GLY C C 126 173.680 173.680 174.516 -0.836 19554 1681 1 4 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.023 -0.143 19554 1682 1 4 . 1 1 126 126 GLY H H 126 8.070 8.070 8.456 -0.386 19554 1683 1 4 . 1 1 127 127 ILE N N 127 122.120 122.120 122.856 -0.736 19554 1684 1 4 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.728 0.242 19554 1685 1 4 . 1 1 127 127 ILE C C 127 174.370 174.370 175.209 -0.839 19554 1686 1 4 . 1 1 127 127 ILE CA C 127 59.530 59.530 61.412 -1.882 19554 1687 1 4 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.355 0.615 19554 1688 1 4 . 1 1 127 127 ILE H H 127 7.380 7.380 7.338 0.042 19554 1689 1 4 . 1 1 128 128 ARG N N 128 126.630 126.630 125.863 0.767 19554 1690 1 4 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.294 -0.654 19554 1691 1 4 . 1 1 128 128 ARG C C 128 174.720 174.720 175.448 -0.728 19554 1692 1 4 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.922 0.728 19554 1693 1 4 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.729 -0.729 19554 1694 1 4 . 1 1 128 128 ARG H H 128 8.170 8.170 8.501 -0.331 19554 1695 1 4 . 1 1 129 129 ALA N N 129 127.320 127.320 126.950 0.370 19554 1696 1 4 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.556 0.294 19554 1697 1 4 . 1 1 129 129 ALA C C 129 174.970 174.970 175.666 -0.696 19554 1698 1 4 . 1 1 129 129 ALA CA C 129 49.660 49.660 50.171 -0.511 19554 1699 1 4 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.025 3.365 19554 1700 1 4 . 1 1 129 129 ALA H H 129 9.240 9.240 8.824 0.416 19554 1701 1 4 . 1 1 130 130 PHE N N 130 121.060 121.060 118.776 2.284 19554 1702 1 4 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.480 -0.320 19554 1703 1 4 . 1 1 130 130 PHE C C 130 172.430 172.430 173.765 -1.335 19554 1704 1 4 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.025 -2.025 19554 1705 1 4 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.997 -0.597 19554 1706 1 4 . 1 1 130 130 PHE H H 130 8.660 8.660 8.368 0.292 19554 1707 1 4 . 1 1 131 131 LEU N N 131 130.250 130.250 126.423 3.827 19554 1708 1 4 . 1 1 131 131 LEU HA H 131 4.980 4.980 5.100 -0.120 19554 1709 1 4 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.562 -1.892 19554 1710 1 4 . 1 1 131 131 LEU CB C 131 44.330 44.330 43.256 1.074 19554 1711 1 4 . 1 1 131 131 LEU H H 131 8.550 8.550 8.751 -0.201 19554 1712 1 4 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.604 -0.604 19554 1713 1 4 . 1 1 132 132 PRO C C 132 179.380 179.380 178.298 1.082 19554 1714 1 4 . 1 1 132 132 PRO CA C 132 62.160 62.160 63.075 -0.915 19554 1715 1 4 . 1 1 133 133 GLY N N 133 111.470 111.470 110.876 0.594 19554 1716 1 4 . 1 1 133 133 GLY C C 133 175.590 175.590 176.827 -1.237 19554 1717 1 4 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.948 0.582 19554 1718 1 4 . 1 1 133 133 GLY H H 133 9.140 9.140 8.835 0.305 19554 1719 1 4 . 1 1 134 134 SER HA H 134 4.350 4.350 4.492 -0.142 19554 1720 1 4 . 1 1 134 134 SER C C 134 175.280 175.280 174.329 0.951 19554 1721 1 4 . 1 1 134 134 SER CA C 134 59.210 59.210 59.617 -0.407 19554 1722 1 4 . 1 1 134 134 SER CB C 134 62.730 62.730 63.542 -0.812 19554 1723 1 4 . 1 1 135 135 LEU N N 135 118.770 118.770 121.975 -3.205 19554 1724 1 4 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.768 -0.188 19554 1725 1 4 . 1 1 135 135 LEU C C 135 177.500 177.500 176.576 0.924 19554 1726 1 4 . 1 1 135 135 LEU CA C 135 53.770 53.770 53.658 0.112 19554 1727 1 4 . 1 1 135 135 LEU H H 135 8.030 8.030 7.622 0.408 19554 1728 1 4 . 1 1 136 136 VAL N N 136 123.080 123.080 120.778 2.302 19554 1729 1 4 . 1 1 136 136 VAL HA H 136 3.610 3.610 3.734 -0.124 19554 1730 1 4 . 1 1 136 136 VAL C C 136 173.150 173.150 175.961 -2.811 19554 1731 1 4 . 1 1 136 136 VAL CA C 136 65.220 65.220 65.302 -0.082 19554 1732 1 4 . 1 1 136 136 VAL CB C 136 32.020 32.020 32.378 -0.358 19554 1733 1 4 . 1 1 136 136 VAL H H 136 7.550 7.550 7.410 0.140 19554 1734 1 4 . 1 1 137 137 ASP N N 137 117.300 117.300 113.586 3.714 19554 1735 1 4 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.802 -0.462 19554 1736 1 4 . 1 1 137 137 ASP C C 137 174.840 174.840 174.858 -0.018 19554 1737 1 4 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.388 -1.318 19554 1738 1 4 . 1 1 137 137 ASP CB C 137 44.460 44.460 42.994 1.466 19554 1739 1 4 . 1 1 137 137 ASP H H 137 7.940 7.940 7.972 -0.032 19554 1740 1 4 . 1 1 138 138 VAL N N 138 116.750 116.750 120.433 -3.683 19554 1741 1 4 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.404 -0.264 19554 1742 1 4 . 1 1 138 138 VAL CA C 138 61.190 61.190 61.896 -0.706 19554 1743 1 4 . 1 1 138 138 VAL CB C 138 33.330 33.330 32.254 1.076 19554 1744 1 4 . 1 1 138 138 VAL H H 138 10.000 10.000 8.510 1.490 19554 1745 1 4 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.673 -0.163 19554 1746 1 4 . 1 1 140 140 PRO C C 140 175.860 175.860 177.499 -1.639 19554 1747 1 4 . 1 1 141 141 VAL N N 141 124.910 124.910 114.665 10.245 19554 1748 1 4 . 1 1 141 141 VAL HA H 141 3.900 3.900 3.817 0.083 19554 1749 1 4 . 1 1 141 141 VAL C C 141 175.120 175.120 176.220 -1.100 19554 1750 1 4 . 1 1 141 141 VAL CA C 141 62.720 62.720 63.903 -1.183 19554 1751 1 4 . 1 1 141 141 VAL CB C 141 31.870 31.870 31.376 0.494 19554 1752 1 4 . 1 1 141 141 VAL H H 141 8.110 8.110 8.188 -0.078 19554 1753 1 4 . 1 1 142 142 ARG N N 142 119.730 119.730 121.482 -1.752 19554 1754 1 4 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.229 0.391 19554 1755 1 4 . 1 1 142 142 ARG C C 142 173.520 173.520 176.682 -3.162 19554 1756 1 4 . 1 1 142 142 ARG CA C 142 53.020 53.020 56.152 -3.132 19554 1757 1 4 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.238 0.241 19554 1758 1 4 . 1 1 142 142 ARG H H 142 7.440 7.440 7.909 -0.469 19554 1759 1 4 . 1 1 143 143 ASP N N 143 119.780 119.780 121.832 -2.052 19554 1760 1 4 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.428 0.242 19554 1761 1 4 . 1 1 143 143 ASP C C 143 175.970 175.970 176.058 -0.088 19554 1762 1 4 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.808 -0.778 19554 1763 1 4 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.220 0.510 19554 1764 1 4 . 1 1 143 143 ASP H H 143 7.880 7.880 8.363 -0.483 19554 1765 1 4 . 1 1 144 144 THR N N 144 110.060 110.060 111.515 -1.455 19554 1766 1 4 . 1 1 144 144 THR HA H 144 4.110 4.110 4.379 -0.269 19554 1767 1 4 . 1 1 144 144 THR C C 144 175.730 175.730 175.288 0.442 19554 1768 1 4 . 1 1 144 144 THR CA C 144 61.520 61.520 61.576 -0.056 19554 1769 1 4 . 1 1 144 144 THR CB C 144 68.610 68.610 71.021 -2.411 19554 1770 1 4 . 1 1 144 144 THR H H 144 8.030 8.030 8.194 -0.164 19554 1771 1 4 . 1 1 145 145 LEU N N 145 124.820 124.820 128.092 -3.272 19554 1772 1 4 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.585 0.115 19554 1773 1 4 . 1 1 145 145 LEU C C 145 178.010 178.010 177.353 0.657 19554 1774 1 4 . 1 1 145 145 LEU CA C 145 57.350 57.350 55.634 1.716 19554 1775 1 4 . 1 1 145 145 LEU CB C 145 42.100 42.100 42.303 -0.203 19554 1776 1 4 . 1 1 145 145 LEU H H 145 8.050 8.050 8.799 -0.749 19554 1777 1 4 . 1 1 146 146 HIS N N 146 116.310 116.310 119.210 -2.900 19554 1778 1 4 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.383 0.157 19554 1779 1 4 . 1 1 146 146 HIS C C 146 175.000 175.000 175.563 -0.563 19554 1780 1 4 . 1 1 146 146 HIS H H 146 8.120 8.120 8.426 -0.306 19554 1781 1 4 . 1 1 147 147 LEU N N 147 120.320 120.320 118.740 1.580 19554 1782 1 4 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.737 0.333 19554 1783 1 4 . 1 1 147 147 LEU C C 147 176.810 176.810 176.227 0.583 19554 1784 1 4 . 1 1 147 147 LEU CA C 147 54.710 54.710 56.446 -1.736 19554 1785 1 4 . 1 1 147 147 LEU CB C 147 41.960 41.960 42.599 -0.639 19554 1786 1 4 . 1 1 147 147 LEU H H 147 7.620 7.620 7.515 0.105 19554 1787 1 4 . 1 1 148 148 GLU N N 148 118.950 118.950 118.409 0.541 19554 1788 1 4 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.437 -0.657 19554 1789 1 4 . 1 1 148 148 GLU C C 148 177.480 177.480 176.220 1.260 19554 1790 1 4 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.784 2.646 19554 1791 1 4 . 1 1 148 148 GLU CB C 148 29.680 29.680 30.522 -0.842 19554 1792 1 4 . 1 1 148 148 GLU H H 148 7.760 7.760 7.615 0.145 19554 1793 1 4 . 1 1 149 149 GLY N N 149 111.070 111.070 111.216 -0.146 19554 1794 1 4 . 1 1 149 149 GLY C C 149 173.820 173.820 173.915 -0.095 19554 1795 1 4 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.028 0.502 19554 1796 1 4 . 1 1 149 149 GLY H H 149 8.630 8.630 8.479 0.151 19554 1797 1 4 . 1 1 150 150 LYS N N 150 119.380 119.380 121.085 -1.705 19554 1798 1 4 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.298 0.032 19554 1799 1 4 . 1 1 150 150 LYS C C 150 175.110 175.110 175.104 0.006 19554 1800 1 4 . 1 1 150 150 LYS CA C 150 55.170 55.170 55.727 -0.557 19554 1801 1 4 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.000 0.550 19554 1802 1 4 . 1 1 150 150 LYS H H 150 7.520 7.520 8.018 -0.498 19554 1803 1 4 . 1 1 151 151 GLU N N 151 122.850 122.850 125.051 -2.201 19554 1804 1 4 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.507 -0.037 19554 1805 1 4 . 1 1 151 151 GLU C C 151 175.510 175.510 174.970 0.540 19554 1806 1 4 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.367 0.973 19554 1807 1 4 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.667 0.343 19554 1808 1 4 . 1 1 151 151 GLU H H 151 8.410 8.410 8.667 -0.257 19554 1809 1 4 . 1 1 152 152 LEU N N 152 127.520 127.520 125.347 2.173 19554 1810 1 4 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.707 -0.167 19554 1811 1 4 . 1 1 152 152 LEU C C 152 173.750 173.750 174.763 -1.013 19554 1812 1 4 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.115 -0.295 19554 1813 1 4 . 1 1 152 152 LEU H H 152 8.850 8.850 7.977 0.873 19554 1814 1 4 . 1 1 153 153 GLU N N 153 116.500 116.500 117.884 -1.384 19554 1815 1 4 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.405 0.175 19554 1816 1 4 . 1 1 153 153 GLU C C 153 175.120 175.120 174.141 0.979 19554 1817 1 4 . 1 1 153 153 GLU CA C 153 55.160 55.160 54.436 0.724 19554 1818 1 4 . 1 1 153 153 GLU H H 153 7.110 7.110 8.264 -1.154 19554 1819 1 4 . 1 1 154 154 PHE N N 154 115.150 115.150 117.340 -2.190 19554 1820 1 4 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.701 0.159 19554 1821 1 4 . 1 1 154 154 PHE C C 154 175.630 175.630 174.270 1.360 19554 1822 1 4 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.619 0.571 19554 1823 1 4 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.974 1.276 19554 1824 1 4 . 1 1 154 154 PHE H H 154 8.910 8.910 7.975 0.935 19554 1825 1 4 . 1 1 155 155 LYS N N 155 114.560 114.560 121.314 -6.754 19554 1826 1 4 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.595 0.115 19554 1827 1 4 . 1 1 155 155 LYS C C 155 176.500 176.500 175.783 0.717 19554 1828 1 4 . 1 1 155 155 LYS CA C 155 53.600 53.600 54.982 -1.382 19554 1829 1 4 . 1 1 155 155 LYS CB C 155 33.960 33.960 33.829 0.131 19554 1830 1 4 . 1 1 155 155 LYS H H 155 8.100 8.100 8.764 -0.664 19554 1831 1 4 . 1 1 156 156 VAL N N 156 124.530 124.530 127.127 -2.597 19554 1832 1 4 . 1 1 156 156 VAL C C 156 175.630 175.630 175.714 -0.084 19554 1833 1 4 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.875 -1.185 19554 1834 1 4 . 1 1 156 156 VAL CB C 156 31.600 31.600 31.613 -0.013 19554 1835 1 4 . 1 1 156 156 VAL H H 156 9.920 9.920 8.104 1.816 19554 1836 1 4 . 1 1 157 157 ILE N N 157 119.590 119.590 129.274 -9.684 19554 1837 1 4 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.382 0.338 19554 1838 1 4 . 1 1 157 157 ILE C C 157 176.190 176.190 175.339 0.851 19554 1839 1 4 . 1 1 157 157 ILE CA C 157 61.050 61.050 60.402 0.648 19554 1840 1 4 . 1 1 157 157 ILE CB C 157 39.170 39.170 39.903 -0.733 19554 1841 1 4 . 1 1 157 157 ILE H H 157 8.530 8.530 8.607 -0.077 19554 1842 1 4 . 1 1 158 158 LYS N N 158 122.460 122.460 120.837 1.623 19554 1843 1 4 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.524 -0.324 19554 1844 1 4 . 1 1 158 158 LYS C C 158 173.000 173.000 174.039 -1.039 19554 1845 1 4 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.992 -0.192 19554 1846 1 4 . 1 1 158 158 LYS CB C 158 35.640 35.640 33.989 1.651 19554 1847 1 4 . 1 1 158 158 LYS H H 158 7.600 7.600 7.986 -0.386 19554 1848 1 4 . 1 1 159 159 LEU N N 159 125.430 125.430 123.279 2.151 19554 1849 1 4 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.823 -0.203 19554 1850 1 4 . 1 1 159 159 LEU C C 159 174.390 174.390 175.230 -0.840 19554 1851 1 4 . 1 1 159 159 LEU CA C 159 54.510 54.510 53.936 0.574 19554 1852 1 4 . 1 1 159 159 LEU H H 159 7.950 7.950 8.174 -0.224 19554 1853 1 4 . 1 1 160 160 ASP N N 160 124.740 124.740 123.755 0.985 19554 1854 1 4 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.849 -0.179 19554 1855 1 4 . 1 1 160 160 ASP C C 160 176.020 176.020 175.862 0.158 19554 1856 1 4 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.694 -1.074 19554 1857 1 4 . 1 1 160 160 ASP CB C 160 42.050 42.050 41.265 0.785 19554 1858 1 4 . 1 1 160 160 ASP H H 160 8.760 8.760 8.668 0.092 19554 1859 1 4 . 1 1 161 161 GLN N N 161 126.490 126.490 123.406 3.084 19554 1860 1 4 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.051 -0.931 19554 1861 1 4 . 1 1 161 161 GLN C C 161 178.280 178.280 177.215 1.065 19554 1862 1 4 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.559 0.211 19554 1863 1 4 . 1 1 161 161 GLN CB C 161 27.840 27.840 29.090 -1.250 19554 1864 1 4 . 1 1 161 161 GLN H H 161 9.110 9.110 8.621 0.489 19554 1865 1 4 . 1 1 162 162 LYS N N 162 119.150 119.150 120.104 -0.954 19554 1866 1 4 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.092 -0.292 19554 1867 1 4 . 1 1 162 162 LYS C C 162 177.900 177.900 177.733 0.167 19554 1868 1 4 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.379 0.321 19554 1869 1 4 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.118 -0.728 19554 1870 1 4 . 1 1 162 162 LYS H H 162 8.070 8.070 8.111 -0.041 19554 1871 1 4 . 1 1 163 163 ARG N N 163 114.850 114.850 117.328 -2.478 19554 1872 1 4 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.354 -0.204 19554 1873 1 4 . 1 1 163 163 ARG C C 163 174.750 174.750 175.512 -0.762 19554 1874 1 4 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.297 -0.498 19554 1875 1 4 . 1 1 163 163 ARG H H 163 7.010 7.010 7.542 -0.532 19554 1876 1 4 . 1 1 164 164 ASN N N 164 117.810 117.810 115.555 2.255 19554 1877 1 4 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.479 -0.349 19554 1878 1 4 . 1 1 164 164 ASN C C 164 173.880 173.880 173.803 0.077 19554 1879 1 4 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.710 -0.750 19554 1880 1 4 . 1 1 164 164 ASN CB C 164 37.530 37.530 36.236 1.294 19554 1881 1 4 . 1 1 164 164 ASN H H 164 7.750 7.750 8.317 -0.567 19554 1882 1 4 . 1 1 165 165 ASN N N 165 116.170 116.170 115.373 0.797 19554 1883 1 4 . 1 1 165 165 ASN HA H 165 5.060 5.060 5.036 0.024 19554 1884 1 4 . 1 1 165 165 ASN C C 165 172.990 172.990 173.138 -0.148 19554 1885 1 4 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.777 -0.337 19554 1886 1 4 . 1 1 165 165 ASN CB C 165 41.820 41.820 42.184 -0.365 19554 1887 1 4 . 1 1 165 165 ASN H H 165 8.020 8.020 7.381 0.639 19554 1888 1 4 . 1 1 166 166 VAL N N 166 124.790 124.790 118.353 6.437 19554 1889 1 4 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.329 0.171 19554 1890 1 4 . 1 1 166 166 VAL C C 166 174.190 174.190 173.633 0.557 19554 1891 1 4 . 1 1 166 166 VAL CA C 166 61.030 61.030 61.488 -0.458 19554 1892 1 4 . 1 1 166 166 VAL CB C 166 34.620 34.620 35.578 -0.958 19554 1893 1 4 . 1 1 166 166 VAL H H 166 8.380 8.380 8.104 0.276 19554 1894 1 4 . 1 1 167 167 VAL N N 167 128.000 128.000 124.148 3.852 19554 1895 1 4 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.644 0.606 19554 1896 1 4 . 1 1 167 167 VAL C C 167 176.000 176.000 174.012 1.988 19554 1897 1 4 . 1 1 167 167 VAL CA C 167 60.610 60.610 60.166 0.444 19554 1898 1 4 . 1 1 167 167 VAL CB C 167 33.900 33.900 35.977 -2.077 19554 1899 1 4 . 1 1 167 167 VAL H H 167 8.710 8.710 8.459 0.251 19554 1900 1 4 . 1 1 168 168 VAL N N 168 118.360 118.360 120.172 -1.812 19554 1901 1 4 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.663 0.577 19554 1902 1 4 . 1 1 168 168 VAL C C 168 172.800 172.800 174.837 -2.037 19554 1903 1 4 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.799 -1.939 19554 1904 1 4 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.828 1.522 19554 1905 1 4 . 1 1 168 168 VAL H H 168 8.560 8.560 8.606 -0.046 19554 1906 1 4 . 1 1 169 169 SER N N 169 106.720 106.720 119.756 -13.036 19554 1907 1 4 . 1 1 169 169 SER HA H 169 4.480 4.480 4.457 0.023 19554 1908 1 4 . 1 1 169 169 SER C C 169 175.950 175.950 174.438 1.512 19554 1909 1 4 . 1 1 169 169 SER CA C 169 55.550 55.550 57.728 -2.178 19554 1910 1 4 . 1 1 169 169 SER CB C 169 64.980 64.980 64.438 0.542 19554 1911 1 4 . 1 1 169 169 SER H H 169 8.600 8.600 8.638 -0.038 19554 1912 1 4 . 1 1 170 170 ARG N N 170 129.620 129.620 121.383 8.237 19554 1913 1 4 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.428 0.282 19554 1914 1 4 . 1 1 170 170 ARG C C 170 177.870 177.870 178.582 -0.712 19554 1915 1 4 . 1 1 170 170 ARG CA C 170 57.150 57.150 57.061 0.089 19554 1916 1 4 . 1 1 170 170 ARG H H 170 7.610 7.610 8.613 -1.003 19554 1917 1 4 . 1 1 171 171 ARG N N 171 122.230 122.230 120.457 1.773 19554 1918 1 4 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.341 -0.871 19554 1919 1 4 . 1 1 171 171 ARG C C 171 175.760 175.760 178.264 -2.504 19554 1920 1 4 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.295 1.135 19554 1921 1 4 . 1 1 171 171 ARG CB C 171 30.410 30.410 30.253 0.157 19554 1922 1 4 . 1 1 171 171 ARG H H 171 8.260 8.260 7.972 0.288 19554 1923 1 4 . 1 1 172 172 ALA N N 172 116.490 116.490 122.878 -6.388 19554 1924 1 4 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.236 -0.186 19554 1925 1 4 . 1 1 172 172 ALA C C 172 179.480 179.480 179.046 0.434 19554 1926 1 4 . 1 1 172 172 ALA CA C 172 54.010 54.010 54.276 -0.266 19554 1927 1 4 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.123 0.767 19554 1928 1 4 . 1 1 172 172 ALA H H 172 7.760 7.760 8.557 -0.797 19554 1929 1 4 . 1 1 173 173 VAL N N 173 116.440 116.440 119.930 -3.490 19554 1930 1 4 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.676 -0.206 19554 1931 1 4 . 1 1 173 173 VAL C C 173 177.680 177.680 176.826 0.854 19554 1932 1 4 . 1 1 173 173 VAL CA C 173 65.080 65.080 65.169 -0.089 19554 1933 1 4 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.937 -0.057 19554 1934 1 4 . 1 1 173 173 VAL H H 173 7.210 7.210 7.275 -0.065 19554 1935 1 4 . 1 1 174 174 ILE N N 174 119.790 119.790 115.590 4.200 19554 1936 1 4 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.715 -0.035 19554 1937 1 4 . 1 1 174 174 ILE C C 174 178.310 178.310 177.323 0.987 19554 1938 1 4 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.351 -0.581 19554 1939 1 4 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.217 1.233 19554 1940 1 4 . 1 1 174 174 ILE H H 174 7.160 7.160 7.372 -0.212 19554 1941 1 4 . 1 1 175 175 GLU N N 175 117.810 117.810 120.436 -2.626 19554 1942 1 4 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.035 -0.005 19554 1943 1 4 . 1 1 175 175 GLU C C 175 177.170 177.170 179.098 -1.928 19554 1944 1 4 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.659 -1.469 19554 1945 1 4 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.225 0.415 19554 1946 1 4 . 1 1 175 175 GLU H H 175 8.250 8.250 8.214 0.036 19554 1947 1 4 . 1 1 176 176 SER N N 176 114.300 114.300 115.190 -0.890 19554 1948 1 4 . 1 1 176 176 SER HA H 176 4.320 4.320 4.108 0.212 19554 1949 1 4 . 1 1 176 176 SER C C 176 174.930 174.930 176.951 -2.021 19554 1950 1 4 . 1 1 176 176 SER CA C 176 59.060 59.060 61.368 -2.308 19554 1951 1 4 . 1 1 176 176 SER CB C 176 63.640 63.640 62.834 0.806 19554 1952 1 4 . 1 1 176 176 SER H H 176 7.460 7.460 7.554 -0.094 19554 1953 1 4 . 1 1 177 177 GLU N N 177 121.860 121.860 122.341 -0.481 19554 1954 1 4 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.032 0.138 19554 1955 1 4 . 1 1 177 177 GLU C C 177 176.340 176.340 178.053 -1.713 19554 1956 1 4 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.753 -2.113 19554 1957 1 4 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.557 0.193 19554 1958 1 4 . 1 1 177 177 GLU H H 177 7.890 7.890 7.805 0.085 19554 1959 1 4 . 1 1 178 178 ASN N N 178 119.030 119.030 117.640 1.390 19554 1960 1 4 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.865 -0.165 19554 1961 1 4 . 1 1 178 178 ASN C C 178 174.230 174.230 174.863 -0.633 19554 1962 1 4 . 1 1 178 178 ASN CA C 178 53.010 53.010 51.990 1.020 19554 1963 1 4 . 1 1 178 178 ASN CB C 178 39.080 39.080 39.018 0.062 19554 1964 1 4 . 1 1 178 178 ASN H H 178 8.110 8.110 7.590 0.520 19554 1965 1 5 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.212 -0.052 19554 1966 1 5 . 1 1 89 89 ALA C C 89 179.720 179.720 179.097 0.623 19554 1967 1 5 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.688 -0.198 19554 1968 1 5 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.664 -0.444 19554 1969 1 5 . 1 1 90 90 LYS N N 90 119.500 119.500 118.674 0.826 19554 1970 1 5 . 1 1 90 90 LYS C C 90 179.090 179.090 178.202 0.888 19554 1971 1 5 . 1 1 90 90 LYS H H 90 7.980 7.980 8.357 -0.377 19554 1972 1 5 . 1 1 91 91 ARG N N 91 120.510 120.510 120.083 0.427 19554 1973 1 5 . 1 1 91 91 ARG HA H 91 4.150 4.150 3.962 0.188 19554 1974 1 5 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.979 0.321 19554 1975 1 5 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.127 0.893 19554 1976 1 5 . 1 1 91 91 ARG H H 91 8.010 8.010 8.467 -0.457 19554 1977 1 5 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.627 1.493 19554 1978 1 5 . 1 1 92 92 HIS C C 92 177.360 177.360 175.982 1.378 19554 1979 1 5 . 1 1 92 92 HIS CB C 92 29.870 29.870 28.552 1.318 19554 1980 1 5 . 1 1 93 93 GLU N N 93 118.470 118.470 119.068 -0.598 19554 1981 1 5 . 1 1 93 93 GLU HA H 93 3.900 3.900 3.892 0.008 19554 1982 1 5 . 1 1 93 93 GLU C C 93 178.740 178.740 178.133 0.607 19554 1983 1 5 . 1 1 93 93 GLU CA C 93 59.160 59.160 57.711 1.449 19554 1984 1 5 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.931 -0.971 19554 1985 1 5 . 1 1 93 93 GLU H H 93 8.190 8.190 7.189 1.001 19554 1986 1 5 . 1 1 94 94 ALA N N 94 123.080 123.080 122.846 0.234 19554 1987 1 5 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.133 -0.063 19554 1988 1 5 . 1 1 94 94 ALA C C 94 180.330 180.330 179.985 0.345 19554 1989 1 5 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.491 0.449 19554 1990 1 5 . 1 1 94 94 ALA CB C 94 18.250 18.250 17.855 0.395 19554 1991 1 5 . 1 1 94 94 ALA H H 94 8.090 8.090 7.505 0.585 19554 1992 1 5 . 1 1 95 95 TRP N N 95 119.190 119.190 119.817 -0.627 19554 1993 1 5 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.387 -0.347 19554 1994 1 5 . 1 1 95 95 TRP C C 95 178.590 178.590 178.634 -0.044 19554 1995 1 5 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.289 2.711 19554 1996 1 5 . 1 1 95 95 TRP CB C 95 29.160 29.160 28.247 0.913 19554 1997 1 5 . 1 1 95 95 TRP H H 95 8.060 8.060 7.849 0.211 19554 1998 1 5 . 1 1 96 96 ILE N N 96 119.570 119.570 116.282 3.288 19554 1999 1 5 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.745 0.065 19554 2000 1 5 . 1 1 96 96 ILE C C 96 179.300 179.300 177.629 1.671 19554 2001 1 5 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.621 -0.081 19554 2002 1 5 . 1 1 96 96 ILE CB C 96 37.130 37.130 36.948 0.182 19554 2003 1 5 . 1 1 96 96 ILE H H 96 7.850 7.850 7.698 0.152 19554 2004 1 5 . 1 1 97 97 THR N N 97 117.030 117.030 115.243 1.787 19554 2005 1 5 . 1 1 97 97 THR HA H 97 3.830 3.830 4.180 -0.350 19554 2006 1 5 . 1 1 97 97 THR C C 97 177.080 177.080 176.400 0.680 19554 2007 1 5 . 1 1 97 97 THR CA C 97 66.430 66.430 64.922 1.508 19554 2008 1 5 . 1 1 97 97 THR CB C 97 68.450 68.450 68.832 -0.382 19554 2009 1 5 . 1 1 97 97 THR H H 97 7.900 7.900 7.864 0.036 19554 2010 1 5 . 1 1 98 98 LEU N N 98 123.110 123.110 119.550 3.560 19554 2011 1 5 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.152 -0.222 19554 2012 1 5 . 1 1 98 98 LEU C C 98 178.160 178.160 178.183 -0.023 19554 2013 1 5 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.091 0.639 19554 2014 1 5 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.421 0.119 19554 2015 1 5 . 1 1 98 98 LEU H H 98 7.830 7.830 7.837 -0.007 19554 2016 1 5 . 1 1 99 99 GLU N N 99 120.520 120.520 119.891 0.629 19554 2017 1 5 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.143 -0.263 19554 2018 1 5 . 1 1 99 99 GLU C C 99 179.010 179.010 177.860 1.150 19554 2019 1 5 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.050 0.870 19554 2020 1 5 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.515 -0.164 19554 2021 1 5 . 1 1 99 99 GLU H H 99 8.560 8.560 7.622 0.938 19554 2022 1 5 . 1 1 100 100 LYS N N 100 119.950 119.950 117.792 2.158 19554 2023 1 5 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.311 -0.281 19554 2024 1 5 . 1 1 100 100 LYS C C 100 177.870 177.870 178.500 -0.630 19554 2025 1 5 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.095 0.475 19554 2026 1 5 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.622 -0.902 19554 2027 1 5 . 1 1 100 100 LYS H H 100 7.800 7.800 7.498 0.302 19554 2028 1 5 . 1 1 101 101 ALA N N 101 120.690 120.690 123.655 -2.965 19554 2029 1 5 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.266 -0.246 19554 2030 1 5 . 1 1 101 101 ALA C C 101 180.990 180.990 178.658 2.332 19554 2031 1 5 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.221 0.899 19554 2032 1 5 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.459 -0.879 19554 2033 1 5 . 1 1 101 101 ALA H H 101 7.800 7.800 7.830 -0.030 19554 2034 1 5 . 1 1 102 102 TYR N N 102 118.440 118.440 120.113 -1.673 19554 2035 1 5 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.180 0.140 19554 2036 1 5 . 1 1 102 102 TYR C C 102 178.590 178.590 177.538 1.052 19554 2037 1 5 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.400 -0.590 19554 2038 1 5 . 1 1 102 102 TYR CB C 102 38.690 38.690 38.080 0.610 19554 2039 1 5 . 1 1 102 102 TYR H H 102 8.580 8.580 7.916 0.664 19554 2040 1 5 . 1 1 103 103 GLU N N 103 120.860 120.860 118.656 2.204 19554 2041 1 5 . 1 1 103 103 GLU HA H 103 3.590 3.590 3.904 -0.314 19554 2042 1 5 . 1 1 103 103 GLU C C 103 178.100 178.100 177.304 0.796 19554 2043 1 5 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.565 0.515 19554 2044 1 5 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.553 -0.133 19554 2045 1 5 . 1 1 103 103 GLU H H 103 8.290 8.290 7.859 0.431 19554 2046 1 5 . 1 1 104 104 ASP N N 104 116.120 116.120 116.339 -0.219 19554 2047 1 5 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.627 -0.017 19554 2048 1 5 . 1 1 104 104 ASP C C 104 174.970 174.970 175.141 -0.171 19554 2049 1 5 . 1 1 104 104 ASP CA C 104 54.120 54.120 54.454 -0.334 19554 2050 1 5 . 1 1 104 104 ASP CB C 104 40.480 40.480 41.694 -1.214 19554 2051 1 5 . 1 1 104 104 ASP H H 104 8.120 8.120 7.773 0.347 19554 2052 1 5 . 1 1 105 105 ALA N N 105 123.330 123.330 121.070 2.260 19554 2053 1 5 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.005 0.145 19554 2054 1 5 . 1 1 105 105 ALA C C 105 177.130 177.130 176.496 0.634 19554 2055 1 5 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.447 0.193 19554 2056 1 5 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.838 -0.538 19554 2057 1 5 . 1 1 105 105 ALA H H 105 7.710 7.710 7.185 0.525 19554 2058 1 5 . 1 1 106 106 GLU N N 106 118.950 118.950 118.246 0.704 19554 2059 1 5 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.259 0.041 19554 2060 1 5 . 1 1 106 106 GLU C C 106 176.730 176.730 176.555 0.175 19554 2061 1 5 . 1 1 106 106 GLU CA C 106 55.440 55.440 56.411 -0.971 19554 2062 1 5 . 1 1 106 106 GLU CB C 106 31.760 31.760 30.992 0.767 19554 2063 1 5 . 1 1 106 106 GLU H H 106 8.440 8.440 8.417 0.023 19554 2064 1 5 . 1 1 107 107 THR N N 107 118.780 118.780 113.232 5.548 19554 2065 1 5 . 1 1 107 107 THR HA H 107 4.550 4.550 4.943 -0.393 19554 2066 1 5 . 1 1 107 107 THR C C 107 174.250 174.250 173.636 0.614 19554 2067 1 5 . 1 1 107 107 THR CA C 107 62.360 62.360 60.588 1.772 19554 2068 1 5 . 1 1 107 107 THR CB C 107 69.390 69.390 69.734 -0.344 19554 2069 1 5 . 1 1 107 107 THR H H 107 8.740 8.740 7.968 0.772 19554 2070 1 5 . 1 1 108 108 VAL N N 108 120.540 120.540 119.316 1.224 19554 2071 1 5 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.673 -0.043 19554 2072 1 5 . 1 1 108 108 VAL C C 108 174.440 174.440 173.698 0.742 19554 2073 1 5 . 1 1 108 108 VAL CA C 108 59.000 59.000 60.021 -1.021 19554 2074 1 5 . 1 1 108 108 VAL CB C 108 34.650 34.650 35.026 -0.376 19554 2075 1 5 . 1 1 108 108 VAL H H 108 9.040 9.040 8.737 0.303 19554 2076 1 5 . 1 1 109 109 THR N N 109 115.100 115.100 115.894 -0.794 19554 2077 1 5 . 1 1 109 109 THR HA H 109 5.380 5.380 4.950 0.430 19554 2078 1 5 . 1 1 109 109 THR C C 109 174.580 174.580 173.817 0.763 19554 2079 1 5 . 1 1 109 109 THR CA C 109 60.410 60.410 61.555 -1.145 19554 2080 1 5 . 1 1 109 109 THR CB C 109 70.610 70.610 69.639 0.971 19554 2081 1 5 . 1 1 109 109 THR H H 109 8.170 8.170 8.425 -0.255 19554 2082 1 5 . 1 1 110 110 GLY N N 110 108.580 108.580 114.130 -5.550 19554 2083 1 5 . 1 1 110 110 GLY C C 110 170.810 170.810 171.752 -0.942 19554 2084 1 5 . 1 1 110 110 GLY CA C 110 45.380 45.380 44.183 1.197 19554 2085 1 5 . 1 1 110 110 GLY H H 110 8.780 8.780 8.645 0.135 19554 2086 1 5 . 1 1 111 111 VAL N N 111 116.930 116.930 120.348 -3.418 19554 2087 1 5 . 1 1 111 111 VAL HA H 111 4.780 4.780 5.046 -0.266 19554 2088 1 5 . 1 1 111 111 VAL C C 111 176.060 176.060 175.620 0.440 19554 2089 1 5 . 1 1 111 111 VAL CA C 111 59.770 59.770 58.752 1.018 19554 2090 1 5 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.775 0.975 19554 2091 1 5 . 1 1 111 111 VAL H H 111 7.810 7.810 8.258 -0.448 19554 2092 1 5 . 1 1 112 112 ILE N N 112 127.060 127.060 129.840 -2.780 19554 2093 1 5 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.109 0.121 19554 2094 1 5 . 1 1 112 112 ILE C C 112 176.180 176.180 176.059 0.121 19554 2095 1 5 . 1 1 112 112 ILE CA C 112 62.220 62.220 62.716 -0.496 19554 2096 1 5 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.029 1.451 19554 2097 1 5 . 1 1 112 112 ILE H H 112 9.240 9.240 8.127 1.113 19554 2098 1 5 . 1 1 113 113 ASN N N 113 127.510 127.510 126.313 1.197 19554 2099 1 5 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.633 0.307 19554 2100 1 5 . 1 1 113 113 ASN C C 113 175.020 175.020 175.478 -0.458 19554 2101 1 5 . 1 1 113 113 ASN CA C 113 52.290 52.290 54.587 -2.296 19554 2102 1 5 . 1 1 113 113 ASN CB C 113 39.580 39.580 39.340 0.240 19554 2103 1 5 . 1 1 113 113 ASN H H 113 9.010 9.010 8.318 0.692 19554 2104 1 5 . 1 1 114 114 GLY N N 114 107.150 107.150 106.800 0.350 19554 2105 1 5 . 1 1 114 114 GLY C C 114 171.360 171.360 171.961 -0.601 19554 2106 1 5 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.459 1.061 19554 2107 1 5 . 1 1 114 114 GLY H H 114 7.620 7.620 7.510 0.110 19554 2108 1 5 . 1 1 115 115 LYS N N 115 121.670 121.670 120.959 0.711 19554 2109 1 5 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.436 0.154 19554 2110 1 5 . 1 1 115 115 LYS C C 115 175.950 175.950 174.930 1.020 19554 2111 1 5 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.767 1.173 19554 2112 1 5 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.204 -0.164 19554 2113 1 5 . 1 1 115 115 LYS H H 115 8.550 8.550 8.140 0.410 19554 2114 1 5 . 1 1 116 116 VAL N N 116 118.750 118.750 118.990 -0.240 19554 2115 1 5 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.448 0.022 19554 2116 1 5 . 1 1 116 116 VAL C C 116 175.110 175.110 174.643 0.467 19554 2117 1 5 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.137 -0.107 19554 2118 1 5 . 1 1 116 116 VAL CB C 116 35.500 35.500 34.111 1.389 19554 2119 1 5 . 1 1 116 116 VAL H H 116 8.070 8.070 7.977 0.093 19554 2120 1 5 . 1 1 117 117 LYS N N 117 122.520 122.520 121.615 0.905 19554 2121 1 5 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.030 -0.100 19554 2122 1 5 . 1 1 117 117 LYS C C 117 177.970 177.970 177.076 0.894 19554 2123 1 5 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.146 1.524 19554 2124 1 5 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.196 -0.256 19554 2125 1 5 . 1 1 117 117 LYS H H 117 8.250 8.250 8.439 -0.189 19554 2126 1 5 . 1 1 118 118 GLY N N 118 113.440 113.440 113.381 0.059 19554 2127 1 5 . 1 1 118 118 GLY C C 118 175.540 175.540 173.444 2.096 19554 2128 1 5 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.102 0.098 19554 2129 1 5 . 1 1 118 118 GLY H H 118 8.820 8.820 7.983 0.837 19554 2130 1 5 . 1 1 119 119 GLY N N 119 109.130 109.130 106.079 3.051 19554 2131 1 5 . 1 1 119 119 GLY C C 119 170.530 170.530 172.116 -1.586 19554 2132 1 5 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.175 3.665 19554 2133 1 5 . 1 1 119 119 GLY H H 119 7.930 7.930 7.464 0.466 19554 2134 1 5 . 1 1 120 120 PHE N N 120 123.370 123.370 117.620 5.750 19554 2135 1 5 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.635 0.635 19554 2136 1 5 . 1 1 120 120 PHE C C 120 174.260 174.260 174.718 -0.458 19554 2137 1 5 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.072 -0.732 19554 2138 1 5 . 1 1 120 120 PHE CB C 120 43.730 43.730 42.982 0.748 19554 2139 1 5 . 1 1 120 120 PHE H H 120 8.820 8.820 7.571 1.249 19554 2140 1 5 . 1 1 121 121 THR N N 121 114.670 114.670 119.527 -4.857 19554 2141 1 5 . 1 1 121 121 THR HA H 121 5.000 5.000 4.882 0.118 19554 2142 1 5 . 1 1 121 121 THR C C 121 173.780 173.780 173.805 -0.025 19554 2143 1 5 . 1 1 121 121 THR CA C 121 60.500 60.500 61.599 -1.099 19554 2144 1 5 . 1 1 121 121 THR CB C 121 69.910 69.910 69.725 0.185 19554 2145 1 5 . 1 1 121 121 THR H H 121 8.670 8.670 8.738 -0.068 19554 2146 1 5 . 1 1 122 122 VAL N N 122 124.340 124.340 120.079 4.261 19554 2147 1 5 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.476 0.124 19554 2148 1 5 . 1 1 122 122 VAL C C 122 174.240 174.240 174.085 0.155 19554 2149 1 5 . 1 1 122 122 VAL CA C 122 59.300 59.300 60.241 -0.941 19554 2150 1 5 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.876 -0.016 19554 2151 1 5 . 1 1 122 122 VAL H H 122 8.560 8.560 7.984 0.576 19554 2152 1 5 . 1 1 123 123 GLU N N 123 126.950 126.950 124.511 2.439 19554 2153 1 5 . 1 1 123 123 GLU HA H 123 4.610 4.610 5.152 -0.542 19554 2154 1 5 . 1 1 123 123 GLU C C 123 175.840 175.840 175.961 -0.121 19554 2155 1 5 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.517 0.643 19554 2156 1 5 . 1 1 123 123 GLU CB C 123 30.910 30.910 31.327 -0.417 19554 2157 1 5 . 1 1 123 123 GLU H H 123 8.950 8.950 8.154 0.796 19554 2158 1 5 . 1 1 124 124 LEU N N 124 129.580 129.580 129.351 0.229 19554 2159 1 5 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.643 0.017 19554 2160 1 5 . 1 1 124 124 LEU C C 124 175.350 175.350 175.881 -0.531 19554 2161 1 5 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.632 -0.432 19554 2162 1 5 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.508 0.682 19554 2163 1 5 . 1 1 124 124 LEU H H 124 8.940 8.940 8.994 -0.054 19554 2164 1 5 . 1 1 125 125 ASN N N 125 121.880 121.880 118.816 3.064 19554 2165 1 5 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.433 -0.243 19554 2166 1 5 . 1 1 125 125 ASN C C 125 174.690 174.690 175.462 -0.772 19554 2167 1 5 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.069 -0.189 19554 2168 1 5 . 1 1 125 125 ASN CB C 125 37.250 37.250 36.816 0.434 19554 2169 1 5 . 1 1 125 125 ASN H H 125 8.950 8.950 8.876 0.074 19554 2170 1 5 . 1 1 126 126 GLY N N 126 103.140 103.140 103.884 -0.744 19554 2171 1 5 . 1 1 126 126 GLY C C 126 173.680 173.680 174.176 -0.496 19554 2172 1 5 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.542 -0.662 19554 2173 1 5 . 1 1 126 126 GLY H H 126 8.070 8.070 8.220 -0.150 19554 2174 1 5 . 1 1 127 127 ILE N N 127 122.120 122.120 122.896 -0.776 19554 2175 1 5 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.972 -0.002 19554 2176 1 5 . 1 1 127 127 ILE C C 127 174.370 174.370 174.882 -0.512 19554 2177 1 5 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.933 -1.403 19554 2178 1 5 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.142 0.828 19554 2179 1 5 . 1 1 127 127 ILE H H 127 7.380 7.380 7.296 0.084 19554 2180 1 5 . 1 1 128 128 ARG N N 128 126.630 126.630 123.595 3.035 19554 2181 1 5 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.508 -0.868 19554 2182 1 5 . 1 1 128 128 ARG C C 128 174.720 174.720 174.512 0.208 19554 2183 1 5 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.299 1.351 19554 2184 1 5 . 1 1 128 128 ARG CB C 128 31.000 31.000 32.639 -1.639 19554 2185 1 5 . 1 1 128 128 ARG H H 128 8.170 8.170 8.411 -0.241 19554 2186 1 5 . 1 1 129 129 ALA N N 129 127.320 127.320 125.062 2.258 19554 2187 1 5 . 1 1 129 129 ALA HA H 129 4.850 4.850 5.105 -0.255 19554 2188 1 5 . 1 1 129 129 ALA C C 129 174.970 174.970 175.092 -0.122 19554 2189 1 5 . 1 1 129 129 ALA CA C 129 49.660 49.660 49.628 0.032 19554 2190 1 5 . 1 1 129 129 ALA CB C 129 24.390 24.390 22.011 2.379 19554 2191 1 5 . 1 1 129 129 ALA H H 129 9.240 9.240 8.458 0.782 19554 2192 1 5 . 1 1 130 130 PHE N N 130 121.060 121.060 119.068 1.992 19554 2193 1 5 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.005 0.155 19554 2194 1 5 . 1 1 130 130 PHE C C 130 172.430 172.430 173.702 -1.272 19554 2195 1 5 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.041 -2.041 19554 2196 1 5 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.523 -0.123 19554 2197 1 5 . 1 1 130 130 PHE H H 130 8.660 8.660 8.385 0.275 19554 2198 1 5 . 1 1 131 131 LEU N N 131 130.250 130.250 127.751 2.499 19554 2199 1 5 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.883 0.097 19554 2200 1 5 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.576 -1.906 19554 2201 1 5 . 1 1 131 131 LEU CB C 131 44.330 44.330 43.512 0.818 19554 2202 1 5 . 1 1 131 131 LEU H H 131 8.550 8.550 8.305 0.245 19554 2203 1 5 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.634 -0.634 19554 2204 1 5 . 1 1 132 132 PRO C C 132 179.380 179.380 178.099 1.281 19554 2205 1 5 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.949 -0.789 19554 2206 1 5 . 1 1 133 133 GLY N N 133 111.470 111.470 111.486 -0.016 19554 2207 1 5 . 1 1 133 133 GLY C C 133 175.590 175.590 176.386 -0.796 19554 2208 1 5 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.431 1.099 19554 2209 1 5 . 1 1 133 133 GLY H H 133 9.140 9.140 8.883 0.257 19554 2210 1 5 . 1 1 134 134 SER HA H 134 4.350 4.350 4.289 0.061 19554 2211 1 5 . 1 1 134 134 SER C C 134 175.280 175.280 174.656 0.624 19554 2212 1 5 . 1 1 134 134 SER CA C 134 59.210 59.210 60.972 -1.762 19554 2213 1 5 . 1 1 134 134 SER CB C 134 62.730 62.730 63.060 -0.330 19554 2214 1 5 . 1 1 135 135 LEU N N 135 118.770 118.770 120.760 -1.990 19554 2215 1 5 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.548 0.032 19554 2216 1 5 . 1 1 135 135 LEU C C 135 177.500 177.500 176.081 1.419 19554 2217 1 5 . 1 1 135 135 LEU CA C 135 53.770 53.770 54.752 -0.982 19554 2218 1 5 . 1 1 135 135 LEU H H 135 8.030 8.030 7.529 0.501 19554 2219 1 5 . 1 1 136 136 VAL N N 136 123.080 123.080 118.969 4.111 19554 2220 1 5 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.279 -0.669 19554 2221 1 5 . 1 1 136 136 VAL C C 136 173.150 173.150 175.826 -2.676 19554 2222 1 5 . 1 1 136 136 VAL CA C 136 65.220 65.220 63.276 1.944 19554 2223 1 5 . 1 1 136 136 VAL CB C 136 32.020 32.020 34.460 -2.440 19554 2224 1 5 . 1 1 136 136 VAL H H 136 7.550 7.550 8.146 -0.596 19554 2225 1 5 . 1 1 137 137 ASP N N 137 117.300 117.300 122.699 -5.399 19554 2226 1 5 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.739 -0.399 19554 2227 1 5 . 1 1 137 137 ASP C C 137 174.840 174.840 175.266 -0.426 19554 2228 1 5 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.902 -1.832 19554 2229 1 5 . 1 1 137 137 ASP CB C 137 44.460 44.460 40.871 3.589 19554 2230 1 5 . 1 1 137 137 ASP H H 137 7.940 7.940 7.834 0.106 19554 2231 1 5 . 1 1 138 138 VAL N N 138 116.750 116.750 122.215 -5.465 19554 2232 1 5 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.243 -0.103 19554 2233 1 5 . 1 1 138 138 VAL CA C 138 61.190 61.190 62.349 -1.159 19554 2234 1 5 . 1 1 138 138 VAL CB C 138 33.330 33.330 33.259 0.071 19554 2235 1 5 . 1 1 138 138 VAL H H 138 10.000 10.000 8.493 1.507 19554 2236 1 5 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.501 0.009 19554 2237 1 5 . 1 1 140 140 PRO C C 140 175.860 175.860 175.995 -0.135 19554 2238 1 5 . 1 1 141 141 VAL N N 141 124.910 124.910 119.472 5.438 19554 2239 1 5 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.505 -0.605 19554 2240 1 5 . 1 1 141 141 VAL C C 141 175.120 175.120 175.211 -0.091 19554 2241 1 5 . 1 1 141 141 VAL CA C 141 62.720 62.720 60.711 2.009 19554 2242 1 5 . 1 1 141 141 VAL CB C 141 31.870 31.870 34.760 -2.890 19554 2243 1 5 . 1 1 141 141 VAL H H 141 8.110 8.110 7.682 0.428 19554 2244 1 5 . 1 1 142 142 ARG N N 142 119.730 119.730 120.958 -1.228 19554 2245 1 5 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.665 -0.045 19554 2246 1 5 . 1 1 142 142 ARG C C 142 173.520 173.520 174.811 -1.291 19554 2247 1 5 . 1 1 142 142 ARG CA C 142 53.020 53.020 55.655 -2.635 19554 2248 1 5 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.947 -0.467 19554 2249 1 5 . 1 1 142 142 ARG H H 142 7.440 7.440 8.633 -1.193 19554 2250 1 5 . 1 1 143 143 ASP N N 143 119.780 119.780 123.443 -3.663 19554 2251 1 5 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.835 -0.165 19554 2252 1 5 . 1 1 143 143 ASP C C 143 175.970 175.970 175.705 0.265 19554 2253 1 5 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.322 -0.291 19554 2254 1 5 . 1 1 143 143 ASP CB C 143 41.730 41.730 42.157 -0.427 19554 2255 1 5 . 1 1 143 143 ASP H H 143 7.880 7.880 8.354 -0.474 19554 2256 1 5 . 1 1 144 144 THR N N 144 110.060 110.060 113.572 -3.512 19554 2257 1 5 . 1 1 144 144 THR HA H 144 4.110 4.110 4.471 -0.361 19554 2258 1 5 . 1 1 144 144 THR C C 144 175.730 175.730 174.927 0.803 19554 2259 1 5 . 1 1 144 144 THR CA C 144 61.520 61.520 61.105 0.415 19554 2260 1 5 . 1 1 144 144 THR CB C 144 68.610 68.610 69.798 -1.188 19554 2261 1 5 . 1 1 144 144 THR H H 144 8.030 8.030 8.643 -0.613 19554 2262 1 5 . 1 1 145 145 LEU N N 145 124.820 124.820 121.687 3.133 19554 2263 1 5 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.637 0.063 19554 2264 1 5 . 1 1 145 145 LEU C C 145 178.010 178.010 178.074 -0.064 19554 2265 1 5 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.537 0.813 19554 2266 1 5 . 1 1 145 145 LEU CB C 145 42.100 42.100 41.438 0.662 19554 2267 1 5 . 1 1 145 145 LEU H H 145 8.050 8.050 8.196 -0.146 19554 2268 1 5 . 1 1 146 146 HIS N N 146 116.310 116.310 113.623 2.687 19554 2269 1 5 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.481 0.059 19554 2270 1 5 . 1 1 146 146 HIS C C 146 175.000 175.000 176.194 -1.194 19554 2271 1 5 . 1 1 146 146 HIS H H 146 8.120 8.120 8.182 -0.062 19554 2272 1 5 . 1 1 147 147 LEU N N 147 120.320 120.320 122.983 -2.663 19554 2273 1 5 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.981 0.089 19554 2274 1 5 . 1 1 147 147 LEU C C 147 176.810 176.810 175.357 1.453 19554 2275 1 5 . 1 1 147 147 LEU CA C 147 54.710 54.710 54.490 0.220 19554 2276 1 5 . 1 1 147 147 LEU CB C 147 41.960 41.960 40.100 1.860 19554 2277 1 5 . 1 1 147 147 LEU H H 147 7.620 7.620 7.514 0.106 19554 2278 1 5 . 1 1 148 148 GLU N N 148 118.950 118.950 117.642 1.308 19554 2279 1 5 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.430 -0.650 19554 2280 1 5 . 1 1 148 148 GLU C C 148 177.480 177.480 176.376 1.104 19554 2281 1 5 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.466 2.964 19554 2282 1 5 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.507 -1.827 19554 2283 1 5 . 1 1 148 148 GLU H H 148 7.760 7.760 7.453 0.307 19554 2284 1 5 . 1 1 149 149 GLY N N 149 111.070 111.070 110.939 0.131 19554 2285 1 5 . 1 1 149 149 GLY C C 149 173.820 173.820 173.884 -0.064 19554 2286 1 5 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.932 -0.402 19554 2287 1 5 . 1 1 149 149 GLY H H 149 8.630 8.630 8.461 0.169 19554 2288 1 5 . 1 1 150 150 LYS N N 150 119.380 119.380 120.391 -1.011 19554 2289 1 5 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.385 -0.055 19554 2290 1 5 . 1 1 150 150 LYS C C 150 175.110 175.110 175.423 -0.313 19554 2291 1 5 . 1 1 150 150 LYS CA C 150 55.170 55.170 55.423 -0.253 19554 2292 1 5 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.524 0.026 19554 2293 1 5 . 1 1 150 150 LYS H H 150 7.520 7.520 7.847 -0.327 19554 2294 1 5 . 1 1 151 151 GLU N N 151 122.850 122.850 126.159 -3.309 19554 2295 1 5 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.305 0.165 19554 2296 1 5 . 1 1 151 151 GLU C C 151 175.510 175.510 175.459 0.051 19554 2297 1 5 . 1 1 151 151 GLU CA C 151 56.340 56.340 56.213 0.127 19554 2298 1 5 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.330 0.680 19554 2299 1 5 . 1 1 151 151 GLU H H 151 8.410 8.410 8.710 -0.300 19554 2300 1 5 . 1 1 152 152 LEU N N 152 127.520 127.520 126.729 0.791 19554 2301 1 5 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.606 -0.066 19554 2302 1 5 . 1 1 152 152 LEU C C 152 173.750 173.750 174.669 -0.919 19554 2303 1 5 . 1 1 152 152 LEU CA C 152 52.820 52.820 52.618 0.202 19554 2304 1 5 . 1 1 152 152 LEU H H 152 8.850 8.850 8.456 0.394 19554 2305 1 5 . 1 1 153 153 GLU N N 153 116.500 116.500 120.452 -3.952 19554 2306 1 5 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.482 0.098 19554 2307 1 5 . 1 1 153 153 GLU C C 153 175.120 175.120 174.946 0.174 19554 2308 1 5 . 1 1 153 153 GLU CA C 153 55.160 55.160 56.103 -0.943 19554 2309 1 5 . 1 1 153 153 GLU H H 153 7.110 7.110 8.167 -1.057 19554 2310 1 5 . 1 1 154 154 PHE N N 154 115.150 115.150 121.403 -6.253 19554 2311 1 5 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.834 0.026 19554 2312 1 5 . 1 1 154 154 PHE C C 154 175.630 175.630 174.263 1.367 19554 2313 1 5 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.559 0.631 19554 2314 1 5 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.540 1.710 19554 2315 1 5 . 1 1 154 154 PHE H H 154 8.910 8.910 8.853 0.057 19554 2316 1 5 . 1 1 155 155 LYS N N 155 114.560 114.560 119.651 -5.091 19554 2317 1 5 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.603 0.107 19554 2318 1 5 . 1 1 155 155 LYS C C 155 176.500 176.500 175.318 1.182 19554 2319 1 5 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.441 -1.841 19554 2320 1 5 . 1 1 155 155 LYS CB C 155 33.960 33.960 36.570 -2.610 19554 2321 1 5 . 1 1 155 155 LYS H H 155 8.100 8.100 8.682 -0.582 19554 2322 1 5 . 1 1 156 156 VAL N N 156 124.530 124.530 127.136 -2.606 19554 2323 1 5 . 1 1 156 156 VAL C C 156 175.630 175.630 174.731 0.899 19554 2324 1 5 . 1 1 156 156 VAL CA C 156 62.690 62.690 62.627 0.063 19554 2325 1 5 . 1 1 156 156 VAL CB C 156 31.600 31.600 30.942 0.658 19554 2326 1 5 . 1 1 156 156 VAL H H 156 9.920 9.920 8.370 1.550 19554 2327 1 5 . 1 1 157 157 ILE N N 157 119.590 119.590 124.773 -5.183 19554 2328 1 5 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.223 0.497 19554 2329 1 5 . 1 1 157 157 ILE C C 157 176.190 176.190 175.136 1.054 19554 2330 1 5 . 1 1 157 157 ILE CA C 157 61.050 61.050 61.771 -0.721 19554 2331 1 5 . 1 1 157 157 ILE CB C 157 39.170 39.170 38.764 0.406 19554 2332 1 5 . 1 1 157 157 ILE H H 157 8.530 8.530 7.737 0.793 19554 2333 1 5 . 1 1 158 158 LYS N N 158 122.460 122.460 119.456 3.004 19554 2334 1 5 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.780 -0.580 19554 2335 1 5 . 1 1 158 158 LYS C C 158 173.000 173.000 174.744 -1.744 19554 2336 1 5 . 1 1 158 158 LYS CA C 158 56.800 56.800 54.838 1.962 19554 2337 1 5 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.038 1.602 19554 2338 1 5 . 1 1 158 158 LYS H H 158 7.600 7.600 8.320 -0.720 19554 2339 1 5 . 1 1 159 159 LEU N N 159 125.430 125.430 120.918 4.512 19554 2340 1 5 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.604 0.016 19554 2341 1 5 . 1 1 159 159 LEU C C 159 174.390 174.390 176.369 -1.979 19554 2342 1 5 . 1 1 159 159 LEU CA C 159 54.510 54.510 53.549 0.961 19554 2343 1 5 . 1 1 159 159 LEU H H 159 7.950 7.950 7.911 0.039 19554 2344 1 5 . 1 1 160 160 ASP N N 160 124.740 124.740 120.407 4.333 19554 2345 1 5 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.848 -0.177 19554 2346 1 5 . 1 1 160 160 ASP C C 160 176.020 176.020 176.970 -0.950 19554 2347 1 5 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.434 -0.815 19554 2348 1 5 . 1 1 160 160 ASP CB C 160 42.050 42.050 39.915 2.135 19554 2349 1 5 . 1 1 160 160 ASP H H 160 8.760 8.760 8.668 0.092 19554 2350 1 5 . 1 1 161 161 GLN N N 161 126.490 126.490 119.127 7.363 19554 2351 1 5 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.055 -0.935 19554 2352 1 5 . 1 1 161 161 GLN C C 161 178.280 178.280 177.677 0.603 19554 2353 1 5 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.282 0.488 19554 2354 1 5 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.276 -0.436 19554 2355 1 5 . 1 1 161 161 GLN H H 161 9.110 9.110 8.105 1.005 19554 2356 1 5 . 1 1 162 162 LYS N N 162 119.150 119.150 120.940 -1.790 19554 2357 1 5 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.067 -0.267 19554 2358 1 5 . 1 1 162 162 LYS C C 162 177.900 177.900 177.393 0.507 19554 2359 1 5 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.228 0.472 19554 2360 1 5 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.122 -0.732 19554 2361 1 5 . 1 1 162 162 LYS H H 162 8.070 8.070 7.960 0.110 19554 2362 1 5 . 1 1 163 163 ARG N N 163 114.850 114.850 117.575 -2.725 19554 2363 1 5 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.445 -0.295 19554 2364 1 5 . 1 1 163 163 ARG C C 163 174.750 174.750 175.256 -0.506 19554 2365 1 5 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.128 -0.328 19554 2366 1 5 . 1 1 163 163 ARG H H 163 7.010 7.010 7.509 -0.499 19554 2367 1 5 . 1 1 164 164 ASN N N 164 117.810 117.810 115.639 2.171 19554 2368 1 5 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.375 -0.245 19554 2369 1 5 . 1 1 164 164 ASN C C 164 173.880 173.880 173.956 -0.076 19554 2370 1 5 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.735 -0.775 19554 2371 1 5 . 1 1 164 164 ASN CB C 164 37.530 37.530 36.729 0.801 19554 2372 1 5 . 1 1 164 164 ASN H H 164 7.750 7.750 8.377 -0.627 19554 2373 1 5 . 1 1 165 165 ASN N N 165 116.170 116.170 115.446 0.724 19554 2374 1 5 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.960 0.100 19554 2375 1 5 . 1 1 165 165 ASN C C 165 172.990 172.990 173.003 -0.013 19554 2376 1 5 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.545 -0.105 19554 2377 1 5 . 1 1 165 165 ASN CB C 165 41.820 41.820 42.153 -0.333 19554 2378 1 5 . 1 1 165 165 ASN H H 165 8.020 8.020 7.420 0.600 19554 2379 1 5 . 1 1 166 166 VAL N N 166 124.790 124.790 113.947 10.843 19554 2380 1 5 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.708 -0.208 19554 2381 1 5 . 1 1 166 166 VAL C C 166 174.190 174.190 173.771 0.419 19554 2382 1 5 . 1 1 166 166 VAL CA C 166 61.030 61.030 60.293 0.737 19554 2383 1 5 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.721 -0.101 19554 2384 1 5 . 1 1 166 166 VAL H H 166 8.380 8.380 8.225 0.155 19554 2385 1 5 . 1 1 167 167 VAL N N 167 128.000 128.000 117.815 10.185 19554 2386 1 5 . 1 1 167 167 VAL HA H 167 5.250 5.250 5.069 0.181 19554 2387 1 5 . 1 1 167 167 VAL C C 167 176.000 176.000 174.577 1.423 19554 2388 1 5 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.169 1.441 19554 2389 1 5 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.596 -0.696 19554 2390 1 5 . 1 1 167 167 VAL H H 167 8.710 8.710 8.068 0.642 19554 2391 1 5 . 1 1 168 168 VAL N N 168 118.360 118.360 114.695 3.665 19554 2392 1 5 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.626 0.614 19554 2393 1 5 . 1 1 168 168 VAL C C 168 172.800 172.800 175.534 -2.734 19554 2394 1 5 . 1 1 168 168 VAL CA C 168 57.860 57.860 60.189 -2.329 19554 2395 1 5 . 1 1 168 168 VAL CB C 168 35.350 35.350 34.435 0.915 19554 2396 1 5 . 1 1 168 168 VAL H H 168 8.560 8.560 7.798 0.762 19554 2397 1 5 . 1 1 169 169 SER N N 169 106.720 106.720 118.481 -11.761 19554 2398 1 5 . 1 1 169 169 SER HA H 169 4.480 4.480 4.784 -0.304 19554 2399 1 5 . 1 1 169 169 SER C C 169 175.950 175.950 174.596 1.354 19554 2400 1 5 . 1 1 169 169 SER CA C 169 55.550 55.550 58.077 -2.527 19554 2401 1 5 . 1 1 169 169 SER CB C 169 64.980 64.980 64.585 0.395 19554 2402 1 5 . 1 1 169 169 SER H H 169 8.600 8.600 8.815 -0.214 19554 2403 1 5 . 1 1 170 170 ARG N N 170 129.620 129.620 121.596 8.024 19554 2404 1 5 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.340 0.370 19554 2405 1 5 . 1 1 170 170 ARG C C 170 177.870 177.870 178.252 -0.382 19554 2406 1 5 . 1 1 170 170 ARG CA C 170 57.150 57.150 58.295 -1.145 19554 2407 1 5 . 1 1 170 170 ARG H H 170 7.610 7.610 8.700 -1.090 19554 2408 1 5 . 1 1 171 171 ARG N N 171 122.230 122.230 119.966 2.264 19554 2409 1 5 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.203 -0.733 19554 2410 1 5 . 1 1 171 171 ARG C C 171 175.760 175.760 177.427 -1.667 19554 2411 1 5 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.418 1.012 19554 2412 1 5 . 1 1 171 171 ARG CB C 171 30.410 30.410 28.992 1.417 19554 2413 1 5 . 1 1 171 171 ARG H H 171 8.260 8.260 8.393 -0.133 19554 2414 1 5 . 1 1 172 172 ALA N N 172 116.490 116.490 123.179 -6.689 19554 2415 1 5 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.288 -0.238 19554 2416 1 5 . 1 1 172 172 ALA C C 172 179.480 179.480 179.209 0.271 19554 2417 1 5 . 1 1 172 172 ALA CA C 172 54.010 54.010 53.832 0.178 19554 2418 1 5 . 1 1 172 172 ALA CB C 172 18.890 18.890 17.887 1.003 19554 2419 1 5 . 1 1 172 172 ALA H H 172 7.760 7.760 7.936 -0.176 19554 2420 1 5 . 1 1 173 173 VAL N N 173 116.440 116.440 120.763 -4.323 19554 2421 1 5 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.713 -0.243 19554 2422 1 5 . 1 1 173 173 VAL C C 173 177.680 177.680 176.823 0.857 19554 2423 1 5 . 1 1 173 173 VAL CA C 173 65.080 65.080 64.990 0.090 19554 2424 1 5 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.353 0.527 19554 2425 1 5 . 1 1 173 173 VAL H H 173 7.210 7.210 7.380 -0.170 19554 2426 1 5 . 1 1 174 174 ILE N N 174 119.790 119.790 115.077 4.713 19554 2427 1 5 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.990 -0.310 19554 2428 1 5 . 1 1 174 174 ILE C C 174 178.310 178.310 177.587 0.723 19554 2429 1 5 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.201 -0.430 19554 2430 1 5 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.050 1.399 19554 2431 1 5 . 1 1 174 174 ILE H H 174 7.160 7.160 7.454 -0.294 19554 2432 1 5 . 1 1 175 175 GLU N N 175 117.810 117.810 121.194 -3.384 19554 2433 1 5 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.103 -0.073 19554 2434 1 5 . 1 1 175 175 GLU C C 175 177.170 177.170 178.442 -1.272 19554 2435 1 5 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.514 -1.324 19554 2436 1 5 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.575 0.065 19554 2437 1 5 . 1 1 175 175 GLU H H 175 8.250 8.250 8.373 -0.123 19554 2438 1 5 . 1 1 176 176 SER N N 176 114.300 114.300 116.324 -2.024 19554 2439 1 5 . 1 1 176 176 SER HA H 176 4.320 4.320 4.058 0.262 19554 2440 1 5 . 1 1 176 176 SER C C 176 174.930 174.930 176.393 -1.463 19554 2441 1 5 . 1 1 176 176 SER CA C 176 59.060 59.060 60.760 -1.700 19554 2442 1 5 . 1 1 176 176 SER CB C 176 63.640 63.640 62.993 0.647 19554 2443 1 5 . 1 1 176 176 SER H H 176 7.460 7.460 7.766 -0.306 19554 2444 1 5 . 1 1 177 177 GLU N N 177 121.860 121.860 121.347 0.513 19554 2445 1 5 . 1 1 177 177 GLU HA H 177 4.170 4.170 3.974 0.196 19554 2446 1 5 . 1 1 177 177 GLU C C 177 176.340 176.340 177.354 -1.014 19554 2447 1 5 . 1 1 177 177 GLU CA C 177 56.640 56.640 57.356 -0.716 19554 2448 1 5 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.524 0.226 19554 2449 1 5 . 1 1 177 177 GLU H H 177 7.890 7.890 7.733 0.157 19554 2450 1 5 . 1 1 178 178 ASN N N 178 119.030 119.030 116.700 2.330 19554 2451 1 5 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.327 0.373 19554 2452 1 5 . 1 1 178 178 ASN C C 178 174.230 174.230 174.715 -0.485 19554 2453 1 5 . 1 1 178 178 ASN CA C 178 53.010 53.010 53.870 -0.860 19554 2454 1 5 . 1 1 178 178 ASN CB C 178 39.080 39.080 37.539 1.541 19554 2455 1 5 . 1 1 178 178 ASN H H 178 8.110 8.110 7.963 0.147 19554 2456 1 6 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.024 0.136 19554 2457 1 6 . 1 1 89 89 ALA C C 89 179.720 179.720 179.186 0.534 19554 2458 1 6 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.880 -0.390 19554 2459 1 6 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.170 0.050 19554 2460 1 6 . 1 1 90 90 LYS N N 90 119.500 119.500 117.008 2.492 19554 2461 1 6 . 1 1 90 90 LYS C C 90 179.090 179.090 178.775 0.315 19554 2462 1 6 . 1 1 90 90 LYS H H 90 7.980 7.980 8.383 -0.403 19554 2463 1 6 . 1 1 91 91 ARG N N 91 120.510 120.510 118.231 2.279 19554 2464 1 6 . 1 1 91 91 ARG HA H 91 4.150 4.150 4.048 0.102 19554 2465 1 6 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.135 1.165 19554 2466 1 6 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.784 0.236 19554 2467 1 6 . 1 1 91 91 ARG H H 91 8.010 8.010 7.702 0.308 19554 2468 1 6 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.678 1.442 19554 2469 1 6 . 1 1 92 92 HIS C C 92 177.360 177.360 175.706 1.654 19554 2470 1 6 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.672 0.198 19554 2471 1 6 . 1 1 93 93 GLU N N 93 118.470 118.470 116.348 2.122 19554 2472 1 6 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.230 -0.330 19554 2473 1 6 . 1 1 93 93 GLU C C 93 178.740 178.740 178.113 0.627 19554 2474 1 6 . 1 1 93 93 GLU CA C 93 59.160 59.160 57.996 1.164 19554 2475 1 6 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.622 -0.662 19554 2476 1 6 . 1 1 93 93 GLU H H 93 8.190 8.190 7.859 0.331 19554 2477 1 6 . 1 1 94 94 ALA N N 94 123.080 123.080 122.791 0.289 19554 2478 1 6 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.226 -0.156 19554 2479 1 6 . 1 1 94 94 ALA C C 94 180.330 180.330 179.727 0.603 19554 2480 1 6 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.207 0.733 19554 2481 1 6 . 1 1 94 94 ALA CB C 94 18.250 18.250 17.862 0.388 19554 2482 1 6 . 1 1 94 94 ALA H H 94 8.090 8.090 7.362 0.728 19554 2483 1 6 . 1 1 95 95 TRP N N 95 119.190 119.190 119.559 -0.369 19554 2484 1 6 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.438 -0.398 19554 2485 1 6 . 1 1 95 95 TRP C C 95 178.590 178.590 177.841 0.749 19554 2486 1 6 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.826 2.174 19554 2487 1 6 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.792 1.368 19554 2488 1 6 . 1 1 95 95 TRP H H 95 8.060 8.060 7.921 0.139 19554 2489 1 6 . 1 1 96 96 ILE N N 96 119.570 119.570 119.344 0.226 19554 2490 1 6 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.669 0.141 19554 2491 1 6 . 1 1 96 96 ILE C C 96 179.300 179.300 177.863 1.437 19554 2492 1 6 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.731 -0.191 19554 2493 1 6 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.542 -0.412 19554 2494 1 6 . 1 1 96 96 ILE H H 96 7.850 7.850 7.574 0.276 19554 2495 1 6 . 1 1 97 97 THR N N 97 117.030 117.030 114.841 2.189 19554 2496 1 6 . 1 1 97 97 THR HA H 97 3.830 3.830 4.122 -0.292 19554 2497 1 6 . 1 1 97 97 THR C C 97 177.080 177.080 176.314 0.766 19554 2498 1 6 . 1 1 97 97 THR CA C 97 66.430 66.430 65.569 0.861 19554 2499 1 6 . 1 1 97 97 THR CB C 97 68.450 68.450 68.537 -0.087 19554 2500 1 6 . 1 1 97 97 THR H H 97 7.900 7.900 8.068 -0.168 19554 2501 1 6 . 1 1 98 98 LEU N N 98 123.110 123.110 120.074 3.036 19554 2502 1 6 . 1 1 98 98 LEU HA H 98 3.930 3.930 3.970 -0.040 19554 2503 1 6 . 1 1 98 98 LEU C C 98 178.160 178.160 178.058 0.102 19554 2504 1 6 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.270 0.460 19554 2505 1 6 . 1 1 98 98 LEU CB C 98 41.540 41.540 40.642 0.898 19554 2506 1 6 . 1 1 98 98 LEU H H 98 7.830 7.830 7.516 0.314 19554 2507 1 6 . 1 1 99 99 GLU N N 99 120.520 120.520 120.910 -0.390 19554 2508 1 6 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.034 -0.154 19554 2509 1 6 . 1 1 99 99 GLU C C 99 179.010 179.010 179.049 -0.039 19554 2510 1 6 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.596 0.324 19554 2511 1 6 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.326 0.024 19554 2512 1 6 . 1 1 99 99 GLU H H 99 8.560 8.560 8.535 0.025 19554 2513 1 6 . 1 1 100 100 LYS N N 100 119.950 119.950 119.499 0.451 19554 2514 1 6 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.117 -0.087 19554 2515 1 6 . 1 1 100 100 LYS C C 100 177.870 177.870 178.994 -1.124 19554 2516 1 6 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.515 0.055 19554 2517 1 6 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.129 -0.409 19554 2518 1 6 . 1 1 100 100 LYS H H 100 7.800 7.800 7.788 0.012 19554 2519 1 6 . 1 1 101 101 ALA N N 101 120.690 120.690 123.548 -2.858 19554 2520 1 6 . 1 1 101 101 ALA HA H 101 4.020 4.020 3.971 0.049 19554 2521 1 6 . 1 1 101 101 ALA C C 101 180.990 180.990 179.670 1.320 19554 2522 1 6 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.752 0.368 19554 2523 1 6 . 1 1 101 101 ALA CB C 101 17.580 17.580 17.888 -0.308 19554 2524 1 6 . 1 1 101 101 ALA H H 101 7.800 7.800 7.274 0.526 19554 2525 1 6 . 1 1 102 102 TYR N N 102 118.440 118.440 116.973 1.467 19554 2526 1 6 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.123 0.197 19554 2527 1 6 . 1 1 102 102 TYR C C 102 178.590 178.590 178.638 -0.048 19554 2528 1 6 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.803 -0.993 19554 2529 1 6 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.118 1.572 19554 2530 1 6 . 1 1 102 102 TYR H H 102 8.580 8.580 7.428 1.152 19554 2531 1 6 . 1 1 103 103 GLU N N 103 120.860 120.860 118.874 1.986 19554 2532 1 6 . 1 1 103 103 GLU HA H 103 3.590 3.590 4.135 -0.545 19554 2533 1 6 . 1 1 103 103 GLU C C 103 178.100 178.100 177.178 0.922 19554 2534 1 6 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.969 0.111 19554 2535 1 6 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.393 0.027 19554 2536 1 6 . 1 1 103 103 GLU H H 103 8.290 8.290 7.921 0.369 19554 2537 1 6 . 1 1 104 104 ASP N N 104 116.120 116.120 117.277 -1.157 19554 2538 1 6 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.717 -0.107 19554 2539 1 6 . 1 1 104 104 ASP C C 104 174.970 174.970 174.904 0.066 19554 2540 1 6 . 1 1 104 104 ASP CA C 104 54.120 54.120 54.043 0.077 19554 2541 1 6 . 1 1 104 104 ASP CB C 104 40.480 40.480 41.169 -0.688 19554 2542 1 6 . 1 1 104 104 ASP H H 104 8.120 8.120 7.802 0.318 19554 2543 1 6 . 1 1 105 105 ALA N N 105 123.330 123.330 121.046 2.284 19554 2544 1 6 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.038 0.112 19554 2545 1 6 . 1 1 105 105 ALA C C 105 177.130 177.130 176.365 0.765 19554 2546 1 6 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.833 -0.193 19554 2547 1 6 . 1 1 105 105 ALA CB C 105 16.300 16.300 17.198 -0.898 19554 2548 1 6 . 1 1 105 105 ALA H H 105 7.710 7.710 7.856 -0.146 19554 2549 1 6 . 1 1 106 106 GLU N N 106 118.950 118.950 119.643 -0.693 19554 2550 1 6 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.417 -0.117 19554 2551 1 6 . 1 1 106 106 GLU C C 106 176.730 176.730 177.138 -0.408 19554 2552 1 6 . 1 1 106 106 GLU CA C 106 55.440 55.440 55.693 -0.253 19554 2553 1 6 . 1 1 106 106 GLU CB C 106 31.760 31.760 30.919 0.841 19554 2554 1 6 . 1 1 106 106 GLU H H 106 8.440 8.440 8.418 0.022 19554 2555 1 6 . 1 1 107 107 THR N N 107 118.780 118.780 111.055 7.725 19554 2556 1 6 . 1 1 107 107 THR HA H 107 4.550 4.550 4.743 -0.193 19554 2557 1 6 . 1 1 107 107 THR C C 107 174.250 174.250 174.076 0.174 19554 2558 1 6 . 1 1 107 107 THR CA C 107 62.360 62.360 60.157 2.203 19554 2559 1 6 . 1 1 107 107 THR CB C 107 69.390 69.390 71.247 -1.857 19554 2560 1 6 . 1 1 107 107 THR H H 107 8.740 8.740 8.225 0.515 19554 2561 1 6 . 1 1 108 108 VAL N N 108 120.540 120.540 115.910 4.630 19554 2562 1 6 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.754 -0.124 19554 2563 1 6 . 1 1 108 108 VAL C C 108 174.440 174.440 174.334 0.106 19554 2564 1 6 . 1 1 108 108 VAL CA C 108 59.000 59.000 60.280 -1.280 19554 2565 1 6 . 1 1 108 108 VAL CB C 108 34.650 34.650 34.183 0.467 19554 2566 1 6 . 1 1 108 108 VAL H H 108 9.040 9.040 8.223 0.817 19554 2567 1 6 . 1 1 109 109 THR N N 109 115.100 115.100 115.475 -0.375 19554 2568 1 6 . 1 1 109 109 THR HA H 109 5.380 5.380 4.686 0.694 19554 2569 1 6 . 1 1 109 109 THR C C 109 174.580 174.580 172.814 1.766 19554 2570 1 6 . 1 1 109 109 THR CA C 109 60.410 60.410 61.692 -1.282 19554 2571 1 6 . 1 1 109 109 THR CB C 109 70.610 70.610 70.109 0.501 19554 2572 1 6 . 1 1 109 109 THR H H 109 8.170 8.170 8.368 -0.198 19554 2573 1 6 . 1 1 110 110 GLY N N 110 108.580 108.580 114.151 -5.571 19554 2574 1 6 . 1 1 110 110 GLY C C 110 170.810 170.810 171.634 -0.824 19554 2575 1 6 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.597 -0.217 19554 2576 1 6 . 1 1 110 110 GLY H H 110 8.780 8.780 8.005 0.775 19554 2577 1 6 . 1 1 111 111 VAL N N 111 116.930 116.930 115.895 1.035 19554 2578 1 6 . 1 1 111 111 VAL HA H 111 4.780 4.780 5.304 -0.524 19554 2579 1 6 . 1 1 111 111 VAL C C 111 176.060 176.060 175.553 0.507 19554 2580 1 6 . 1 1 111 111 VAL CA C 111 59.770 59.770 59.064 0.706 19554 2581 1 6 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.871 0.879 19554 2582 1 6 . 1 1 111 111 VAL H H 111 7.810 7.810 8.377 -0.567 19554 2583 1 6 . 1 1 112 112 ILE N N 112 127.060 127.060 123.883 3.177 19554 2584 1 6 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.146 0.084 19554 2585 1 6 . 1 1 112 112 ILE C C 112 176.180 176.180 175.763 0.417 19554 2586 1 6 . 1 1 112 112 ILE CA C 112 62.220 62.220 62.494 -0.274 19554 2587 1 6 . 1 1 112 112 ILE CB C 112 37.480 37.480 35.951 1.529 19554 2588 1 6 . 1 1 112 112 ILE H H 112 9.240 9.240 8.129 1.111 19554 2589 1 6 . 1 1 113 113 ASN N N 113 127.510 127.510 126.793 0.717 19554 2590 1 6 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.717 0.223 19554 2591 1 6 . 1 1 113 113 ASN C C 113 175.020 175.020 175.615 -0.595 19554 2592 1 6 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.932 -1.642 19554 2593 1 6 . 1 1 113 113 ASN CB C 113 39.580 39.580 39.621 -0.041 19554 2594 1 6 . 1 1 113 113 ASN H H 113 9.010 9.010 8.191 0.819 19554 2595 1 6 . 1 1 114 114 GLY N N 114 107.150 107.150 107.966 -0.816 19554 2596 1 6 . 1 1 114 114 GLY C C 114 171.360 171.360 172.320 -0.960 19554 2597 1 6 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.472 1.048 19554 2598 1 6 . 1 1 114 114 GLY H H 114 7.620 7.620 7.539 0.081 19554 2599 1 6 . 1 1 115 115 LYS N N 115 121.670 121.670 122.767 -1.097 19554 2600 1 6 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.429 0.161 19554 2601 1 6 . 1 1 115 115 LYS C C 115 175.950 175.950 175.049 0.901 19554 2602 1 6 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.817 1.123 19554 2603 1 6 . 1 1 115 115 LYS CB C 115 34.040 34.040 33.661 0.379 19554 2604 1 6 . 1 1 115 115 LYS H H 115 8.550 8.550 8.224 0.326 19554 2605 1 6 . 1 1 116 116 VAL N N 116 118.750 118.750 119.158 -0.408 19554 2606 1 6 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.436 0.034 19554 2607 1 6 . 1 1 116 116 VAL C C 116 175.110 175.110 174.866 0.244 19554 2608 1 6 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.238 -0.208 19554 2609 1 6 . 1 1 116 116 VAL CB C 116 35.500 35.500 33.772 1.728 19554 2610 1 6 . 1 1 116 116 VAL H H 116 8.070 8.070 7.900 0.170 19554 2611 1 6 . 1 1 117 117 LYS N N 117 122.520 122.520 121.775 0.745 19554 2612 1 6 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.008 -0.078 19554 2613 1 6 . 1 1 117 117 LYS C C 117 177.970 177.970 177.073 0.897 19554 2614 1 6 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.138 1.532 19554 2615 1 6 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.180 -0.240 19554 2616 1 6 . 1 1 117 117 LYS H H 117 8.250 8.250 8.452 -0.202 19554 2617 1 6 . 1 1 118 118 GLY N N 118 113.440 113.440 113.262 0.178 19554 2618 1 6 . 1 1 118 118 GLY C C 118 175.540 175.540 173.594 1.946 19554 2619 1 6 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.167 0.033 19554 2620 1 6 . 1 1 118 118 GLY H H 118 8.820 8.820 7.966 0.854 19554 2621 1 6 . 1 1 119 119 GLY N N 119 109.130 109.130 106.255 2.875 19554 2622 1 6 . 1 1 119 119 GLY C C 119 170.530 170.530 172.094 -1.564 19554 2623 1 6 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.114 3.726 19554 2624 1 6 . 1 1 119 119 GLY H H 119 7.930 7.930 7.504 0.426 19554 2625 1 6 . 1 1 120 120 PHE N N 120 123.370 123.370 117.712 5.658 19554 2626 1 6 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.598 0.672 19554 2627 1 6 . 1 1 120 120 PHE C C 120 174.260 174.260 174.573 -0.313 19554 2628 1 6 . 1 1 120 120 PHE CA C 120 56.340 56.340 56.907 -0.567 19554 2629 1 6 . 1 1 120 120 PHE CB C 120 43.730 43.730 42.824 0.906 19554 2630 1 6 . 1 1 120 120 PHE H H 120 8.820 8.820 7.638 1.182 19554 2631 1 6 . 1 1 121 121 THR N N 121 114.670 114.670 121.122 -6.452 19554 2632 1 6 . 1 1 121 121 THR HA H 121 5.000 5.000 4.613 0.387 19554 2633 1 6 . 1 1 121 121 THR C C 121 173.780 173.780 173.677 0.103 19554 2634 1 6 . 1 1 121 121 THR CA C 121 60.500 60.500 61.317 -0.817 19554 2635 1 6 . 1 1 121 121 THR CB C 121 69.910 69.910 69.424 0.486 19554 2636 1 6 . 1 1 121 121 THR H H 121 8.670 8.670 8.680 -0.010 19554 2637 1 6 . 1 1 122 122 VAL N N 122 124.340 124.340 121.140 3.200 19554 2638 1 6 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.235 0.365 19554 2639 1 6 . 1 1 122 122 VAL C C 122 174.240 174.240 174.165 0.075 19554 2640 1 6 . 1 1 122 122 VAL CA C 122 59.300 59.300 59.986 -0.686 19554 2641 1 6 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.126 0.734 19554 2642 1 6 . 1 1 122 122 VAL H H 122 8.560 8.560 7.887 0.673 19554 2643 1 6 . 1 1 123 123 GLU N N 123 126.950 126.950 126.590 0.360 19554 2644 1 6 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.936 -0.326 19554 2645 1 6 . 1 1 123 123 GLU C C 123 175.840 175.840 175.874 -0.034 19554 2646 1 6 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.963 0.197 19554 2647 1 6 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.431 0.479 19554 2648 1 6 . 1 1 123 123 GLU H H 123 8.950 8.950 8.329 0.621 19554 2649 1 6 . 1 1 124 124 LEU N N 124 129.580 129.580 128.498 1.082 19554 2650 1 6 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.841 -0.181 19554 2651 1 6 . 1 1 124 124 LEU C C 124 175.350 175.350 176.440 -1.090 19554 2652 1 6 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.616 -0.416 19554 2653 1 6 . 1 1 124 124 LEU CB C 124 42.190 42.190 40.657 1.533 19554 2654 1 6 . 1 1 124 124 LEU H H 124 8.940 8.940 8.856 0.084 19554 2655 1 6 . 1 1 125 125 ASN N N 125 121.880 121.880 120.370 1.510 19554 2656 1 6 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.405 -0.215 19554 2657 1 6 . 1 1 125 125 ASN C C 125 174.690 174.690 175.306 -0.616 19554 2658 1 6 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.324 -0.444 19554 2659 1 6 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.429 -0.179 19554 2660 1 6 . 1 1 125 125 ASN H H 125 8.950 8.950 8.686 0.264 19554 2661 1 6 . 1 1 126 126 GLY N N 126 103.140 103.140 102.830 0.310 19554 2662 1 6 . 1 1 126 126 GLY C C 126 173.680 173.680 174.254 -0.574 19554 2663 1 6 . 1 1 126 126 GLY CA C 126 44.880 44.880 44.846 0.034 19554 2664 1 6 . 1 1 126 126 GLY H H 126 8.070 8.070 8.493 -0.423 19554 2665 1 6 . 1 1 127 127 ILE N N 127 122.120 122.120 122.249 -0.129 19554 2666 1 6 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.933 0.037 19554 2667 1 6 . 1 1 127 127 ILE C C 127 174.370 174.370 175.522 -1.152 19554 2668 1 6 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.657 -1.127 19554 2669 1 6 . 1 1 127 127 ILE CB C 127 38.970 38.970 37.798 1.172 19554 2670 1 6 . 1 1 127 127 ILE H H 127 7.380 7.380 7.656 -0.276 19554 2671 1 6 . 1 1 128 128 ARG N N 128 126.630 126.630 125.078 1.552 19554 2672 1 6 . 1 1 128 128 ARG HA H 128 4.640 4.640 4.786 -0.146 19554 2673 1 6 . 1 1 128 128 ARG C C 128 174.720 174.720 175.385 -0.665 19554 2674 1 6 . 1 1 128 128 ARG CA C 128 55.650 55.650 55.322 0.329 19554 2675 1 6 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.238 -0.238 19554 2676 1 6 . 1 1 128 128 ARG H H 128 8.170 8.170 8.368 -0.198 19554 2677 1 6 . 1 1 129 129 ALA N N 129 127.320 127.320 126.093 1.227 19554 2678 1 6 . 1 1 129 129 ALA HA H 129 4.850 4.850 5.016 -0.166 19554 2679 1 6 . 1 1 129 129 ALA C C 129 174.970 174.970 175.784 -0.814 19554 2680 1 6 . 1 1 129 129 ALA CA C 129 49.660 49.660 49.510 0.150 19554 2681 1 6 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.637 2.753 19554 2682 1 6 . 1 1 129 129 ALA H H 129 9.240 9.240 8.782 0.458 19554 2683 1 6 . 1 1 130 130 PHE N N 130 121.060 121.060 118.246 2.814 19554 2684 1 6 . 1 1 130 130 PHE HA H 130 5.160 5.160 4.736 0.424 19554 2685 1 6 . 1 1 130 130 PHE C C 130 172.430 172.430 173.249 -0.819 19554 2686 1 6 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.335 -2.335 19554 2687 1 6 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.690 -0.290 19554 2688 1 6 . 1 1 130 130 PHE H H 130 8.660 8.660 8.324 0.336 19554 2689 1 6 . 1 1 131 131 LEU N N 131 130.250 130.250 127.818 2.432 19554 2690 1 6 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.824 0.156 19554 2691 1 6 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.633 -1.963 19554 2692 1 6 . 1 1 131 131 LEU CB C 131 44.330 44.330 43.411 0.919 19554 2693 1 6 . 1 1 131 131 LEU H H 131 8.550 8.550 8.376 0.174 19554 2694 1 6 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.617 -0.617 19554 2695 1 6 . 1 1 132 132 PRO C C 132 179.380 179.380 178.244 1.136 19554 2696 1 6 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.928 -0.768 19554 2697 1 6 . 1 1 133 133 GLY N N 133 111.470 111.470 111.457 0.013 19554 2698 1 6 . 1 1 133 133 GLY C C 133 175.590 175.590 176.611 -1.021 19554 2699 1 6 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.617 0.913 19554 2700 1 6 . 1 1 133 133 GLY H H 133 9.140 9.140 8.868 0.272 19554 2701 1 6 . 1 1 134 134 SER HA H 134 4.350 4.350 4.249 0.101 19554 2702 1 6 . 1 1 134 134 SER C C 134 175.280 175.280 174.690 0.590 19554 2703 1 6 . 1 1 134 134 SER CA C 134 59.210 59.210 60.633 -1.423 19554 2704 1 6 . 1 1 134 134 SER CB C 134 62.730 62.730 63.298 -0.568 19554 2705 1 6 . 1 1 135 135 LEU N N 135 118.770 118.770 119.769 -0.999 19554 2706 1 6 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.470 0.110 19554 2707 1 6 . 1 1 135 135 LEU C C 135 177.500 177.500 176.065 1.435 19554 2708 1 6 . 1 1 135 135 LEU CA C 135 53.770 53.770 54.075 -0.305 19554 2709 1 6 . 1 1 135 135 LEU H H 135 8.030 8.030 7.450 0.580 19554 2710 1 6 . 1 1 136 136 VAL N N 136 123.080 123.080 118.547 4.533 19554 2711 1 6 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.320 -0.710 19554 2712 1 6 . 1 1 136 136 VAL C C 136 173.150 173.150 175.717 -2.567 19554 2713 1 6 . 1 1 136 136 VAL CA C 136 65.220 65.220 62.656 2.564 19554 2714 1 6 . 1 1 136 136 VAL CB C 136 32.020 32.020 33.873 -1.853 19554 2715 1 6 . 1 1 136 136 VAL H H 136 7.550 7.550 7.733 -0.183 19554 2716 1 6 . 1 1 137 137 ASP N N 137 117.300 117.300 123.270 -5.970 19554 2717 1 6 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.838 -0.498 19554 2718 1 6 . 1 1 137 137 ASP C C 137 174.840 174.840 175.416 -0.576 19554 2719 1 6 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.984 -1.914 19554 2720 1 6 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.142 3.318 19554 2721 1 6 . 1 1 137 137 ASP H H 137 7.940 7.940 7.802 0.138 19554 2722 1 6 . 1 1 138 138 VAL N N 138 116.750 116.750 119.279 -2.529 19554 2723 1 6 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.405 -0.265 19554 2724 1 6 . 1 1 138 138 VAL CA C 138 61.190 61.190 60.774 0.416 19554 2725 1 6 . 1 1 138 138 VAL CB C 138 33.330 33.330 33.838 -0.508 19554 2726 1 6 . 1 1 138 138 VAL H H 138 10.000 10.000 8.275 1.725 19554 2727 1 6 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.513 -0.003 19554 2728 1 6 . 1 1 140 140 PRO C C 140 175.860 175.860 176.363 -0.503 19554 2729 1 6 . 1 1 141 141 VAL N N 141 124.910 124.910 121.322 3.588 19554 2730 1 6 . 1 1 141 141 VAL HA H 141 3.900 3.900 3.929 -0.029 19554 2731 1 6 . 1 1 141 141 VAL C C 141 175.120 175.120 174.907 0.213 19554 2732 1 6 . 1 1 141 141 VAL CA C 141 62.720 62.720 64.182 -1.462 19554 2733 1 6 . 1 1 141 141 VAL CB C 141 31.870 31.870 32.263 -0.393 19554 2734 1 6 . 1 1 141 141 VAL H H 141 8.110 8.110 8.413 -0.303 19554 2735 1 6 . 1 1 142 142 ARG N N 142 119.730 119.730 124.616 -4.886 19554 2736 1 6 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.319 0.301 19554 2737 1 6 . 1 1 142 142 ARG C C 142 173.520 173.520 174.243 -0.723 19554 2738 1 6 . 1 1 142 142 ARG CA C 142 53.020 53.020 55.089 -2.069 19554 2739 1 6 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.952 -0.472 19554 2740 1 6 . 1 1 142 142 ARG H H 142 7.440 7.440 8.024 -0.584 19554 2741 1 6 . 1 1 143 143 ASP N N 143 119.780 119.780 122.351 -2.571 19554 2742 1 6 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.464 0.206 19554 2743 1 6 . 1 1 143 143 ASP C C 143 175.970 175.970 176.262 -0.292 19554 2744 1 6 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.739 -0.709 19554 2745 1 6 . 1 1 143 143 ASP CB C 143 41.730 41.730 40.901 0.829 19554 2746 1 6 . 1 1 143 143 ASP H H 143 7.880 7.880 8.602 -0.722 19554 2747 1 6 . 1 1 144 144 THR N N 144 110.060 110.060 115.952 -5.892 19554 2748 1 6 . 1 1 144 144 THR HA H 144 4.110 4.110 4.320 -0.210 19554 2749 1 6 . 1 1 144 144 THR C C 144 175.730 175.730 175.140 0.590 19554 2750 1 6 . 1 1 144 144 THR CA C 144 61.520 61.520 63.080 -1.560 19554 2751 1 6 . 1 1 144 144 THR CB C 144 68.610 68.610 69.226 -0.616 19554 2752 1 6 . 1 1 144 144 THR H H 144 8.030 8.030 8.336 -0.306 19554 2753 1 6 . 1 1 145 145 LEU N N 145 124.820 124.820 123.069 1.751 19554 2754 1 6 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.474 0.226 19554 2755 1 6 . 1 1 145 145 LEU C C 145 178.010 178.010 177.665 0.345 19554 2756 1 6 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.063 1.287 19554 2757 1 6 . 1 1 145 145 LEU CB C 145 42.100 42.100 40.642 1.458 19554 2758 1 6 . 1 1 145 145 LEU H H 145 8.050 8.050 8.040 0.010 19554 2759 1 6 . 1 1 146 146 HIS N N 146 116.310 116.310 116.484 -0.174 19554 2760 1 6 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.390 0.150 19554 2761 1 6 . 1 1 146 146 HIS C C 146 175.000 175.000 174.833 0.167 19554 2762 1 6 . 1 1 146 146 HIS H H 146 8.120 8.120 7.949 0.171 19554 2763 1 6 . 1 1 147 147 LEU N N 147 120.320 120.320 116.129 4.191 19554 2764 1 6 . 1 1 147 147 LEU HA H 147 4.070 4.070 4.430 -0.360 19554 2765 1 6 . 1 1 147 147 LEU C C 147 176.810 176.810 176.029 0.781 19554 2766 1 6 . 1 1 147 147 LEU CA C 147 54.710 54.710 53.363 1.347 19554 2767 1 6 . 1 1 147 147 LEU CB C 147 41.960 41.960 41.571 0.389 19554 2768 1 6 . 1 1 147 147 LEU H H 147 7.620 7.620 7.292 0.328 19554 2769 1 6 . 1 1 148 148 GLU N N 148 118.950 118.950 119.701 -0.751 19554 2770 1 6 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.547 -0.767 19554 2771 1 6 . 1 1 148 148 GLU C C 148 177.480 177.480 177.114 0.366 19554 2772 1 6 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.129 3.301 19554 2773 1 6 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.429 -1.749 19554 2774 1 6 . 1 1 148 148 GLU H H 148 7.760 7.760 7.375 0.385 19554 2775 1 6 . 1 1 149 149 GLY N N 149 111.070 111.070 113.778 -2.708 19554 2776 1 6 . 1 1 149 149 GLY C C 149 173.820 173.820 174.113 -0.293 19554 2777 1 6 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.944 -0.414 19554 2778 1 6 . 1 1 149 149 GLY H H 149 8.630 8.630 8.414 0.216 19554 2779 1 6 . 1 1 150 150 LYS N N 150 119.380 119.380 120.256 -0.876 19554 2780 1 6 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.184 0.146 19554 2781 1 6 . 1 1 150 150 LYS C C 150 175.110 175.110 175.452 -0.342 19554 2782 1 6 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.490 -1.320 19554 2783 1 6 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.403 0.147 19554 2784 1 6 . 1 1 150 150 LYS H H 150 7.520 7.520 7.956 -0.436 19554 2785 1 6 . 1 1 151 151 GLU N N 151 122.850 122.850 124.572 -1.722 19554 2786 1 6 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.452 0.018 19554 2787 1 6 . 1 1 151 151 GLU C C 151 175.510 175.510 175.170 0.340 19554 2788 1 6 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.551 0.789 19554 2789 1 6 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.107 0.903 19554 2790 1 6 . 1 1 151 151 GLU H H 151 8.410 8.410 8.482 -0.072 19554 2791 1 6 . 1 1 152 152 LEU N N 152 127.520 127.520 125.494 2.026 19554 2792 1 6 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.517 0.023 19554 2793 1 6 . 1 1 152 152 LEU C C 152 173.750 173.750 175.236 -1.486 19554 2794 1 6 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.141 -0.321 19554 2795 1 6 . 1 1 152 152 LEU H H 152 8.850 8.850 7.963 0.887 19554 2796 1 6 . 1 1 153 153 GLU N N 153 116.500 116.500 121.181 -4.681 19554 2797 1 6 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.409 0.171 19554 2798 1 6 . 1 1 153 153 GLU C C 153 175.120 175.120 174.585 0.535 19554 2799 1 6 . 1 1 153 153 GLU CA C 153 55.160 55.160 55.592 -0.432 19554 2800 1 6 . 1 1 153 153 GLU H H 153 7.110 7.110 8.410 -1.300 19554 2801 1 6 . 1 1 154 154 PHE N N 154 115.150 115.150 122.465 -7.315 19554 2802 1 6 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.884 -0.024 19554 2803 1 6 . 1 1 154 154 PHE C C 154 175.630 175.630 174.443 1.187 19554 2804 1 6 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.615 0.575 19554 2805 1 6 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.147 2.103 19554 2806 1 6 . 1 1 154 154 PHE H H 154 8.910 8.910 8.522 0.388 19554 2807 1 6 . 1 1 155 155 LYS N N 155 114.560 114.560 117.679 -3.119 19554 2808 1 6 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.657 0.053 19554 2809 1 6 . 1 1 155 155 LYS C C 155 176.500 176.500 175.058 1.442 19554 2810 1 6 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.336 -1.736 19554 2811 1 6 . 1 1 155 155 LYS CB C 155 33.960 33.960 35.290 -1.330 19554 2812 1 6 . 1 1 155 155 LYS H H 155 8.100 8.100 8.391 -0.291 19554 2813 1 6 . 1 1 156 156 VAL N N 156 124.530 124.530 122.295 2.235 19554 2814 1 6 . 1 1 156 156 VAL C C 156 175.630 175.630 175.874 -0.244 19554 2815 1 6 . 1 1 156 156 VAL CA C 156 62.690 62.690 62.331 0.358 19554 2816 1 6 . 1 1 156 156 VAL CB C 156 31.600 31.600 31.305 0.295 19554 2817 1 6 . 1 1 156 156 VAL H H 156 9.920 9.920 8.216 1.704 19554 2818 1 6 . 1 1 157 157 ILE N N 157 119.590 119.590 127.727 -8.137 19554 2819 1 6 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.057 0.663 19554 2820 1 6 . 1 1 157 157 ILE C C 157 176.190 176.190 175.240 0.950 19554 2821 1 6 . 1 1 157 157 ILE CA C 157 61.050 61.050 62.133 -1.083 19554 2822 1 6 . 1 1 157 157 ILE CB C 157 39.170 39.170 38.657 0.513 19554 2823 1 6 . 1 1 157 157 ILE H H 157 8.530 8.530 8.302 0.228 19554 2824 1 6 . 1 1 158 158 LYS N N 158 122.460 122.460 119.624 2.836 19554 2825 1 6 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.416 -0.216 19554 2826 1 6 . 1 1 158 158 LYS C C 158 173.000 173.000 174.101 -1.101 19554 2827 1 6 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.165 0.635 19554 2828 1 6 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.100 1.540 19554 2829 1 6 . 1 1 158 158 LYS H H 158 7.600 7.600 7.772 -0.172 19554 2830 1 6 . 1 1 159 159 LEU N N 159 125.430 125.430 124.187 1.243 19554 2831 1 6 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.807 -0.187 19554 2832 1 6 . 1 1 159 159 LEU C C 159 174.390 174.390 175.861 -1.471 19554 2833 1 6 . 1 1 159 159 LEU CA C 159 54.510 54.510 53.703 0.806 19554 2834 1 6 . 1 1 159 159 LEU H H 159 7.950 7.950 8.219 -0.269 19554 2835 1 6 . 1 1 160 160 ASP N N 160 124.740 124.740 123.226 1.514 19554 2836 1 6 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.640 0.030 19554 2837 1 6 . 1 1 160 160 ASP C C 160 176.020 176.020 176.839 -0.819 19554 2838 1 6 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.889 -1.269 19554 2839 1 6 . 1 1 160 160 ASP CB C 160 42.050 42.050 43.092 -1.042 19554 2840 1 6 . 1 1 160 160 ASP H H 160 8.760 8.760 8.191 0.569 19554 2841 1 6 . 1 1 161 161 GLN N N 161 126.490 126.490 124.467 2.023 19554 2842 1 6 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.149 -1.029 19554 2843 1 6 . 1 1 161 161 GLN C C 161 178.280 178.280 177.232 1.048 19554 2844 1 6 . 1 1 161 161 GLN CA C 161 58.770 58.770 57.854 0.916 19554 2845 1 6 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.514 -0.674 19554 2846 1 6 . 1 1 161 161 GLN H H 161 9.110 9.110 8.707 0.403 19554 2847 1 6 . 1 1 162 162 LYS N N 162 119.150 119.150 120.319 -1.169 19554 2848 1 6 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.084 -0.284 19554 2849 1 6 . 1 1 162 162 LYS C C 162 177.900 177.900 177.701 0.199 19554 2850 1 6 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.440 0.260 19554 2851 1 6 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.556 -1.166 19554 2852 1 6 . 1 1 162 162 LYS H H 162 8.070 8.070 7.981 0.089 19554 2853 1 6 . 1 1 163 163 ARG N N 163 114.850 114.850 115.722 -0.872 19554 2854 1 6 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.352 -0.202 19554 2855 1 6 . 1 1 163 163 ARG C C 163 174.750 174.750 175.840 -1.090 19554 2856 1 6 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.419 -0.619 19554 2857 1 6 . 1 1 163 163 ARG H H 163 7.010 7.010 7.644 -0.634 19554 2858 1 6 . 1 1 164 164 ASN N N 164 117.810 117.810 117.682 0.128 19554 2859 1 6 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.327 -0.197 19554 2860 1 6 . 1 1 164 164 ASN C C 164 173.880 173.880 173.548 0.332 19554 2861 1 6 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.302 -0.342 19554 2862 1 6 . 1 1 164 164 ASN CB C 164 37.530 37.530 37.210 0.320 19554 2863 1 6 . 1 1 164 164 ASN H H 164 7.750 7.750 8.078 -0.328 19554 2864 1 6 . 1 1 165 165 ASN N N 165 116.170 116.170 114.749 1.421 19554 2865 1 6 . 1 1 165 165 ASN HA H 165 5.060 5.060 5.031 0.029 19554 2866 1 6 . 1 1 165 165 ASN C C 165 172.990 172.990 172.992 -0.002 19554 2867 1 6 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.261 0.179 19554 2868 1 6 . 1 1 165 165 ASN CB C 165 41.820 41.820 41.922 -0.102 19554 2869 1 6 . 1 1 165 165 ASN H H 165 8.020 8.020 7.723 0.297 19554 2870 1 6 . 1 1 166 166 VAL N N 166 124.790 124.790 115.682 9.108 19554 2871 1 6 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.336 0.164 19554 2872 1 6 . 1 1 166 166 VAL C C 166 174.190 174.190 174.638 -0.448 19554 2873 1 6 . 1 1 166 166 VAL CA C 166 61.030 61.030 59.948 1.082 19554 2874 1 6 . 1 1 166 166 VAL CB C 166 34.620 34.620 32.306 2.314 19554 2875 1 6 . 1 1 166 166 VAL H H 166 8.380 8.380 8.167 0.213 19554 2876 1 6 . 1 1 167 167 VAL N N 167 128.000 128.000 118.812 9.188 19554 2877 1 6 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.982 0.268 19554 2878 1 6 . 1 1 167 167 VAL C C 167 176.000 176.000 174.470 1.530 19554 2879 1 6 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.940 0.670 19554 2880 1 6 . 1 1 167 167 VAL CB C 167 33.900 33.900 35.050 -1.150 19554 2881 1 6 . 1 1 167 167 VAL H H 167 8.710 8.710 7.847 0.863 19554 2882 1 6 . 1 1 168 168 VAL N N 168 118.360 118.360 115.417 2.943 19554 2883 1 6 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.908 0.332 19554 2884 1 6 . 1 1 168 168 VAL C C 168 172.800 172.800 175.252 -2.452 19554 2885 1 6 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.191 -1.331 19554 2886 1 6 . 1 1 168 168 VAL CB C 168 35.350 35.350 34.226 1.124 19554 2887 1 6 . 1 1 168 168 VAL H H 168 8.560 8.560 7.915 0.645 19554 2888 1 6 . 1 1 169 169 SER N N 169 106.720 106.720 117.076 -10.356 19554 2889 1 6 . 1 1 169 169 SER HA H 169 4.480 4.480 4.883 -0.403 19554 2890 1 6 . 1 1 169 169 SER C C 169 175.950 175.950 175.414 0.536 19554 2891 1 6 . 1 1 169 169 SER CA C 169 55.550 55.550 56.552 -1.002 19554 2892 1 6 . 1 1 169 169 SER CB C 169 64.980 64.980 65.881 -0.901 19554 2893 1 6 . 1 1 169 169 SER H H 169 8.600 8.600 8.502 0.098 19554 2894 1 6 . 1 1 170 170 ARG N N 170 129.620 129.620 121.645 7.975 19554 2895 1 6 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.315 0.395 19554 2896 1 6 . 1 1 170 170 ARG C C 170 177.870 177.870 176.694 1.176 19554 2897 1 6 . 1 1 170 170 ARG CA C 170 57.150 57.150 57.612 -0.462 19554 2898 1 6 . 1 1 170 170 ARG H H 170 7.610 7.610 8.848 -1.238 19554 2899 1 6 . 1 1 171 171 ARG N N 171 122.230 122.230 120.039 2.191 19554 2900 1 6 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.243 -0.773 19554 2901 1 6 . 1 1 171 171 ARG C C 171 175.760 175.760 177.637 -1.877 19554 2902 1 6 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.419 1.011 19554 2903 1 6 . 1 1 171 171 ARG CB C 171 30.410 30.410 30.250 0.160 19554 2904 1 6 . 1 1 171 171 ARG H H 171 8.260 8.260 8.072 0.188 19554 2905 1 6 . 1 1 172 172 ALA N N 172 116.490 116.490 121.385 -4.895 19554 2906 1 6 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.351 -0.301 19554 2907 1 6 . 1 1 172 172 ALA C C 172 179.480 179.480 179.382 0.098 19554 2908 1 6 . 1 1 172 172 ALA CA C 172 54.010 54.010 53.316 0.695 19554 2909 1 6 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.282 0.608 19554 2910 1 6 . 1 1 172 172 ALA H H 172 7.760 7.760 8.104 -0.344 19554 2911 1 6 . 1 1 173 173 VAL N N 173 116.440 116.440 120.382 -3.942 19554 2912 1 6 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.651 -0.181 19554 2913 1 6 . 1 1 173 173 VAL C C 173 177.680 177.680 177.204 0.476 19554 2914 1 6 . 1 1 173 173 VAL CA C 173 65.080 65.080 65.355 -0.275 19554 2915 1 6 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.918 -0.038 19554 2916 1 6 . 1 1 173 173 VAL H H 173 7.210 7.210 7.656 -0.446 19554 2917 1 6 . 1 1 174 174 ILE N N 174 119.790 119.790 115.986 3.804 19554 2918 1 6 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.621 0.059 19554 2919 1 6 . 1 1 174 174 ILE C C 174 178.310 178.310 177.341 0.969 19554 2920 1 6 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.045 -0.275 19554 2921 1 6 . 1 1 174 174 ILE CB C 174 38.450 38.450 36.902 1.548 19554 2922 1 6 . 1 1 174 174 ILE H H 174 7.160 7.160 7.320 -0.160 19554 2923 1 6 . 1 1 175 175 GLU N N 175 117.810 117.810 120.984 -3.174 19554 2924 1 6 . 1 1 175 175 GLU HA H 175 4.030 4.030 3.943 0.087 19554 2925 1 6 . 1 1 175 175 GLU C C 175 177.170 177.170 178.591 -1.421 19554 2926 1 6 . 1 1 175 175 GLU CA C 175 57.190 57.190 59.097 -1.907 19554 2927 1 6 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.318 0.322 19554 2928 1 6 . 1 1 175 175 GLU H H 175 8.250 8.250 8.284 -0.034 19554 2929 1 6 . 1 1 176 176 SER N N 176 114.300 114.300 114.439 -0.139 19554 2930 1 6 . 1 1 176 176 SER HA H 176 4.320 4.320 4.040 0.280 19554 2931 1 6 . 1 1 176 176 SER C C 176 174.930 174.930 176.261 -1.331 19554 2932 1 6 . 1 1 176 176 SER CA C 176 59.060 59.060 61.364 -2.304 19554 2933 1 6 . 1 1 176 176 SER CB C 176 63.640 63.640 63.024 0.616 19554 2934 1 6 . 1 1 176 176 SER H H 176 7.460 7.460 7.886 -0.426 19554 2935 1 6 . 1 1 177 177 GLU N N 177 121.860 121.860 121.581 0.279 19554 2936 1 6 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.044 0.126 19554 2937 1 6 . 1 1 177 177 GLU C C 177 176.340 176.340 178.561 -2.221 19554 2938 1 6 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.588 -1.948 19554 2939 1 6 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.625 0.125 19554 2940 1 6 . 1 1 177 177 GLU H H 177 7.890 7.890 7.467 0.423 19554 2941 1 6 . 1 1 178 178 ASN N N 178 119.030 119.030 118.653 0.377 19554 2942 1 6 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.700 0.000 19554 2943 1 6 . 1 1 178 178 ASN C C 178 174.230 174.230 173.978 0.252 19554 2944 1 6 . 1 1 178 178 ASN CA C 178 53.010 53.010 53.217 -0.207 19554 2945 1 6 . 1 1 178 178 ASN CB C 178 39.080 39.080 37.892 1.188 19554 2946 1 6 . 1 1 178 178 ASN H H 178 8.110 8.110 7.813 0.297 19554 2947 1 7 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.187 -0.027 19554 2948 1 7 . 1 1 89 89 ALA C C 89 179.720 179.720 178.420 1.300 19554 2949 1 7 . 1 1 89 89 ALA CA C 89 54.490 54.490 53.932 0.558 19554 2950 1 7 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.681 -0.461 19554 2951 1 7 . 1 1 90 90 LYS N N 90 119.500 119.500 118.544 0.956 19554 2952 1 7 . 1 1 90 90 LYS C C 90 179.090 179.090 178.931 0.159 19554 2953 1 7 . 1 1 90 90 LYS H H 90 7.980 7.980 8.445 -0.465 19554 2954 1 7 . 1 1 91 91 ARG N N 91 120.510 120.510 117.988 2.522 19554 2955 1 7 . 1 1 91 91 ARG HA H 91 4.150 4.150 3.973 0.177 19554 2956 1 7 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.918 0.382 19554 2957 1 7 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.442 0.578 19554 2958 1 7 . 1 1 91 91 ARG H H 91 8.010 8.010 7.735 0.275 19554 2959 1 7 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.621 1.499 19554 2960 1 7 . 1 1 92 92 HIS C C 92 177.360 177.360 176.035 1.325 19554 2961 1 7 . 1 1 92 92 HIS CB C 92 29.870 29.870 28.807 1.063 19554 2962 1 7 . 1 1 93 93 GLU N N 93 118.470 118.470 118.542 -0.072 19554 2963 1 7 . 1 1 93 93 GLU HA H 93 3.900 3.900 3.833 0.067 19554 2964 1 7 . 1 1 93 93 GLU C C 93 178.740 178.740 177.976 0.764 19554 2965 1 7 . 1 1 93 93 GLU CA C 93 59.160 59.160 57.726 1.434 19554 2966 1 7 . 1 1 93 93 GLU CB C 93 28.960 28.960 30.083 -1.123 19554 2967 1 7 . 1 1 93 93 GLU H H 93 8.190 8.190 7.249 0.941 19554 2968 1 7 . 1 1 94 94 ALA N N 94 123.080 123.080 122.822 0.258 19554 2969 1 7 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.150 -0.080 19554 2970 1 7 . 1 1 94 94 ALA C C 94 180.330 180.330 180.085 0.245 19554 2971 1 7 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.531 0.409 19554 2972 1 7 . 1 1 94 94 ALA CB C 94 18.250 18.250 17.921 0.330 19554 2973 1 7 . 1 1 94 94 ALA H H 94 8.090 8.090 7.518 0.572 19554 2974 1 7 . 1 1 95 95 TRP N N 95 119.190 119.190 119.641 -0.451 19554 2975 1 7 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.474 -0.434 19554 2976 1 7 . 1 1 95 95 TRP C C 95 178.590 178.590 177.936 0.654 19554 2977 1 7 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.821 2.179 19554 2978 1 7 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.881 1.279 19554 2979 1 7 . 1 1 95 95 TRP H H 95 8.060 8.060 7.888 0.172 19554 2980 1 7 . 1 1 96 96 ILE N N 96 119.570 119.570 118.979 0.591 19554 2981 1 7 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.801 0.009 19554 2982 1 7 . 1 1 96 96 ILE C C 96 179.300 179.300 177.949 1.351 19554 2983 1 7 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.629 -0.089 19554 2984 1 7 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.714 -0.584 19554 2985 1 7 . 1 1 96 96 ILE H H 96 7.850 7.850 7.768 0.082 19554 2986 1 7 . 1 1 97 97 THR N N 97 117.030 117.030 113.979 3.051 19554 2987 1 7 . 1 1 97 97 THR HA H 97 3.830 3.830 4.209 -0.379 19554 2988 1 7 . 1 1 97 97 THR C C 97 177.080 177.080 176.694 0.386 19554 2989 1 7 . 1 1 97 97 THR CA C 97 66.430 66.430 65.311 1.119 19554 2990 1 7 . 1 1 97 97 THR CB C 97 68.450 68.450 69.032 -0.582 19554 2991 1 7 . 1 1 97 97 THR H H 97 7.900 7.900 8.005 -0.105 19554 2992 1 7 . 1 1 98 98 LEU N N 98 123.110 123.110 120.754 2.356 19554 2993 1 7 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.082 -0.152 19554 2994 1 7 . 1 1 98 98 LEU C C 98 178.160 178.160 178.269 -0.109 19554 2995 1 7 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.583 0.147 19554 2996 1 7 . 1 1 98 98 LEU CB C 98 41.540 41.540 40.896 0.644 19554 2997 1 7 . 1 1 98 98 LEU H H 98 7.830 7.830 7.573 0.257 19554 2998 1 7 . 1 1 99 99 GLU N N 99 120.520 120.520 119.701 0.819 19554 2999 1 7 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.326 -0.446 19554 3000 1 7 . 1 1 99 99 GLU C C 99 179.010 179.010 178.579 0.431 19554 3001 1 7 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.039 0.881 19554 3002 1 7 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.581 -0.230 19554 3003 1 7 . 1 1 99 99 GLU H H 99 8.560 8.560 8.602 -0.042 19554 3004 1 7 . 1 1 100 100 LYS N N 100 119.950 119.950 118.785 1.165 19554 3005 1 7 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.196 -0.166 19554 3006 1 7 . 1 1 100 100 LYS C C 100 177.870 177.870 177.932 -0.062 19554 3007 1 7 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.395 0.175 19554 3008 1 7 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.413 -0.693 19554 3009 1 7 . 1 1 100 100 LYS H H 100 7.800 7.800 7.794 0.006 19554 3010 1 7 . 1 1 101 101 ALA N N 101 120.690 120.690 121.528 -0.838 19554 3011 1 7 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.056 -0.036 19554 3012 1 7 . 1 1 101 101 ALA C C 101 180.990 180.990 179.741 1.249 19554 3013 1 7 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.382 0.738 19554 3014 1 7 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.261 -0.681 19554 3015 1 7 . 1 1 101 101 ALA H H 101 7.800 7.800 7.147 0.653 19554 3016 1 7 . 1 1 102 102 TYR N N 102 118.440 118.440 117.066 1.374 19554 3017 1 7 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.226 0.094 19554 3018 1 7 . 1 1 102 102 TYR C C 102 178.590 178.590 178.228 0.362 19554 3019 1 7 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.319 -0.509 19554 3020 1 7 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.343 1.347 19554 3021 1 7 . 1 1 102 102 TYR H H 102 8.580 8.580 7.447 1.133 19554 3022 1 7 . 1 1 103 103 GLU N N 103 120.860 120.860 119.367 1.493 19554 3023 1 7 . 1 1 103 103 GLU HA H 103 3.590 3.590 4.088 -0.498 19554 3024 1 7 . 1 1 103 103 GLU C C 103 178.100 178.100 176.839 1.261 19554 3025 1 7 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.888 0.192 19554 3026 1 7 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.151 0.269 19554 3027 1 7 . 1 1 103 103 GLU H H 103 8.290 8.290 7.928 0.362 19554 3028 1 7 . 1 1 104 104 ASP N N 104 116.120 116.120 117.690 -1.570 19554 3029 1 7 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.665 -0.055 19554 3030 1 7 . 1 1 104 104 ASP C C 104 174.970 174.970 174.922 0.048 19554 3031 1 7 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.158 0.962 19554 3032 1 7 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.723 -0.243 19554 3033 1 7 . 1 1 104 104 ASP H H 104 8.120 8.120 7.455 0.665 19554 3034 1 7 . 1 1 105 105 ALA N N 105 123.330 123.330 119.952 3.378 19554 3035 1 7 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.008 0.142 19554 3036 1 7 . 1 1 105 105 ALA C C 105 177.130 177.130 175.888 1.242 19554 3037 1 7 . 1 1 105 105 ALA CA C 105 52.640 52.640 53.000 -0.360 19554 3038 1 7 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.723 -0.423 19554 3039 1 7 . 1 1 105 105 ALA H H 105 7.710 7.710 7.853 -0.143 19554 3040 1 7 . 1 1 106 106 GLU N N 106 118.950 118.950 119.661 -0.711 19554 3041 1 7 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.428 -0.128 19554 3042 1 7 . 1 1 106 106 GLU C C 106 176.730 176.730 175.821 0.909 19554 3043 1 7 . 1 1 106 106 GLU CA C 106 55.440 55.440 55.412 0.028 19554 3044 1 7 . 1 1 106 106 GLU CB C 106 31.760 31.760 31.754 0.006 19554 3045 1 7 . 1 1 106 106 GLU H H 106 8.440 8.440 8.157 0.283 19554 3046 1 7 . 1 1 107 107 THR N N 107 118.780 118.780 116.127 2.653 19554 3047 1 7 . 1 1 107 107 THR HA H 107 4.550 4.550 4.491 0.059 19554 3048 1 7 . 1 1 107 107 THR C C 107 174.250 174.250 173.781 0.469 19554 3049 1 7 . 1 1 107 107 THR CA C 107 62.360 62.360 61.339 1.021 19554 3050 1 7 . 1 1 107 107 THR CB C 107 69.390 69.390 69.814 -0.424 19554 3051 1 7 . 1 1 107 107 THR H H 107 8.740 8.740 8.336 0.404 19554 3052 1 7 . 1 1 108 108 VAL N N 108 120.540 120.540 121.591 -1.051 19554 3053 1 7 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.826 -0.196 19554 3054 1 7 . 1 1 108 108 VAL C C 108 174.440 174.440 174.219 0.221 19554 3055 1 7 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.192 -0.192 19554 3056 1 7 . 1 1 108 108 VAL CB C 108 34.650 34.650 34.516 0.135 19554 3057 1 7 . 1 1 108 108 VAL H H 108 9.040 9.040 8.383 0.657 19554 3058 1 7 . 1 1 109 109 THR N N 109 115.100 115.100 114.267 0.833 19554 3059 1 7 . 1 1 109 109 THR HA H 109 5.380 5.380 4.215 1.165 19554 3060 1 7 . 1 1 109 109 THR C C 109 174.580 174.580 172.886 1.694 19554 3061 1 7 . 1 1 109 109 THR CA C 109 60.410 60.410 61.761 -1.351 19554 3062 1 7 . 1 1 109 109 THR CB C 109 70.610 70.610 69.595 1.015 19554 3063 1 7 . 1 1 109 109 THR H H 109 8.170 8.170 8.157 0.013 19554 3064 1 7 . 1 1 110 110 GLY N N 110 108.580 108.580 113.754 -5.174 19554 3065 1 7 . 1 1 110 110 GLY C C 110 170.810 170.810 171.873 -1.063 19554 3066 1 7 . 1 1 110 110 GLY CA C 110 45.380 45.380 44.807 0.573 19554 3067 1 7 . 1 1 110 110 GLY H H 110 8.780 8.780 7.558 1.222 19554 3068 1 7 . 1 1 111 111 VAL N N 111 116.930 116.930 121.388 -4.458 19554 3069 1 7 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.555 0.225 19554 3070 1 7 . 1 1 111 111 VAL C C 111 176.060 176.060 175.769 0.291 19554 3071 1 7 . 1 1 111 111 VAL CA C 111 59.770 59.770 60.840 -1.070 19554 3072 1 7 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.398 1.352 19554 3073 1 7 . 1 1 111 111 VAL H H 111 7.810 7.810 8.371 -0.561 19554 3074 1 7 . 1 1 112 112 ILE N N 112 127.060 127.060 129.990 -2.930 19554 3075 1 7 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.235 -0.005 19554 3076 1 7 . 1 1 112 112 ILE C C 112 176.180 176.180 175.525 0.655 19554 3077 1 7 . 1 1 112 112 ILE CA C 112 62.220 62.220 62.590 -0.370 19554 3078 1 7 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.502 0.978 19554 3079 1 7 . 1 1 112 112 ILE H H 112 9.240 9.240 7.946 1.294 19554 3080 1 7 . 1 1 113 113 ASN N N 113 127.510 127.510 125.782 1.728 19554 3081 1 7 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.789 0.151 19554 3082 1 7 . 1 1 113 113 ASN C C 113 175.020 175.020 175.355 -0.335 19554 3083 1 7 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.885 -1.595 19554 3084 1 7 . 1 1 113 113 ASN CB C 113 39.580 39.580 39.533 0.047 19554 3085 1 7 . 1 1 113 113 ASN H H 113 9.010 9.010 8.423 0.587 19554 3086 1 7 . 1 1 114 114 GLY N N 114 107.150 107.150 107.784 -0.634 19554 3087 1 7 . 1 1 114 114 GLY C C 114 171.360 171.360 172.029 -0.669 19554 3088 1 7 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.556 0.964 19554 3089 1 7 . 1 1 114 114 GLY H H 114 7.620 7.620 7.535 0.085 19554 3090 1 7 . 1 1 115 115 LYS N N 115 121.670 121.670 121.839 -0.169 19554 3091 1 7 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.394 0.196 19554 3092 1 7 . 1 1 115 115 LYS C C 115 175.950 175.950 175.032 0.918 19554 3093 1 7 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.799 1.141 19554 3094 1 7 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.172 -0.132 19554 3095 1 7 . 1 1 115 115 LYS H H 115 8.550 8.550 8.170 0.380 19554 3096 1 7 . 1 1 116 116 VAL N N 116 118.750 118.750 118.267 0.483 19554 3097 1 7 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.479 -0.009 19554 3098 1 7 . 1 1 116 116 VAL C C 116 175.110 175.110 174.958 0.152 19554 3099 1 7 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.124 -0.094 19554 3100 1 7 . 1 1 116 116 VAL CB C 116 35.500 35.500 34.288 1.212 19554 3101 1 7 . 1 1 116 116 VAL H H 116 8.070 8.070 7.908 0.162 19554 3102 1 7 . 1 1 117 117 LYS N N 117 122.520 122.520 121.914 0.606 19554 3103 1 7 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.048 -0.118 19554 3104 1 7 . 1 1 117 117 LYS C C 117 177.970 177.970 177.014 0.956 19554 3105 1 7 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.156 1.514 19554 3106 1 7 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.100 -0.160 19554 3107 1 7 . 1 1 117 117 LYS H H 117 8.250 8.250 8.507 -0.257 19554 3108 1 7 . 1 1 118 118 GLY N N 118 113.440 113.440 112.192 1.248 19554 3109 1 7 . 1 1 118 118 GLY C C 118 175.540 175.540 173.324 2.216 19554 3110 1 7 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.127 0.073 19554 3111 1 7 . 1 1 118 118 GLY H H 118 8.820 8.820 8.018 0.802 19554 3112 1 7 . 1 1 119 119 GLY N N 119 109.130 109.130 106.047 3.083 19554 3113 1 7 . 1 1 119 119 GLY C C 119 170.530 170.530 172.153 -1.623 19554 3114 1 7 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.312 3.528 19554 3115 1 7 . 1 1 119 119 GLY H H 119 7.930 7.930 7.486 0.444 19554 3116 1 7 . 1 1 120 120 PHE N N 120 123.370 123.370 117.242 6.128 19554 3117 1 7 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.559 0.711 19554 3118 1 7 . 1 1 120 120 PHE C C 120 174.260 174.260 174.332 -0.072 19554 3119 1 7 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.070 -0.730 19554 3120 1 7 . 1 1 120 120 PHE CB C 120 43.730 43.730 43.017 0.713 19554 3121 1 7 . 1 1 120 120 PHE H H 120 8.820 8.820 7.540 1.280 19554 3122 1 7 . 1 1 121 121 THR N N 121 114.670 114.670 121.540 -6.870 19554 3123 1 7 . 1 1 121 121 THR HA H 121 5.000 5.000 4.934 0.066 19554 3124 1 7 . 1 1 121 121 THR C C 121 173.780 173.780 173.974 -0.194 19554 3125 1 7 . 1 1 121 121 THR CA C 121 60.500 60.500 61.977 -1.477 19554 3126 1 7 . 1 1 121 121 THR CB C 121 69.910 69.910 69.639 0.271 19554 3127 1 7 . 1 1 121 121 THR H H 121 8.670 8.670 8.739 -0.069 19554 3128 1 7 . 1 1 122 122 VAL N N 122 124.340 124.340 121.821 2.519 19554 3129 1 7 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.367 0.234 19554 3130 1 7 . 1 1 122 122 VAL C C 122 174.240 174.240 174.328 -0.088 19554 3131 1 7 . 1 1 122 122 VAL CA C 122 59.300 59.300 60.587 -1.287 19554 3132 1 7 . 1 1 122 122 VAL CB C 122 35.860 35.860 36.304 -0.444 19554 3133 1 7 . 1 1 122 122 VAL H H 122 8.560 8.560 8.132 0.428 19554 3134 1 7 . 1 1 123 123 GLU N N 123 126.950 126.950 125.270 1.680 19554 3135 1 7 . 1 1 123 123 GLU HA H 123 4.610 4.610 5.072 -0.462 19554 3136 1 7 . 1 1 123 123 GLU C C 123 175.840 175.840 176.223 -0.383 19554 3137 1 7 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.867 0.293 19554 3138 1 7 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.824 0.086 19554 3139 1 7 . 1 1 123 123 GLU H H 123 8.950 8.950 8.257 0.693 19554 3140 1 7 . 1 1 124 124 LEU N N 124 129.580 129.580 129.293 0.287 19554 3141 1 7 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.612 0.048 19554 3142 1 7 . 1 1 124 124 LEU C C 124 175.350 175.350 176.206 -0.856 19554 3143 1 7 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.652 -0.452 19554 3144 1 7 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.166 1.024 19554 3145 1 7 . 1 1 124 124 LEU H H 124 8.940 8.940 8.994 -0.054 19554 3146 1 7 . 1 1 125 125 ASN N N 125 121.880 121.880 119.028 2.852 19554 3147 1 7 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.453 -0.263 19554 3148 1 7 . 1 1 125 125 ASN C C 125 174.690 174.690 175.290 -0.600 19554 3149 1 7 . 1 1 125 125 ASN CA C 125 53.880 53.880 53.994 -0.114 19554 3150 1 7 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.264 -0.014 19554 3151 1 7 . 1 1 125 125 ASN H H 125 8.950 8.950 8.641 0.309 19554 3152 1 7 . 1 1 126 126 GLY N N 126 103.140 103.140 102.594 0.546 19554 3153 1 7 . 1 1 126 126 GLY C C 126 173.680 173.680 174.232 -0.552 19554 3154 1 7 . 1 1 126 126 GLY CA C 126 44.880 44.880 44.969 -0.089 19554 3155 1 7 . 1 1 126 126 GLY H H 126 8.070 8.070 8.230 -0.160 19554 3156 1 7 . 1 1 127 127 ILE N N 127 122.120 122.120 122.589 -0.469 19554 3157 1 7 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.993 -0.023 19554 3158 1 7 . 1 1 127 127 ILE C C 127 174.370 174.370 175.883 -1.513 19554 3159 1 7 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.158 -0.628 19554 3160 1 7 . 1 1 127 127 ILE CB C 127 38.970 38.970 37.969 1.001 19554 3161 1 7 . 1 1 127 127 ILE H H 127 7.380 7.380 7.412 -0.032 19554 3162 1 7 . 1 1 128 128 ARG N N 128 126.630 126.630 124.864 1.766 19554 3163 1 7 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.329 -0.689 19554 3164 1 7 . 1 1 128 128 ARG C C 128 174.720 174.720 175.352 -0.632 19554 3165 1 7 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.910 0.740 19554 3166 1 7 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.977 -0.977 19554 3167 1 7 . 1 1 128 128 ARG H H 128 8.170 8.170 8.462 -0.292 19554 3168 1 7 . 1 1 129 129 ALA N N 129 127.320 127.320 126.507 0.813 19554 3169 1 7 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.871 -0.021 19554 3170 1 7 . 1 1 129 129 ALA C C 129 174.970 174.970 175.642 -0.672 19554 3171 1 7 . 1 1 129 129 ALA CA C 129 49.660 49.660 50.035 -0.375 19554 3172 1 7 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.576 2.813 19554 3173 1 7 . 1 1 129 129 ALA H H 129 9.240 9.240 8.833 0.407 19554 3174 1 7 . 1 1 130 130 PHE N N 130 121.060 121.060 118.016 3.044 19554 3175 1 7 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.228 -0.068 19554 3176 1 7 . 1 1 130 130 PHE C C 130 172.430 172.430 173.514 -1.084 19554 3177 1 7 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.320 -2.320 19554 3178 1 7 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.874 -0.474 19554 3179 1 7 . 1 1 130 130 PHE H H 130 8.660 8.660 8.371 0.289 19554 3180 1 7 . 1 1 131 131 LEU N N 131 130.250 130.250 127.577 2.673 19554 3181 1 7 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.870 0.110 19554 3182 1 7 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.502 -1.832 19554 3183 1 7 . 1 1 131 131 LEU CB C 131 44.330 44.330 44.191 0.139 19554 3184 1 7 . 1 1 131 131 LEU H H 131 8.550 8.550 8.491 0.059 19554 3185 1 7 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.579 -0.579 19554 3186 1 7 . 1 1 132 132 PRO C C 132 179.380 179.380 178.249 1.131 19554 3187 1 7 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.710 -0.550 19554 3188 1 7 . 1 1 133 133 GLY N N 133 111.470 111.470 109.083 2.387 19554 3189 1 7 . 1 1 133 133 GLY C C 133 175.590 175.590 176.129 -0.539 19554 3190 1 7 . 1 1 133 133 GLY CA C 133 47.530 47.530 47.007 0.523 19554 3191 1 7 . 1 1 133 133 GLY H H 133 9.140 9.140 8.742 0.398 19554 3192 1 7 . 1 1 134 134 SER HA H 134 4.350 4.350 4.354 -0.004 19554 3193 1 7 . 1 1 134 134 SER C C 134 175.280 175.280 175.612 -0.332 19554 3194 1 7 . 1 1 134 134 SER CA C 134 59.210 59.210 60.478 -1.268 19554 3195 1 7 . 1 1 134 134 SER CB C 134 62.730 62.730 63.157 -0.427 19554 3196 1 7 . 1 1 135 135 LEU N N 135 118.770 118.770 121.144 -2.374 19554 3197 1 7 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.242 0.338 19554 3198 1 7 . 1 1 135 135 LEU C C 135 177.500 177.500 178.308 -0.808 19554 3199 1 7 . 1 1 135 135 LEU CA C 135 53.770 53.770 56.587 -2.817 19554 3200 1 7 . 1 1 135 135 LEU H H 135 8.030 8.030 7.526 0.504 19554 3201 1 7 . 1 1 136 136 VAL N N 136 123.080 123.080 118.234 4.846 19554 3202 1 7 . 1 1 136 136 VAL HA H 136 3.610 3.610 3.855 -0.245 19554 3203 1 7 . 1 1 136 136 VAL C C 136 173.150 173.150 176.126 -2.976 19554 3204 1 7 . 1 1 136 136 VAL CA C 136 65.220 65.220 64.402 0.818 19554 3205 1 7 . 1 1 136 136 VAL CB C 136 32.020 32.020 32.740 -0.720 19554 3206 1 7 . 1 1 136 136 VAL H H 136 7.550 7.550 7.475 0.075 19554 3207 1 7 . 1 1 137 137 ASP N N 137 117.300 117.300 115.534 1.766 19554 3208 1 7 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.731 -0.391 19554 3209 1 7 . 1 1 137 137 ASP C C 137 174.840 174.840 174.777 0.063 19554 3210 1 7 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.295 -1.225 19554 3211 1 7 . 1 1 137 137 ASP CB C 137 44.460 44.460 42.834 1.625 19554 3212 1 7 . 1 1 137 137 ASP H H 137 7.940 7.940 7.974 -0.035 19554 3213 1 7 . 1 1 138 138 VAL N N 138 116.750 116.750 117.186 -0.436 19554 3214 1 7 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.221 -0.081 19554 3215 1 7 . 1 1 138 138 VAL CA C 138 61.190 61.190 62.679 -1.490 19554 3216 1 7 . 1 1 138 138 VAL CB C 138 33.330 33.330 32.159 1.171 19554 3217 1 7 . 1 1 138 138 VAL H H 138 10.000 10.000 8.414 1.586 19554 3218 1 7 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.444 0.066 19554 3219 1 7 . 1 1 140 140 PRO C C 140 175.860 175.860 175.418 0.442 19554 3220 1 7 . 1 1 141 141 VAL N N 141 124.910 124.910 121.151 3.759 19554 3221 1 7 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.272 -0.372 19554 3222 1 7 . 1 1 141 141 VAL C C 141 175.120 175.120 176.332 -1.212 19554 3223 1 7 . 1 1 141 141 VAL CA C 141 62.720 62.720 60.676 2.044 19554 3224 1 7 . 1 1 141 141 VAL CB C 141 31.870 31.870 34.298 -2.428 19554 3225 1 7 . 1 1 141 141 VAL H H 141 8.110 8.110 8.218 -0.108 19554 3226 1 7 . 1 1 142 142 ARG N N 142 119.730 119.730 125.225 -5.495 19554 3227 1 7 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.294 0.326 19554 3228 1 7 . 1 1 142 142 ARG C C 142 173.520 173.520 175.465 -1.945 19554 3229 1 7 . 1 1 142 142 ARG CA C 142 53.020 53.020 57.487 -4.467 19554 3230 1 7 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.750 -0.271 19554 3231 1 7 . 1 1 142 142 ARG H H 142 7.440 7.440 8.496 -1.056 19554 3232 1 7 . 1 1 143 143 ASP N N 143 119.780 119.780 115.657 4.123 19554 3233 1 7 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.719 -0.049 19554 3234 1 7 . 1 1 143 143 ASP C C 143 175.970 175.970 174.428 1.542 19554 3235 1 7 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.366 -0.336 19554 3236 1 7 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.561 0.169 19554 3237 1 7 . 1 1 143 143 ASP H H 143 7.880 7.880 8.104 -0.224 19554 3238 1 7 . 1 1 144 144 THR N N 144 110.060 110.060 115.273 -5.213 19554 3239 1 7 . 1 1 144 144 THR HA H 144 4.110 4.110 4.620 -0.510 19554 3240 1 7 . 1 1 144 144 THR C C 144 175.730 175.730 174.944 0.786 19554 3241 1 7 . 1 1 144 144 THR CA C 144 61.520 61.520 60.895 0.625 19554 3242 1 7 . 1 1 144 144 THR CB C 144 68.610 68.610 70.818 -2.208 19554 3243 1 7 . 1 1 144 144 THR H H 144 8.030 8.030 8.223 -0.193 19554 3244 1 7 . 1 1 145 145 LEU N N 145 124.820 124.820 121.491 3.329 19554 3245 1 7 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.393 0.307 19554 3246 1 7 . 1 1 145 145 LEU C C 145 178.010 178.010 177.812 0.198 19554 3247 1 7 . 1 1 145 145 LEU CA C 145 57.350 57.350 55.866 1.484 19554 3248 1 7 . 1 1 145 145 LEU CB C 145 42.100 42.100 41.743 0.357 19554 3249 1 7 . 1 1 145 145 LEU H H 145 8.050 8.050 8.692 -0.642 19554 3250 1 7 . 1 1 146 146 HIS N N 146 116.310 116.310 116.266 0.044 19554 3251 1 7 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.338 0.202 19554 3252 1 7 . 1 1 146 146 HIS C C 146 175.000 175.000 174.849 0.151 19554 3253 1 7 . 1 1 146 146 HIS H H 146 8.120 8.120 8.538 -0.418 19554 3254 1 7 . 1 1 147 147 LEU N N 147 120.320 120.320 116.409 3.911 19554 3255 1 7 . 1 1 147 147 LEU HA H 147 4.070 4.070 4.360 -0.290 19554 3256 1 7 . 1 1 147 147 LEU C C 147 176.810 176.810 176.106 0.704 19554 3257 1 7 . 1 1 147 147 LEU CA C 147 54.710 54.710 53.179 1.531 19554 3258 1 7 . 1 1 147 147 LEU CB C 147 41.960 41.960 40.967 0.993 19554 3259 1 7 . 1 1 147 147 LEU H H 147 7.620 7.620 7.278 0.342 19554 3260 1 7 . 1 1 148 148 GLU N N 148 118.950 118.950 119.454 -0.504 19554 3261 1 7 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.558 -0.778 19554 3262 1 7 . 1 1 148 148 GLU C C 148 177.480 177.480 176.957 0.523 19554 3263 1 7 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.228 3.201 19554 3264 1 7 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.272 -1.592 19554 3265 1 7 . 1 1 148 148 GLU H H 148 7.760 7.760 7.641 0.119 19554 3266 1 7 . 1 1 149 149 GLY N N 149 111.070 111.070 113.395 -2.325 19554 3267 1 7 . 1 1 149 149 GLY C C 149 173.820 173.820 173.979 -0.159 19554 3268 1 7 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.842 -0.312 19554 3269 1 7 . 1 1 149 149 GLY H H 149 8.630 8.630 8.495 0.135 19554 3270 1 7 . 1 1 150 150 LYS N N 150 119.380 119.380 120.159 -0.779 19554 3271 1 7 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.107 0.223 19554 3272 1 7 . 1 1 150 150 LYS C C 150 175.110 175.110 175.781 -0.671 19554 3273 1 7 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.779 -1.609 19554 3274 1 7 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.127 0.423 19554 3275 1 7 . 1 1 150 150 LYS H H 150 7.520 7.520 7.968 -0.448 19554 3276 1 7 . 1 1 151 151 GLU N N 151 122.850 122.850 124.745 -1.895 19554 3277 1 7 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.536 -0.066 19554 3278 1 7 . 1 1 151 151 GLU C C 151 175.510 175.510 175.103 0.407 19554 3279 1 7 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.192 1.148 19554 3280 1 7 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.118 0.892 19554 3281 1 7 . 1 1 151 151 GLU H H 151 8.410 8.410 8.460 -0.050 19554 3282 1 7 . 1 1 152 152 LEU N N 152 127.520 127.520 125.343 2.177 19554 3283 1 7 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.658 -0.118 19554 3284 1 7 . 1 1 152 152 LEU C C 152 173.750 173.750 175.490 -1.740 19554 3285 1 7 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.299 -0.479 19554 3286 1 7 . 1 1 152 152 LEU H H 152 8.850 8.850 7.740 1.110 19554 3287 1 7 . 1 1 153 153 GLU N N 153 116.500 116.500 120.030 -3.530 19554 3288 1 7 . 1 1 153 153 GLU HA H 153 4.580 4.580 3.850 0.730 19554 3289 1 7 . 1 1 153 153 GLU C C 153 175.120 175.120 174.791 0.329 19554 3290 1 7 . 1 1 153 153 GLU CA C 153 55.160 55.160 55.441 -0.281 19554 3291 1 7 . 1 1 153 153 GLU H H 153 7.110 7.110 8.361 -1.251 19554 3292 1 7 . 1 1 154 154 PHE N N 154 115.150 115.150 117.368 -2.218 19554 3293 1 7 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.887 -0.027 19554 3294 1 7 . 1 1 154 154 PHE C C 154 175.630 175.630 174.846 0.784 19554 3295 1 7 . 1 1 154 154 PHE CA C 154 57.190 57.190 55.302 1.888 19554 3296 1 7 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.215 2.035 19554 3297 1 7 . 1 1 154 154 PHE H H 154 8.910 8.910 7.779 1.131 19554 3298 1 7 . 1 1 155 155 LYS N N 155 114.560 114.560 121.779 -7.219 19554 3299 1 7 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.645 0.065 19554 3300 1 7 . 1 1 155 155 LYS C C 155 176.500 176.500 175.211 1.289 19554 3301 1 7 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.545 -1.945 19554 3302 1 7 . 1 1 155 155 LYS CB C 155 33.960 33.960 34.313 -0.353 19554 3303 1 7 . 1 1 155 155 LYS H H 155 8.100 8.100 8.772 -0.672 19554 3304 1 7 . 1 1 156 156 VAL N N 156 124.530 124.530 126.229 -1.699 19554 3305 1 7 . 1 1 156 156 VAL C C 156 175.630 175.630 175.204 0.426 19554 3306 1 7 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.672 -0.983 19554 3307 1 7 . 1 1 156 156 VAL CB C 156 31.600 31.600 32.139 -0.539 19554 3308 1 7 . 1 1 156 156 VAL H H 156 9.920 9.920 8.186 1.734 19554 3309 1 7 . 1 1 157 157 ILE N N 157 119.590 119.590 126.714 -7.124 19554 3310 1 7 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.367 0.353 19554 3311 1 7 . 1 1 157 157 ILE C C 157 176.190 176.190 174.815 1.375 19554 3312 1 7 . 1 1 157 157 ILE CA C 157 61.050 61.050 60.382 0.668 19554 3313 1 7 . 1 1 157 157 ILE CB C 157 39.170 39.170 39.918 -0.748 19554 3314 1 7 . 1 1 157 157 ILE H H 157 8.530 8.530 8.776 -0.246 19554 3315 1 7 . 1 1 158 158 LYS N N 158 122.460 122.460 117.862 4.598 19554 3316 1 7 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.608 -0.408 19554 3317 1 7 . 1 1 158 158 LYS C C 158 173.000 173.000 174.230 -1.230 19554 3318 1 7 . 1 1 158 158 LYS CA C 158 56.800 56.800 55.894 0.906 19554 3319 1 7 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.633 1.008 19554 3320 1 7 . 1 1 158 158 LYS H H 158 7.600 7.600 7.984 -0.384 19554 3321 1 7 . 1 1 159 159 LEU N N 159 125.430 125.430 117.531 7.899 19554 3322 1 7 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.697 -0.077 19554 3323 1 7 . 1 1 159 159 LEU C C 159 174.390 174.390 174.711 -0.321 19554 3324 1 7 . 1 1 159 159 LEU CA C 159 54.510 54.510 54.368 0.141 19554 3325 1 7 . 1 1 159 159 LEU H H 159 7.950 7.950 8.227 -0.277 19554 3326 1 7 . 1 1 160 160 ASP N N 160 124.740 124.740 121.063 3.677 19554 3327 1 7 . 1 1 160 160 ASP HA H 160 4.670 4.670 5.026 -0.356 19554 3328 1 7 . 1 1 160 160 ASP C C 160 176.020 176.020 175.577 0.443 19554 3329 1 7 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.742 -1.121 19554 3330 1 7 . 1 1 160 160 ASP CB C 160 42.050 42.050 42.098 -0.048 19554 3331 1 7 . 1 1 160 160 ASP H H 160 8.760 8.760 8.337 0.423 19554 3332 1 7 . 1 1 161 161 GLN N N 161 126.490 126.490 125.784 0.706 19554 3333 1 7 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.177 -1.057 19554 3334 1 7 . 1 1 161 161 GLN C C 161 178.280 178.280 177.778 0.502 19554 3335 1 7 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.217 0.553 19554 3336 1 7 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.832 -0.992 19554 3337 1 7 . 1 1 161 161 GLN H H 161 9.110 9.110 8.649 0.461 19554 3338 1 7 . 1 1 162 162 LYS N N 162 119.150 119.150 121.602 -2.452 19554 3339 1 7 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.087 -0.287 19554 3340 1 7 . 1 1 162 162 LYS C C 162 177.900 177.900 177.469 0.431 19554 3341 1 7 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.647 0.053 19554 3342 1 7 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.217 -0.827 19554 3343 1 7 . 1 1 162 162 LYS H H 162 8.070 8.070 8.644 -0.574 19554 3344 1 7 . 1 1 163 163 ARG N N 163 114.850 114.850 115.907 -1.057 19554 3345 1 7 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.464 -0.314 19554 3346 1 7 . 1 1 163 163 ARG C C 163 174.750 174.750 175.909 -1.159 19554 3347 1 7 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.252 -0.452 19554 3348 1 7 . 1 1 163 163 ARG H H 163 7.010 7.010 7.879 -0.869 19554 3349 1 7 . 1 1 164 164 ASN N N 164 117.810 117.810 119.212 -1.402 19554 3350 1 7 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.525 -0.395 19554 3351 1 7 . 1 1 164 164 ASN C C 164 173.880 173.880 174.087 -0.207 19554 3352 1 7 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.743 -0.784 19554 3353 1 7 . 1 1 164 164 ASN CB C 164 37.530 37.530 38.077 -0.547 19554 3354 1 7 . 1 1 164 164 ASN H H 164 7.750 7.750 8.232 -0.482 19554 3355 1 7 . 1 1 165 165 ASN N N 165 116.170 116.170 117.606 -1.436 19554 3356 1 7 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.982 0.078 19554 3357 1 7 . 1 1 165 165 ASN C C 165 172.990 172.990 172.947 0.043 19554 3358 1 7 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.554 -0.114 19554 3359 1 7 . 1 1 165 165 ASN CB C 165 41.820 41.820 42.030 -0.210 19554 3360 1 7 . 1 1 165 165 ASN H H 165 8.020 8.020 8.390 -0.370 19554 3361 1 7 . 1 1 166 166 VAL N N 166 124.790 124.790 120.952 3.838 19554 3362 1 7 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.283 0.217 19554 3363 1 7 . 1 1 166 166 VAL C C 166 174.190 174.190 174.038 0.152 19554 3364 1 7 . 1 1 166 166 VAL CA C 166 61.030 61.030 61.479 -0.449 19554 3365 1 7 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.435 0.185 19554 3366 1 7 . 1 1 166 166 VAL H H 166 8.380 8.380 8.486 -0.106 19554 3367 1 7 . 1 1 167 167 VAL N N 167 128.000 128.000 122.204 5.796 19554 3368 1 7 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.681 0.569 19554 3369 1 7 . 1 1 167 167 VAL C C 167 176.000 176.000 174.194 1.806 19554 3370 1 7 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.521 1.089 19554 3371 1 7 . 1 1 167 167 VAL CB C 167 33.900 33.900 35.084 -1.183 19554 3372 1 7 . 1 1 167 167 VAL H H 167 8.710 8.710 8.247 0.463 19554 3373 1 7 . 1 1 168 168 VAL N N 168 118.360 118.360 115.234 3.126 19554 3374 1 7 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.516 0.724 19554 3375 1 7 . 1 1 168 168 VAL C C 168 172.800 172.800 175.685 -2.885 19554 3376 1 7 . 1 1 168 168 VAL CA C 168 57.860 57.860 60.103 -2.243 19554 3377 1 7 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.781 1.569 19554 3378 1 7 . 1 1 168 168 VAL H H 168 8.560 8.560 7.753 0.807 19554 3379 1 7 . 1 1 169 169 SER N N 169 106.720 106.720 119.414 -12.694 19554 3380 1 7 . 1 1 169 169 SER HA H 169 4.480 4.480 4.431 0.049 19554 3381 1 7 . 1 1 169 169 SER C C 169 175.950 175.950 174.900 1.050 19554 3382 1 7 . 1 1 169 169 SER CA C 169 55.550 55.550 57.864 -2.313 19554 3383 1 7 . 1 1 169 169 SER CB C 169 64.980 64.980 64.671 0.309 19554 3384 1 7 . 1 1 169 169 SER H H 169 8.600 8.600 8.413 0.187 19554 3385 1 7 . 1 1 170 170 ARG N N 170 129.620 129.620 122.043 7.577 19554 3386 1 7 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.209 0.501 19554 3387 1 7 . 1 1 170 170 ARG C C 170 177.870 177.870 178.942 -1.072 19554 3388 1 7 . 1 1 170 170 ARG CA C 170 57.150 57.150 58.650 -1.500 19554 3389 1 7 . 1 1 170 170 ARG H H 170 7.610 7.610 8.907 -1.297 19554 3390 1 7 . 1 1 171 171 ARG N N 171 122.230 122.230 120.554 1.676 19554 3391 1 7 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.063 -0.593 19554 3392 1 7 . 1 1 171 171 ARG C C 171 175.760 175.760 178.213 -2.453 19554 3393 1 7 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.729 0.701 19554 3394 1 7 . 1 1 171 171 ARG CB C 171 30.410 30.410 29.531 0.879 19554 3395 1 7 . 1 1 171 171 ARG H H 171 8.260 8.260 8.539 -0.279 19554 3396 1 7 . 1 1 172 172 ALA N N 172 116.490 116.490 122.879 -6.389 19554 3397 1 7 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.192 -0.142 19554 3398 1 7 . 1 1 172 172 ALA C C 172 179.480 179.480 179.381 0.099 19554 3399 1 7 . 1 1 172 172 ALA CA C 172 54.010 54.010 54.423 -0.413 19554 3400 1 7 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.016 0.874 19554 3401 1 7 . 1 1 172 172 ALA H H 172 7.760 7.760 7.837 -0.077 19554 3402 1 7 . 1 1 173 173 VAL N N 173 116.440 116.440 119.789 -3.349 19554 3403 1 7 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.697 -0.227 19554 3404 1 7 . 1 1 173 173 VAL C C 173 177.680 177.680 176.812 0.868 19554 3405 1 7 . 1 1 173 173 VAL CA C 173 65.080 65.080 65.820 -0.740 19554 3406 1 7 . 1 1 173 173 VAL CB C 173 31.880 31.880 32.087 -0.207 19554 3407 1 7 . 1 1 173 173 VAL H H 173 7.210 7.210 7.751 -0.541 19554 3408 1 7 . 1 1 174 174 ILE N N 174 119.790 119.790 114.345 5.445 19554 3409 1 7 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.816 -0.136 19554 3410 1 7 . 1 1 174 174 ILE C C 174 178.310 178.310 177.566 0.744 19554 3411 1 7 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.201 -0.431 19554 3412 1 7 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.466 0.984 19554 3413 1 7 . 1 1 174 174 ILE H H 174 7.160 7.160 7.525 -0.365 19554 3414 1 7 . 1 1 175 175 GLU N N 175 117.810 117.810 118.628 -0.818 19554 3415 1 7 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.342 -0.312 19554 3416 1 7 . 1 1 175 175 GLU C C 175 177.170 177.170 177.499 -0.329 19554 3417 1 7 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.019 -0.829 19554 3418 1 7 . 1 1 175 175 GLU CB C 175 29.640 29.640 30.243 -0.603 19554 3419 1 7 . 1 1 175 175 GLU H H 175 8.250 8.250 8.220 0.030 19554 3420 1 7 . 1 1 176 176 SER N N 176 114.300 114.300 113.314 0.986 19554 3421 1 7 . 1 1 176 176 SER HA H 176 4.320 4.320 4.444 -0.124 19554 3422 1 7 . 1 1 176 176 SER C C 176 174.930 174.930 175.592 -0.662 19554 3423 1 7 . 1 1 176 176 SER CA C 176 59.060 59.060 57.804 1.256 19554 3424 1 7 . 1 1 176 176 SER CB C 176 63.640 63.640 62.821 0.819 19554 3425 1 7 . 1 1 176 176 SER H H 176 7.460 7.460 7.451 0.009 19554 3426 1 7 . 1 1 177 177 GLU N N 177 121.860 121.860 120.601 1.259 19554 3427 1 7 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.035 0.135 19554 3428 1 7 . 1 1 177 177 GLU C C 177 176.340 176.340 177.346 -1.006 19554 3429 1 7 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.718 -2.078 19554 3430 1 7 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.393 0.357 19554 3431 1 7 . 1 1 177 177 GLU H H 177 7.890 7.890 7.991 -0.101 19554 3432 1 7 . 1 1 178 178 ASN N N 178 119.030 119.030 116.590 2.440 19554 3433 1 7 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.871 -0.171 19554 3434 1 7 . 1 1 178 178 ASN C C 178 174.230 174.230 175.709 -1.479 19554 3435 1 7 . 1 1 178 178 ASN CA C 178 53.010 53.010 53.269 -0.259 19554 3436 1 7 . 1 1 178 178 ASN CB C 178 39.080 39.080 39.951 -0.871 19554 3437 1 7 . 1 1 178 178 ASN H H 178 8.110 8.110 8.358 -0.248 19554 3438 1 8 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.202 -0.042 19554 3439 1 8 . 1 1 89 89 ALA C C 89 179.720 179.720 179.197 0.523 19554 3440 1 8 . 1 1 89 89 ALA CA C 89 54.490 54.490 53.934 0.556 19554 3441 1 8 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.855 -0.635 19554 3442 1 8 . 1 1 90 90 LYS N N 90 119.500 119.500 119.078 0.422 19554 3443 1 8 . 1 1 90 90 LYS C C 90 179.090 179.090 178.621 0.469 19554 3444 1 8 . 1 1 90 90 LYS H H 90 7.980 7.980 8.251 -0.271 19554 3445 1 8 . 1 1 91 91 ARG N N 91 120.510 120.510 118.359 2.151 19554 3446 1 8 . 1 1 91 91 ARG HA H 91 4.150 4.150 3.900 0.250 19554 3447 1 8 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.879 0.421 19554 3448 1 8 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.483 0.537 19554 3449 1 8 . 1 1 91 91 ARG H H 91 8.010 8.010 7.759 0.251 19554 3450 1 8 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.644 1.476 19554 3451 1 8 . 1 1 92 92 HIS C C 92 177.360 177.360 176.505 0.855 19554 3452 1 8 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.509 0.361 19554 3453 1 8 . 1 1 93 93 GLU N N 93 118.470 118.470 116.885 1.585 19554 3454 1 8 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.214 -0.314 19554 3455 1 8 . 1 1 93 93 GLU C C 93 178.740 178.740 178.095 0.645 19554 3456 1 8 . 1 1 93 93 GLU CA C 93 59.160 59.160 58.024 1.136 19554 3457 1 8 . 1 1 93 93 GLU CB C 93 28.960 28.960 30.042 -1.082 19554 3458 1 8 . 1 1 93 93 GLU H H 93 8.190 8.190 7.564 0.626 19554 3459 1 8 . 1 1 94 94 ALA N N 94 123.080 123.080 123.470 -0.390 19554 3460 1 8 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.235 -0.165 19554 3461 1 8 . 1 1 94 94 ALA C C 94 180.330 180.330 179.756 0.574 19554 3462 1 8 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.568 0.372 19554 3463 1 8 . 1 1 94 94 ALA CB C 94 18.250 18.250 18.069 0.181 19554 3464 1 8 . 1 1 94 94 ALA H H 94 8.090 8.090 7.275 0.815 19554 3465 1 8 . 1 1 95 95 TRP N N 95 119.190 119.190 118.744 0.446 19554 3466 1 8 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.517 -0.477 19554 3467 1 8 . 1 1 95 95 TRP C C 95 178.590 178.590 177.981 0.609 19554 3468 1 8 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.373 2.627 19554 3469 1 8 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.567 1.593 19554 3470 1 8 . 1 1 95 95 TRP H H 95 8.060 8.060 8.205 -0.145 19554 3471 1 8 . 1 1 96 96 ILE N N 96 119.570 119.570 119.613 -0.043 19554 3472 1 8 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.660 0.150 19554 3473 1 8 . 1 1 96 96 ILE C C 96 179.300 179.300 177.396 1.904 19554 3474 1 8 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.902 -0.362 19554 3475 1 8 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.486 -0.356 19554 3476 1 8 . 1 1 96 96 ILE H H 96 7.850 7.850 7.403 0.447 19554 3477 1 8 . 1 1 97 97 THR N N 97 117.030 117.030 114.306 2.724 19554 3478 1 8 . 1 1 97 97 THR HA H 97 3.830 3.830 4.040 -0.210 19554 3479 1 8 . 1 1 97 97 THR C C 97 177.080 177.080 176.330 0.750 19554 3480 1 8 . 1 1 97 97 THR CA C 97 66.430 66.430 66.232 0.198 19554 3481 1 8 . 1 1 97 97 THR CB C 97 68.450 68.450 68.785 -0.335 19554 3482 1 8 . 1 1 97 97 THR H H 97 7.900 7.900 7.982 -0.082 19554 3483 1 8 . 1 1 98 98 LEU N N 98 123.110 123.110 119.492 3.618 19554 3484 1 8 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.279 -0.349 19554 3485 1 8 . 1 1 98 98 LEU C C 98 178.160 178.160 178.336 -0.176 19554 3486 1 8 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.351 0.379 19554 3487 1 8 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.355 0.185 19554 3488 1 8 . 1 1 98 98 LEU H H 98 7.830 7.830 7.478 0.352 19554 3489 1 8 . 1 1 99 99 GLU N N 99 120.520 120.520 120.810 -0.290 19554 3490 1 8 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.251 -0.371 19554 3491 1 8 . 1 1 99 99 GLU C C 99 179.010 179.010 179.451 -0.441 19554 3492 1 8 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.615 0.305 19554 3493 1 8 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.699 -0.349 19554 3494 1 8 . 1 1 99 99 GLU H H 99 8.560 8.560 8.191 0.369 19554 3495 1 8 . 1 1 100 100 LYS N N 100 119.950 119.950 117.881 2.069 19554 3496 1 8 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.112 -0.082 19554 3497 1 8 . 1 1 100 100 LYS C C 100 177.870 177.870 178.623 -0.753 19554 3498 1 8 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.437 0.133 19554 3499 1 8 . 1 1 100 100 LYS CB C 100 31.720 31.720 31.749 -0.029 19554 3500 1 8 . 1 1 100 100 LYS H H 100 7.800 7.800 7.629 0.171 19554 3501 1 8 . 1 1 101 101 ALA N N 101 120.690 120.690 121.562 -0.872 19554 3502 1 8 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.025 -0.005 19554 3503 1 8 . 1 1 101 101 ALA C C 101 180.990 180.990 179.978 1.012 19554 3504 1 8 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.783 0.337 19554 3505 1 8 . 1 1 101 101 ALA CB C 101 17.580 17.580 17.884 -0.304 19554 3506 1 8 . 1 1 101 101 ALA H H 101 7.800 7.800 7.648 0.152 19554 3507 1 8 . 1 1 102 102 TYR N N 102 118.440 118.440 117.660 0.780 19554 3508 1 8 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.191 0.129 19554 3509 1 8 . 1 1 102 102 TYR C C 102 178.590 178.590 178.711 -0.121 19554 3510 1 8 . 1 1 102 102 TYR CA C 102 59.810 59.810 61.483 -1.673 19554 3511 1 8 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.655 1.035 19554 3512 1 8 . 1 1 102 102 TYR H H 102 8.580 8.580 7.725 0.855 19554 3513 1 8 . 1 1 103 103 GLU N N 103 120.860 120.860 119.373 1.487 19554 3514 1 8 . 1 1 103 103 GLU HA H 103 3.590 3.590 4.137 -0.547 19554 3515 1 8 . 1 1 103 103 GLU C C 103 178.100 178.100 177.016 1.084 19554 3516 1 8 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.788 0.293 19554 3517 1 8 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.556 -0.136 19554 3518 1 8 . 1 1 103 103 GLU H H 103 8.290 8.290 7.896 0.394 19554 3519 1 8 . 1 1 104 104 ASP N N 104 116.120 116.120 117.153 -1.033 19554 3520 1 8 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.770 -0.160 19554 3521 1 8 . 1 1 104 104 ASP C C 104 174.970 174.970 174.864 0.106 19554 3522 1 8 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.444 0.676 19554 3523 1 8 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.461 0.019 19554 3524 1 8 . 1 1 104 104 ASP H H 104 8.120 8.120 7.707 0.413 19554 3525 1 8 . 1 1 105 105 ALA N N 105 123.330 123.330 121.180 2.150 19554 3526 1 8 . 1 1 105 105 ALA HA H 105 4.150 4.150 3.999 0.151 19554 3527 1 8 . 1 1 105 105 ALA C C 105 177.130 177.130 176.599 0.531 19554 3528 1 8 . 1 1 105 105 ALA CA C 105 52.640 52.640 53.099 -0.459 19554 3529 1 8 . 1 1 105 105 ALA CB C 105 16.300 16.300 17.037 -0.737 19554 3530 1 8 . 1 1 105 105 ALA H H 105 7.710 7.710 7.687 0.023 19554 3531 1 8 . 1 1 106 106 GLU N N 106 118.950 118.950 119.145 -0.195 19554 3532 1 8 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.555 -0.255 19554 3533 1 8 . 1 1 106 106 GLU C C 106 176.730 176.730 176.121 0.609 19554 3534 1 8 . 1 1 106 106 GLU CA C 106 55.440 55.440 54.465 0.975 19554 3535 1 8 . 1 1 106 106 GLU CB C 106 31.760 31.760 32.502 -0.742 19554 3536 1 8 . 1 1 106 106 GLU H H 106 8.440 8.440 8.150 0.290 19554 3537 1 8 . 1 1 107 107 THR N N 107 118.780 118.780 113.497 5.283 19554 3538 1 8 . 1 1 107 107 THR HA H 107 4.550 4.550 4.535 0.015 19554 3539 1 8 . 1 1 107 107 THR C C 107 174.250 174.250 173.417 0.833 19554 3540 1 8 . 1 1 107 107 THR CA C 107 62.360 62.360 59.852 2.508 19554 3541 1 8 . 1 1 107 107 THR CB C 107 69.390 69.390 69.771 -0.381 19554 3542 1 8 . 1 1 107 107 THR H H 107 8.740 8.740 8.071 0.669 19554 3543 1 8 . 1 1 108 108 VAL N N 108 120.540 120.540 119.130 1.410 19554 3544 1 8 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.553 0.077 19554 3545 1 8 . 1 1 108 108 VAL C C 108 174.440 174.440 173.557 0.883 19554 3546 1 8 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.411 -0.411 19554 3547 1 8 . 1 1 108 108 VAL CB C 108 34.650 34.650 33.870 0.780 19554 3548 1 8 . 1 1 108 108 VAL H H 108 9.040 9.040 8.158 0.882 19554 3549 1 8 . 1 1 109 109 THR N N 109 115.100 115.100 115.470 -0.370 19554 3550 1 8 . 1 1 109 109 THR HA H 109 5.380 5.380 4.611 0.769 19554 3551 1 8 . 1 1 109 109 THR C C 109 174.580 174.580 173.358 1.222 19554 3552 1 8 . 1 1 109 109 THR CA C 109 60.410 60.410 62.143 -1.733 19554 3553 1 8 . 1 1 109 109 THR CB C 109 70.610 70.610 69.853 0.757 19554 3554 1 8 . 1 1 109 109 THR H H 109 8.170 8.170 8.195 -0.025 19554 3555 1 8 . 1 1 110 110 GLY N N 110 108.580 108.580 114.249 -5.669 19554 3556 1 8 . 1 1 110 110 GLY C C 110 170.810 170.810 171.495 -0.685 19554 3557 1 8 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.375 0.005 19554 3558 1 8 . 1 1 110 110 GLY H H 110 8.780 8.780 8.096 0.684 19554 3559 1 8 . 1 1 111 111 VAL N N 111 116.930 116.930 120.970 -4.040 19554 3560 1 8 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.738 0.042 19554 3561 1 8 . 1 1 111 111 VAL C C 111 176.060 176.060 174.717 1.343 19554 3562 1 8 . 1 1 111 111 VAL CA C 111 59.770 59.770 58.657 1.113 19554 3563 1 8 . 1 1 111 111 VAL CB C 111 35.750 35.750 35.220 0.530 19554 3564 1 8 . 1 1 111 111 VAL H H 111 7.810 7.810 7.962 -0.152 19554 3565 1 8 . 1 1 112 112 ILE N N 112 127.060 127.060 129.552 -2.492 19554 3566 1 8 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.368 -0.138 19554 3567 1 8 . 1 1 112 112 ILE C C 112 176.180 176.180 175.731 0.449 19554 3568 1 8 . 1 1 112 112 ILE CA C 112 62.220 62.220 62.262 -0.042 19554 3569 1 8 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.139 1.341 19554 3570 1 8 . 1 1 112 112 ILE H H 112 9.240 9.240 8.141 1.099 19554 3571 1 8 . 1 1 113 113 ASN N N 113 127.510 127.510 126.281 1.229 19554 3572 1 8 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.743 0.197 19554 3573 1 8 . 1 1 113 113 ASN C C 113 175.020 175.020 175.444 -0.424 19554 3574 1 8 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.441 -1.151 19554 3575 1 8 . 1 1 113 113 ASN CB C 113 39.580 39.580 39.946 -0.366 19554 3576 1 8 . 1 1 113 113 ASN H H 113 9.010 9.010 8.307 0.703 19554 3577 1 8 . 1 1 114 114 GLY N N 114 107.150 107.150 108.030 -0.880 19554 3578 1 8 . 1 1 114 114 GLY C C 114 171.360 171.360 171.941 -0.581 19554 3579 1 8 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.690 0.830 19554 3580 1 8 . 1 1 114 114 GLY H H 114 7.620 7.620 7.492 0.128 19554 3581 1 8 . 1 1 115 115 LYS N N 115 121.670 121.670 121.947 -0.277 19554 3582 1 8 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.367 0.223 19554 3583 1 8 . 1 1 115 115 LYS C C 115 175.950 175.950 174.978 0.972 19554 3584 1 8 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.889 1.051 19554 3585 1 8 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.707 -0.667 19554 3586 1 8 . 1 1 115 115 LYS H H 115 8.550 8.550 8.247 0.303 19554 3587 1 8 . 1 1 116 116 VAL N N 116 118.750 118.750 117.312 1.438 19554 3588 1 8 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.394 0.076 19554 3589 1 8 . 1 1 116 116 VAL C C 116 175.110 175.110 175.164 -0.054 19554 3590 1 8 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.198 -0.168 19554 3591 1 8 . 1 1 116 116 VAL CB C 116 35.500 35.500 33.758 1.742 19554 3592 1 8 . 1 1 116 116 VAL H H 116 8.070 8.070 7.864 0.206 19554 3593 1 8 . 1 1 117 117 LYS N N 117 122.520 122.520 122.286 0.234 19554 3594 1 8 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.054 -0.124 19554 3595 1 8 . 1 1 117 117 LYS C C 117 177.970 177.970 176.763 1.207 19554 3596 1 8 . 1 1 117 117 LYS CA C 117 58.670 58.670 56.904 1.766 19554 3597 1 8 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.171 -0.231 19554 3598 1 8 . 1 1 117 117 LYS H H 117 8.250 8.250 8.386 -0.136 19554 3599 1 8 . 1 1 118 118 GLY N N 118 113.440 113.440 111.743 1.697 19554 3600 1 8 . 1 1 118 118 GLY C C 118 175.540 175.540 174.248 1.292 19554 3601 1 8 . 1 1 118 118 GLY CA C 118 45.200 45.200 44.889 0.311 19554 3602 1 8 . 1 1 118 118 GLY H H 118 8.820 8.820 8.154 0.666 19554 3603 1 8 . 1 1 119 119 GLY N N 119 109.130 109.130 106.375 2.755 19554 3604 1 8 . 1 1 119 119 GLY C C 119 170.530 170.530 172.119 -1.589 19554 3605 1 8 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.329 3.511 19554 3606 1 8 . 1 1 119 119 GLY H H 119 7.930 7.930 7.515 0.415 19554 3607 1 8 . 1 1 120 120 PHE N N 120 123.370 123.370 117.472 5.898 19554 3608 1 8 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.541 0.729 19554 3609 1 8 . 1 1 120 120 PHE C C 120 174.260 174.260 174.313 -0.053 19554 3610 1 8 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.077 -0.737 19554 3611 1 8 . 1 1 120 120 PHE CB C 120 43.730 43.730 42.866 0.864 19554 3612 1 8 . 1 1 120 120 PHE H H 120 8.820 8.820 7.559 1.261 19554 3613 1 8 . 1 1 121 121 THR N N 121 114.670 114.670 120.918 -6.248 19554 3614 1 8 . 1 1 121 121 THR HA H 121 5.000 5.000 4.824 0.176 19554 3615 1 8 . 1 1 121 121 THR C C 121 173.780 173.780 173.853 -0.073 19554 3616 1 8 . 1 1 121 121 THR CA C 121 60.500 60.500 61.391 -0.891 19554 3617 1 8 . 1 1 121 121 THR CB C 121 69.910 69.910 69.658 0.252 19554 3618 1 8 . 1 1 121 121 THR H H 121 8.670 8.670 8.733 -0.063 19554 3619 1 8 . 1 1 122 122 VAL N N 122 124.340 124.340 121.764 2.576 19554 3620 1 8 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.454 0.146 19554 3621 1 8 . 1 1 122 122 VAL C C 122 174.240 174.240 174.378 -0.138 19554 3622 1 8 . 1 1 122 122 VAL CA C 122 59.300 59.300 60.101 -0.801 19554 3623 1 8 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.164 0.696 19554 3624 1 8 . 1 1 122 122 VAL H H 122 8.560 8.560 8.023 0.537 19554 3625 1 8 . 1 1 123 123 GLU N N 123 126.950 126.950 127.408 -0.458 19554 3626 1 8 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.736 -0.126 19554 3627 1 8 . 1 1 123 123 GLU C C 123 175.840 175.840 176.006 -0.166 19554 3628 1 8 . 1 1 123 123 GLU CA C 123 55.160 55.160 55.439 -0.279 19554 3629 1 8 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.098 0.812 19554 3630 1 8 . 1 1 123 123 GLU H H 123 8.950 8.950 8.504 0.446 19554 3631 1 8 . 1 1 124 124 LEU N N 124 129.580 129.580 129.951 -0.371 19554 3632 1 8 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.557 0.103 19554 3633 1 8 . 1 1 124 124 LEU C C 124 175.350 175.350 176.228 -0.878 19554 3634 1 8 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.587 -0.388 19554 3635 1 8 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.291 0.899 19554 3636 1 8 . 1 1 124 124 LEU H H 124 8.940 8.940 8.935 0.005 19554 3637 1 8 . 1 1 125 125 ASN N N 125 121.880 121.880 119.683 2.197 19554 3638 1 8 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.420 -0.230 19554 3639 1 8 . 1 1 125 125 ASN C C 125 174.690 174.690 175.419 -0.729 19554 3640 1 8 . 1 1 125 125 ASN CA C 125 53.880 53.880 53.983 -0.103 19554 3641 1 8 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.239 0.011 19554 3642 1 8 . 1 1 125 125 ASN H H 125 8.950 8.950 8.577 0.373 19554 3643 1 8 . 1 1 126 126 GLY N N 126 103.140 103.140 101.811 1.329 19554 3644 1 8 . 1 1 126 126 GLY C C 126 173.680 173.680 174.400 -0.720 19554 3645 1 8 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.093 -0.213 19554 3646 1 8 . 1 1 126 126 GLY H H 126 8.070 8.070 8.332 -0.262 19554 3647 1 8 . 1 1 127 127 ILE N N 127 122.120 122.120 121.978 0.142 19554 3648 1 8 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.485 0.485 19554 3649 1 8 . 1 1 127 127 ILE C C 127 174.370 174.370 175.101 -0.731 19554 3650 1 8 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.922 -1.392 19554 3651 1 8 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.466 0.504 19554 3652 1 8 . 1 1 127 127 ILE H H 127 7.380 7.380 7.475 -0.095 19554 3653 1 8 . 1 1 128 128 ARG N N 128 126.630 126.630 127.754 -1.124 19554 3654 1 8 . 1 1 128 128 ARG HA H 128 4.640 4.640 4.679 -0.039 19554 3655 1 8 . 1 1 128 128 ARG C C 128 174.720 174.720 174.976 -0.256 19554 3656 1 8 . 1 1 128 128 ARG CA C 128 55.650 55.650 55.324 0.326 19554 3657 1 8 . 1 1 128 128 ARG CB C 128 31.000 31.000 30.685 0.315 19554 3658 1 8 . 1 1 128 128 ARG H H 128 8.170 8.170 8.386 -0.216 19554 3659 1 8 . 1 1 129 129 ALA N N 129 127.320 127.320 128.605 -1.285 19554 3660 1 8 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.446 0.404 19554 3661 1 8 . 1 1 129 129 ALA C C 129 174.970 174.970 175.558 -0.588 19554 3662 1 8 . 1 1 129 129 ALA CA C 129 49.660 49.660 50.459 -0.799 19554 3663 1 8 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.272 3.118 19554 3664 1 8 . 1 1 129 129 ALA H H 129 9.240 9.240 8.626 0.614 19554 3665 1 8 . 1 1 130 130 PHE N N 130 121.060 121.060 117.887 3.173 19554 3666 1 8 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.141 0.019 19554 3667 1 8 . 1 1 130 130 PHE C C 130 172.430 172.430 173.492 -1.062 19554 3668 1 8 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.602 -2.602 19554 3669 1 8 . 1 1 130 130 PHE CB C 130 42.400 42.400 43.071 -0.671 19554 3670 1 8 . 1 1 130 130 PHE H H 130 8.660 8.660 8.305 0.355 19554 3671 1 8 . 1 1 131 131 LEU N N 131 130.250 130.250 126.427 3.823 19554 3672 1 8 . 1 1 131 131 LEU HA H 131 4.980 4.980 5.426 -0.446 19554 3673 1 8 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.370 -1.700 19554 3674 1 8 . 1 1 131 131 LEU CB C 131 44.330 44.330 45.068 -0.738 19554 3675 1 8 . 1 1 131 131 LEU H H 131 8.550 8.550 8.398 0.152 19554 3676 1 8 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.592 -0.592 19554 3677 1 8 . 1 1 132 132 PRO C C 132 179.380 179.380 177.938 1.442 19554 3678 1 8 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.777 -0.617 19554 3679 1 8 . 1 1 133 133 GLY N N 133 111.470 111.470 111.093 0.377 19554 3680 1 8 . 1 1 133 133 GLY C C 133 175.590 175.590 176.799 -1.209 19554 3681 1 8 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.666 0.864 19554 3682 1 8 . 1 1 133 133 GLY H H 133 9.140 9.140 8.453 0.687 19554 3683 1 8 . 1 1 134 134 SER HA H 134 4.350 4.350 4.285 0.065 19554 3684 1 8 . 1 1 134 134 SER C C 134 175.280 175.280 174.976 0.304 19554 3685 1 8 . 1 1 134 134 SER CA C 134 59.210 59.210 60.338 -1.128 19554 3686 1 8 . 1 1 134 134 SER CB C 134 62.730 62.730 63.219 -0.489 19554 3687 1 8 . 1 1 135 135 LEU N N 135 118.770 118.770 119.553 -0.783 19554 3688 1 8 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.670 -0.090 19554 3689 1 8 . 1 1 135 135 LEU C C 135 177.500 177.500 175.877 1.623 19554 3690 1 8 . 1 1 135 135 LEU CA C 135 53.770 53.770 54.393 -0.623 19554 3691 1 8 . 1 1 135 135 LEU H H 135 8.030 8.030 7.503 0.527 19554 3692 1 8 . 1 1 136 136 VAL N N 136 123.080 123.080 117.205 5.875 19554 3693 1 8 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.085 -0.475 19554 3694 1 8 . 1 1 136 136 VAL C C 136 173.150 173.150 175.691 -2.541 19554 3695 1 8 . 1 1 136 136 VAL CA C 136 65.220 65.220 63.692 1.528 19554 3696 1 8 . 1 1 136 136 VAL CB C 136 32.020 32.020 33.748 -1.728 19554 3697 1 8 . 1 1 136 136 VAL H H 136 7.550 7.550 7.777 -0.227 19554 3698 1 8 . 1 1 137 137 ASP N N 137 117.300 117.300 121.543 -4.243 19554 3699 1 8 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.860 -0.520 19554 3700 1 8 . 1 1 137 137 ASP C C 137 174.840 174.840 175.514 -0.674 19554 3701 1 8 . 1 1 137 137 ASP CA C 137 52.070 52.070 54.047 -1.977 19554 3702 1 8 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.200 3.260 19554 3703 1 8 . 1 1 137 137 ASP H H 137 7.940 7.940 7.823 0.117 19554 3704 1 8 . 1 1 138 138 VAL N N 138 116.750 116.750 119.515 -2.765 19554 3705 1 8 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.330 -0.190 19554 3706 1 8 . 1 1 138 138 VAL CA C 138 61.190 61.190 61.420 -0.230 19554 3707 1 8 . 1 1 138 138 VAL CB C 138 33.330 33.330 33.492 -0.162 19554 3708 1 8 . 1 1 138 138 VAL H H 138 10.000 10.000 8.217 1.783 19554 3709 1 8 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.490 0.020 19554 3710 1 8 . 1 1 140 140 PRO C C 140 175.860 175.860 176.132 -0.272 19554 3711 1 8 . 1 1 141 141 VAL N N 141 124.910 124.910 117.067 7.843 19554 3712 1 8 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.373 -0.473 19554 3713 1 8 . 1 1 141 141 VAL C C 141 175.120 175.120 175.514 -0.394 19554 3714 1 8 . 1 1 141 141 VAL CA C 141 62.720 62.720 61.451 1.269 19554 3715 1 8 . 1 1 141 141 VAL CB C 141 31.870 31.870 32.624 -0.754 19554 3716 1 8 . 1 1 141 141 VAL H H 141 8.110 8.110 8.059 0.051 19554 3717 1 8 . 1 1 142 142 ARG N N 142 119.730 119.730 120.904 -1.174 19554 3718 1 8 . 1 1 142 142 ARG HA H 142 4.620 4.620 3.961 0.659 19554 3719 1 8 . 1 1 142 142 ARG C C 142 173.520 173.520 174.857 -1.337 19554 3720 1 8 . 1 1 142 142 ARG CA C 142 53.020 53.020 57.199 -4.179 19554 3721 1 8 . 1 1 142 142 ARG CB C 142 30.480 30.480 28.985 1.495 19554 3722 1 8 . 1 1 142 142 ARG H H 142 7.440 7.440 8.511 -1.071 19554 3723 1 8 . 1 1 143 143 ASP N N 143 119.780 119.780 119.558 0.222 19554 3724 1 8 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.806 -0.136 19554 3725 1 8 . 1 1 143 143 ASP C C 143 175.970 175.970 175.795 0.175 19554 3726 1 8 . 1 1 143 143 ASP CA C 143 54.030 54.030 53.608 0.422 19554 3727 1 8 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.819 -0.089 19554 3728 1 8 . 1 1 143 143 ASP H H 143 7.880 7.880 8.149 -0.269 19554 3729 1 8 . 1 1 144 144 THR N N 144 110.060 110.060 115.243 -5.183 19554 3730 1 8 . 1 1 144 144 THR HA H 144 4.110 4.110 4.718 -0.608 19554 3731 1 8 . 1 1 144 144 THR C C 144 175.730 175.730 175.974 -0.244 19554 3732 1 8 . 1 1 144 144 THR CA C 144 61.520 61.520 63.171 -1.651 19554 3733 1 8 . 1 1 144 144 THR CB C 144 68.610 68.610 70.214 -1.604 19554 3734 1 8 . 1 1 144 144 THR H H 144 8.030 8.030 8.564 -0.534 19554 3735 1 8 . 1 1 145 145 LEU N N 145 124.820 124.820 122.935 1.885 19554 3736 1 8 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.121 0.579 19554 3737 1 8 . 1 1 145 145 LEU C C 145 178.010 178.010 176.656 1.354 19554 3738 1 8 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.828 0.522 19554 3739 1 8 . 1 1 145 145 LEU CB C 145 42.100 42.100 42.063 0.037 19554 3740 1 8 . 1 1 145 145 LEU H H 145 8.050 8.050 8.335 -0.285 19554 3741 1 8 . 1 1 146 146 HIS N N 146 116.310 116.310 112.321 3.989 19554 3742 1 8 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.534 0.006 19554 3743 1 8 . 1 1 146 146 HIS C C 146 175.000 175.000 174.542 0.458 19554 3744 1 8 . 1 1 146 146 HIS H H 146 8.120 8.120 8.286 -0.166 19554 3745 1 8 . 1 1 147 147 LEU N N 147 120.320 120.320 118.550 1.770 19554 3746 1 8 . 1 1 147 147 LEU HA H 147 4.070 4.070 4.061 0.009 19554 3747 1 8 . 1 1 147 147 LEU C C 147 176.810 176.810 176.363 0.447 19554 3748 1 8 . 1 1 147 147 LEU CA C 147 54.710 54.710 55.090 -0.380 19554 3749 1 8 . 1 1 147 147 LEU CB C 147 41.960 41.960 43.713 -1.753 19554 3750 1 8 . 1 1 147 147 LEU H H 147 7.620 7.620 7.579 0.041 19554 3751 1 8 . 1 1 148 148 GLU N N 148 118.950 118.950 116.957 1.993 19554 3752 1 8 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.496 -0.716 19554 3753 1 8 . 1 1 148 148 GLU C C 148 177.480 177.480 176.446 1.034 19554 3754 1 8 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.660 2.770 19554 3755 1 8 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.476 -1.796 19554 3756 1 8 . 1 1 148 148 GLU H H 148 7.760 7.760 7.385 0.375 19554 3757 1 8 . 1 1 149 149 GLY N N 149 111.070 111.070 110.785 0.285 19554 3758 1 8 . 1 1 149 149 GLY C C 149 173.820 173.820 174.388 -0.568 19554 3759 1 8 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.435 0.094 19554 3760 1 8 . 1 1 149 149 GLY H H 149 8.630 8.630 8.359 0.271 19554 3761 1 8 . 1 1 150 150 LYS N N 150 119.380 119.380 122.524 -3.144 19554 3762 1 8 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.184 0.146 19554 3763 1 8 . 1 1 150 150 LYS C C 150 175.110 175.110 175.287 -0.177 19554 3764 1 8 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.582 -1.412 19554 3765 1 8 . 1 1 150 150 LYS CB C 150 33.550 33.550 32.876 0.674 19554 3766 1 8 . 1 1 150 150 LYS H H 150 7.520 7.520 7.984 -0.464 19554 3767 1 8 . 1 1 151 151 GLU N N 151 122.850 122.850 126.088 -3.238 19554 3768 1 8 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.453 0.017 19554 3769 1 8 . 1 1 151 151 GLU C C 151 175.510 175.510 175.262 0.248 19554 3770 1 8 . 1 1 151 151 GLU CA C 151 56.340 56.340 54.928 1.412 19554 3771 1 8 . 1 1 151 151 GLU CB C 151 30.010 30.010 30.288 -0.278 19554 3772 1 8 . 1 1 151 151 GLU H H 151 8.410 8.410 8.537 -0.127 19554 3773 1 8 . 1 1 152 152 LEU N N 152 127.520 127.520 121.896 5.624 19554 3774 1 8 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.827 -0.287 19554 3775 1 8 . 1 1 152 152 LEU C C 152 173.750 173.750 174.504 -0.754 19554 3776 1 8 . 1 1 152 152 LEU CA C 152 52.820 52.820 52.552 0.268 19554 3777 1 8 . 1 1 152 152 LEU H H 152 8.850 8.850 7.762 1.088 19554 3778 1 8 . 1 1 153 153 GLU N N 153 116.500 116.500 119.344 -2.844 19554 3779 1 8 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.413 0.167 19554 3780 1 8 . 1 1 153 153 GLU C C 153 175.120 175.120 175.062 0.058 19554 3781 1 8 . 1 1 153 153 GLU CA C 153 55.160 55.160 54.929 0.231 19554 3782 1 8 . 1 1 153 153 GLU H H 153 7.110 7.110 8.404 -1.294 19554 3783 1 8 . 1 1 154 154 PHE N N 154 115.150 115.150 122.519 -7.369 19554 3784 1 8 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.691 0.169 19554 3785 1 8 . 1 1 154 154 PHE C C 154 175.630 175.630 174.532 1.098 19554 3786 1 8 . 1 1 154 154 PHE CA C 154 57.190 57.190 57.337 -0.147 19554 3787 1 8 . 1 1 154 154 PHE CB C 154 44.250 44.250 41.259 2.991 19554 3788 1 8 . 1 1 154 154 PHE H H 154 8.910 8.910 8.590 0.320 19554 3789 1 8 . 1 1 155 155 LYS N N 155 114.560 114.560 118.857 -4.297 19554 3790 1 8 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.594 0.116 19554 3791 1 8 . 1 1 155 155 LYS C C 155 176.500 176.500 175.320 1.180 19554 3792 1 8 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.403 -1.803 19554 3793 1 8 . 1 1 155 155 LYS CB C 155 33.960 33.960 36.127 -2.167 19554 3794 1 8 . 1 1 155 155 LYS H H 155 8.100 8.100 8.585 -0.485 19554 3795 1 8 . 1 1 156 156 VAL N N 156 124.530 124.530 124.626 -0.096 19554 3796 1 8 . 1 1 156 156 VAL C C 156 175.630 175.630 175.446 0.184 19554 3797 1 8 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.823 -1.133 19554 3798 1 8 . 1 1 156 156 VAL CB C 156 31.600 31.600 32.455 -0.855 19554 3799 1 8 . 1 1 156 156 VAL H H 156 9.920 9.920 8.603 1.317 19554 3800 1 8 . 1 1 157 157 ILE N N 157 119.590 119.590 127.278 -7.688 19554 3801 1 8 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.320 0.400 19554 3802 1 8 . 1 1 157 157 ILE C C 157 176.190 176.190 175.077 1.113 19554 3803 1 8 . 1 1 157 157 ILE CA C 157 61.050 61.050 61.436 -0.386 19554 3804 1 8 . 1 1 157 157 ILE CB C 157 39.170 39.170 39.901 -0.731 19554 3805 1 8 . 1 1 157 157 ILE H H 157 8.530 8.530 8.774 -0.244 19554 3806 1 8 . 1 1 158 158 LYS N N 158 122.460 122.460 119.666 2.794 19554 3807 1 8 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.588 -0.388 19554 3808 1 8 . 1 1 158 158 LYS C C 158 173.000 173.000 174.128 -1.128 19554 3809 1 8 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.465 0.335 19554 3810 1 8 . 1 1 158 158 LYS CB C 158 35.640 35.640 36.069 -0.430 19554 3811 1 8 . 1 1 158 158 LYS H H 158 7.600 7.600 8.098 -0.498 19554 3812 1 8 . 1 1 159 159 LEU N N 159 125.430 125.430 119.026 6.404 19554 3813 1 8 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.643 -0.023 19554 3814 1 8 . 1 1 159 159 LEU C C 159 174.390 174.390 174.843 -0.453 19554 3815 1 8 . 1 1 159 159 LEU CA C 159 54.510 54.510 54.678 -0.168 19554 3816 1 8 . 1 1 159 159 LEU H H 159 7.950 7.950 8.232 -0.282 19554 3817 1 8 . 1 1 160 160 ASP N N 160 124.740 124.740 124.845 -0.105 19554 3818 1 8 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.729 -0.059 19554 3819 1 8 . 1 1 160 160 ASP C C 160 176.020 176.020 177.142 -1.122 19554 3820 1 8 . 1 1 160 160 ASP CA C 160 52.620 52.620 54.191 -1.571 19554 3821 1 8 . 1 1 160 160 ASP CB C 160 42.050 42.050 39.178 2.872 19554 3822 1 8 . 1 1 160 160 ASP H H 160 8.760 8.760 8.609 0.151 19554 3823 1 8 . 1 1 161 161 GLN N N 161 126.490 126.490 120.050 6.440 19554 3824 1 8 . 1 1 161 161 GLN HA H 161 3.120 3.120 3.978 -0.858 19554 3825 1 8 . 1 1 161 161 GLN C C 161 178.280 178.280 177.750 0.530 19554 3826 1 8 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.753 0.017 19554 3827 1 8 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.027 -0.187 19554 3828 1 8 . 1 1 161 161 GLN H H 161 9.110 9.110 7.823 1.287 19554 3829 1 8 . 1 1 162 162 LYS N N 162 119.150 119.150 120.367 -1.217 19554 3830 1 8 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.124 -0.324 19554 3831 1 8 . 1 1 162 162 LYS C C 162 177.900 177.900 177.745 0.155 19554 3832 1 8 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.660 0.040 19554 3833 1 8 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.109 -0.719 19554 3834 1 8 . 1 1 162 162 LYS H H 162 8.070 8.070 8.251 -0.181 19554 3835 1 8 . 1 1 163 163 ARG N N 163 114.850 114.850 116.613 -1.763 19554 3836 1 8 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.503 -0.353 19554 3837 1 8 . 1 1 163 163 ARG C C 163 174.750 174.750 175.117 -0.367 19554 3838 1 8 . 1 1 163 163 ARG CA C 163 54.800 54.800 54.941 -0.141 19554 3839 1 8 . 1 1 163 163 ARG H H 163 7.010 7.010 7.530 -0.520 19554 3840 1 8 . 1 1 164 164 ASN N N 164 117.810 117.810 117.423 0.387 19554 3841 1 8 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.397 -0.267 19554 3842 1 8 . 1 1 164 164 ASN C C 164 173.880 173.880 173.951 -0.071 19554 3843 1 8 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.701 -0.741 19554 3844 1 8 . 1 1 164 164 ASN CB C 164 37.530 37.530 37.549 -0.019 19554 3845 1 8 . 1 1 164 164 ASN H H 164 7.750 7.750 8.110 -0.360 19554 3846 1 8 . 1 1 165 165 ASN N N 165 116.170 116.170 116.910 -0.740 19554 3847 1 8 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.940 0.120 19554 3848 1 8 . 1 1 165 165 ASN C C 165 172.990 172.990 173.452 -0.462 19554 3849 1 8 . 1 1 165 165 ASN CA C 165 52.440 52.440 53.275 -0.835 19554 3850 1 8 . 1 1 165 165 ASN CB C 165 41.820 41.820 41.851 -0.031 19554 3851 1 8 . 1 1 165 165 ASN H H 165 8.020 8.020 8.253 -0.233 19554 3852 1 8 . 1 1 166 166 VAL N N 166 124.790 124.790 120.200 4.590 19554 3853 1 8 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.280 0.220 19554 3854 1 8 . 1 1 166 166 VAL C C 166 174.190 174.190 173.331 0.859 19554 3855 1 8 . 1 1 166 166 VAL CA C 166 61.030 61.030 61.337 -0.307 19554 3856 1 8 . 1 1 166 166 VAL CB C 166 34.620 34.620 33.447 1.173 19554 3857 1 8 . 1 1 166 166 VAL H H 166 8.380 8.380 8.341 0.039 19554 3858 1 8 . 1 1 167 167 VAL N N 167 128.000 128.000 125.749 2.251 19554 3859 1 8 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.526 0.724 19554 3860 1 8 . 1 1 167 167 VAL C C 167 176.000 176.000 173.683 2.317 19554 3861 1 8 . 1 1 167 167 VAL CA C 167 60.610 60.610 60.498 0.112 19554 3862 1 8 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.528 -0.628 19554 3863 1 8 . 1 1 167 167 VAL H H 167 8.710 8.710 7.825 0.885 19554 3864 1 8 . 1 1 168 168 VAL N N 168 118.360 118.360 115.017 3.343 19554 3865 1 8 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.549 0.691 19554 3866 1 8 . 1 1 168 168 VAL C C 168 172.800 172.800 174.907 -2.107 19554 3867 1 8 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.164 -1.304 19554 3868 1 8 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.920 1.430 19554 3869 1 8 . 1 1 168 168 VAL H H 168 8.560 8.560 8.464 0.096 19554 3870 1 8 . 1 1 169 169 SER N N 169 106.720 106.720 115.289 -8.569 19554 3871 1 8 . 1 1 169 169 SER HA H 169 4.480 4.480 4.792 -0.312 19554 3872 1 8 . 1 1 169 169 SER C C 169 175.950 175.950 175.287 0.663 19554 3873 1 8 . 1 1 169 169 SER CA C 169 55.550 55.550 56.674 -1.124 19554 3874 1 8 . 1 1 169 169 SER CB C 169 64.980 64.980 65.604 -0.624 19554 3875 1 8 . 1 1 169 169 SER H H 169 8.600 8.600 8.704 -0.104 19554 3876 1 8 . 1 1 170 170 ARG N N 170 129.620 129.620 126.016 3.604 19554 3877 1 8 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.214 0.496 19554 3878 1 8 . 1 1 170 170 ARG C C 170 177.870 177.870 177.839 0.031 19554 3879 1 8 . 1 1 170 170 ARG CA C 170 57.150 57.150 58.926 -1.776 19554 3880 1 8 . 1 1 170 170 ARG H H 170 7.610 7.610 8.959 -1.349 19554 3881 1 8 . 1 1 171 171 ARG N N 171 122.230 122.230 118.770 3.460 19554 3882 1 8 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.110 -0.640 19554 3883 1 8 . 1 1 171 171 ARG C C 171 175.760 175.760 177.658 -1.898 19554 3884 1 8 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.870 0.560 19554 3885 1 8 . 1 1 171 171 ARG CB C 171 30.410 30.410 29.564 0.846 19554 3886 1 8 . 1 1 171 171 ARG H H 171 8.260 8.260 8.541 -0.281 19554 3887 1 8 . 1 1 172 172 ALA N N 172 116.490 116.490 122.241 -5.751 19554 3888 1 8 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.144 -0.094 19554 3889 1 8 . 1 1 172 172 ALA C C 172 179.480 179.480 179.689 -0.209 19554 3890 1 8 . 1 1 172 172 ALA CA C 172 54.010 54.010 54.773 -0.763 19554 3891 1 8 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.098 0.792 19554 3892 1 8 . 1 1 172 172 ALA H H 172 7.760 7.760 7.585 0.175 19554 3893 1 8 . 1 1 173 173 VAL N N 173 116.440 116.440 119.877 -3.437 19554 3894 1 8 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.615 -0.145 19554 3895 1 8 . 1 1 173 173 VAL C C 173 177.680 177.680 177.854 -0.174 19554 3896 1 8 . 1 1 173 173 VAL CA C 173 65.080 65.080 66.412 -1.332 19554 3897 1 8 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.444 0.436 19554 3898 1 8 . 1 1 173 173 VAL H H 173 7.210 7.210 7.722 -0.512 19554 3899 1 8 . 1 1 174 174 ILE N N 174 119.790 119.790 116.317 3.473 19554 3900 1 8 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.744 -0.064 19554 3901 1 8 . 1 1 174 174 ILE C C 174 178.310 178.310 177.654 0.656 19554 3902 1 8 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.649 -0.879 19554 3903 1 8 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.304 1.146 19554 3904 1 8 . 1 1 174 174 ILE H H 174 7.160 7.160 7.779 -0.619 19554 3905 1 8 . 1 1 175 175 GLU N N 175 117.810 117.810 120.250 -2.440 19554 3906 1 8 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.076 -0.046 19554 3907 1 8 . 1 1 175 175 GLU C C 175 177.170 177.170 178.970 -1.800 19554 3908 1 8 . 1 1 175 175 GLU CA C 175 57.190 57.190 59.049 -1.859 19554 3909 1 8 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.187 0.453 19554 3910 1 8 . 1 1 175 175 GLU H H 175 8.250 8.250 8.359 -0.109 19554 3911 1 8 . 1 1 176 176 SER N N 176 114.300 114.300 115.400 -1.100 19554 3912 1 8 . 1 1 176 176 SER HA H 176 4.320 4.320 4.154 0.166 19554 3913 1 8 . 1 1 176 176 SER C C 176 174.930 174.930 176.667 -1.737 19554 3914 1 8 . 1 1 176 176 SER CA C 176 59.060 59.060 61.230 -2.170 19554 3915 1 8 . 1 1 176 176 SER CB C 176 63.640 63.640 62.994 0.646 19554 3916 1 8 . 1 1 176 176 SER H H 176 7.460 7.460 7.603 -0.143 19554 3917 1 8 . 1 1 177 177 GLU N N 177 121.860 121.860 121.237 0.623 19554 3918 1 8 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.087 0.083 19554 3919 1 8 . 1 1 177 177 GLU C C 177 176.340 176.340 178.228 -1.888 19554 3920 1 8 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.578 -1.938 19554 3921 1 8 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.630 0.120 19554 3922 1 8 . 1 1 177 177 GLU H H 177 7.890 7.890 8.221 -0.331 19554 3923 1 8 . 1 1 178 178 ASN N N 178 119.030 119.030 117.920 1.110 19554 3924 1 8 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.548 0.152 19554 3925 1 8 . 1 1 178 178 ASN C C 178 174.230 174.230 176.607 -2.377 19554 3926 1 8 . 1 1 178 178 ASN CA C 178 53.010 53.010 54.974 -1.964 19554 3927 1 8 . 1 1 178 178 ASN CB C 178 39.080 39.080 38.788 0.292 19554 3928 1 8 . 1 1 178 178 ASN H H 178 8.110 8.110 7.815 0.295 19554 3929 1 9 . 1 1 89 89 ALA HA H 89 4.160 4.160 4.075 0.085 19554 3930 1 9 . 1 1 89 89 ALA C C 89 179.720 179.720 179.265 0.455 19554 3931 1 9 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.475 0.015 19554 3932 1 9 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.931 -0.711 19554 3933 1 9 . 1 1 90 90 LYS N N 90 119.500 119.500 118.368 1.132 19554 3934 1 9 . 1 1 90 90 LYS C C 90 179.090 179.090 178.558 0.532 19554 3935 1 9 . 1 1 90 90 LYS H H 90 7.980 7.980 8.336 -0.356 19554 3936 1 9 . 1 1 91 91 ARG N N 91 120.510 120.510 118.216 2.294 19554 3937 1 9 . 1 1 91 91 ARG HA H 91 4.150 4.150 4.062 0.088 19554 3938 1 9 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.928 0.372 19554 3939 1 9 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.153 0.867 19554 3940 1 9 . 1 1 91 91 ARG H H 91 8.010 8.010 8.396 -0.386 19554 3941 1 9 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.773 1.347 19554 3942 1 9 . 1 1 92 92 HIS C C 92 177.360 177.360 176.325 1.035 19554 3943 1 9 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.690 0.180 19554 3944 1 9 . 1 1 93 93 GLU N N 93 118.470 118.470 117.466 1.004 19554 3945 1 9 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.275 -0.375 19554 3946 1 9 . 1 1 93 93 GLU C C 93 178.740 178.740 178.010 0.730 19554 3947 1 9 . 1 1 93 93 GLU CA C 93 59.160 59.160 58.037 1.123 19554 3948 1 9 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.847 -0.887 19554 3949 1 9 . 1 1 93 93 GLU H H 93 8.190 8.190 7.628 0.562 19554 3950 1 9 . 1 1 94 94 ALA N N 94 123.080 123.080 123.139 -0.059 19554 3951 1 9 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.315 -0.245 19554 3952 1 9 . 1 1 94 94 ALA C C 94 180.330 180.330 179.760 0.570 19554 3953 1 9 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.256 0.684 19554 3954 1 9 . 1 1 94 94 ALA CB C 94 18.250 18.250 18.107 0.143 19554 3955 1 9 . 1 1 94 94 ALA H H 94 8.090 8.090 7.254 0.836 19554 3956 1 9 . 1 1 95 95 TRP N N 95 119.190 119.190 119.695 -0.505 19554 3957 1 9 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.458 -0.418 19554 3958 1 9 . 1 1 95 95 TRP C C 95 178.590 178.590 177.803 0.787 19554 3959 1 9 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.622 2.378 19554 3960 1 9 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.822 1.338 19554 3961 1 9 . 1 1 95 95 TRP H H 95 8.060 8.060 8.064 -0.004 19554 3962 1 9 . 1 1 96 96 ILE N N 96 119.570 119.570 116.059 3.511 19554 3963 1 9 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.730 0.080 19554 3964 1 9 . 1 1 96 96 ILE C C 96 179.300 179.300 177.356 1.944 19554 3965 1 9 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.604 -0.064 19554 3966 1 9 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.517 -0.387 19554 3967 1 9 . 1 1 96 96 ILE H H 96 7.850 7.850 7.385 0.465 19554 3968 1 9 . 1 1 97 97 THR N N 97 117.030 117.030 114.853 2.177 19554 3969 1 9 . 1 1 97 97 THR HA H 97 3.830 3.830 4.122 -0.292 19554 3970 1 9 . 1 1 97 97 THR C C 97 177.080 177.080 176.781 0.299 19554 3971 1 9 . 1 1 97 97 THR CA C 97 66.430 66.430 65.474 0.956 19554 3972 1 9 . 1 1 97 97 THR CB C 97 68.450 68.450 69.209 -0.759 19554 3973 1 9 . 1 1 97 97 THR H H 97 7.900 7.900 7.997 -0.097 19554 3974 1 9 . 1 1 98 98 LEU N N 98 123.110 123.110 118.937 4.173 19554 3975 1 9 . 1 1 98 98 LEU HA H 98 3.930 3.930 3.990 -0.060 19554 3976 1 9 . 1 1 98 98 LEU C C 98 178.160 178.160 178.423 -0.263 19554 3977 1 9 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.333 0.397 19554 3978 1 9 . 1 1 98 98 LEU CB C 98 41.540 41.540 40.337 1.204 19554 3979 1 9 . 1 1 98 98 LEU H H 98 7.830 7.830 7.743 0.087 19554 3980 1 9 . 1 1 99 99 GLU N N 99 120.520 120.520 120.126 0.394 19554 3981 1 9 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.142 -0.262 19554 3982 1 9 . 1 1 99 99 GLU C C 99 179.010 179.010 179.223 -0.213 19554 3983 1 9 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.885 0.035 19554 3984 1 9 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.180 0.170 19554 3985 1 9 . 1 1 99 99 GLU H H 99 8.560 8.560 8.623 -0.063 19554 3986 1 9 . 1 1 100 100 LYS N N 100 119.950 119.950 117.495 2.455 19554 3987 1 9 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.090 -0.060 19554 3988 1 9 . 1 1 100 100 LYS C C 100 177.870 177.870 178.414 -0.544 19554 3989 1 9 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.545 0.025 19554 3990 1 9 . 1 1 100 100 LYS CB C 100 31.720 31.720 31.973 -0.253 19554 3991 1 9 . 1 1 100 100 LYS H H 100 7.800 7.800 7.663 0.137 19554 3992 1 9 . 1 1 101 101 ALA N N 101 120.690 120.690 121.389 -0.699 19554 3993 1 9 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.048 -0.028 19554 3994 1 9 . 1 1 101 101 ALA C C 101 180.990 180.990 179.925 1.065 19554 3995 1 9 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.660 0.460 19554 3996 1 9 . 1 1 101 101 ALA CB C 101 17.580 17.580 17.906 -0.326 19554 3997 1 9 . 1 1 101 101 ALA H H 101 7.800 7.800 7.505 0.295 19554 3998 1 9 . 1 1 102 102 TYR N N 102 118.440 118.440 117.689 0.751 19554 3999 1 9 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.184 0.136 19554 4000 1 9 . 1 1 102 102 TYR C C 102 178.590 178.590 178.484 0.106 19554 4001 1 9 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.416 -0.606 19554 4002 1 9 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.292 1.398 19554 4003 1 9 . 1 1 102 102 TYR H H 102 8.580 8.580 7.394 1.186 19554 4004 1 9 . 1 1 103 103 GLU N N 103 120.860 120.860 118.486 2.374 19554 4005 1 9 . 1 1 103 103 GLU HA H 103 3.590 3.590 4.121 -0.531 19554 4006 1 9 . 1 1 103 103 GLU C C 103 178.100 178.100 176.939 1.161 19554 4007 1 9 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.802 0.278 19554 4008 1 9 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.363 0.057 19554 4009 1 9 . 1 1 103 103 GLU H H 103 8.290 8.290 7.868 0.422 19554 4010 1 9 . 1 1 104 104 ASP N N 104 116.120 116.120 117.285 -1.165 19554 4011 1 9 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.658 -0.048 19554 4012 1 9 . 1 1 104 104 ASP C C 104 174.970 174.970 175.050 -0.080 19554 4013 1 9 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.144 0.976 19554 4014 1 9 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.688 -0.208 19554 4015 1 9 . 1 1 104 104 ASP H H 104 8.120 8.120 7.651 0.469 19554 4016 1 9 . 1 1 105 105 ALA N N 105 123.330 123.330 119.761 3.569 19554 4017 1 9 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.154 -0.004 19554 4018 1 9 . 1 1 105 105 ALA C C 105 177.130 177.130 176.444 0.686 19554 4019 1 9 . 1 1 105 105 ALA CA C 105 52.640 52.640 53.009 -0.369 19554 4020 1 9 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.723 -0.423 19554 4021 1 9 . 1 1 105 105 ALA H H 105 7.710 7.710 7.906 -0.196 19554 4022 1 9 . 1 1 106 106 GLU N N 106 118.950 118.950 117.659 1.291 19554 4023 1 9 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.218 0.082 19554 4024 1 9 . 1 1 106 106 GLU C C 106 176.730 176.730 176.218 0.512 19554 4025 1 9 . 1 1 106 106 GLU CA C 106 55.440 55.440 56.436 -0.996 19554 4026 1 9 . 1 1 106 106 GLU CB C 106 31.760 31.760 31.311 0.450 19554 4027 1 9 . 1 1 106 106 GLU H H 106 8.440 8.440 7.826 0.614 19554 4028 1 9 . 1 1 107 107 THR N N 107 118.780 118.780 114.331 4.449 19554 4029 1 9 . 1 1 107 107 THR HA H 107 4.550 4.550 4.441 0.109 19554 4030 1 9 . 1 1 107 107 THR C C 107 174.250 174.250 174.039 0.211 19554 4031 1 9 . 1 1 107 107 THR CA C 107 62.360 62.360 61.035 1.325 19554 4032 1 9 . 1 1 107 107 THR CB C 107 69.390 69.390 69.645 -0.255 19554 4033 1 9 . 1 1 107 107 THR H H 107 8.740 8.740 8.241 0.499 19554 4034 1 9 . 1 1 108 108 VAL N N 108 120.540 120.540 117.792 2.748 19554 4035 1 9 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.702 -0.072 19554 4036 1 9 . 1 1 108 108 VAL C C 108 174.440 174.440 174.395 0.045 19554 4037 1 9 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.416 -0.416 19554 4038 1 9 . 1 1 108 108 VAL CB C 108 34.650 34.650 35.325 -0.675 19554 4039 1 9 . 1 1 108 108 VAL H H 108 9.040 9.040 8.078 0.962 19554 4040 1 9 . 1 1 109 109 THR N N 109 115.100 115.100 112.083 3.017 19554 4041 1 9 . 1 1 109 109 THR HA H 109 5.380 5.380 4.299 1.081 19554 4042 1 9 . 1 1 109 109 THR C C 109 174.580 174.580 173.466 1.114 19554 4043 1 9 . 1 1 109 109 THR CA C 109 60.410 60.410 61.094 -0.684 19554 4044 1 9 . 1 1 109 109 THR CB C 109 70.610 70.610 70.493 0.117 19554 4045 1 9 . 1 1 109 109 THR H H 109 8.170 8.170 8.170 0.000 19554 4046 1 9 . 1 1 110 110 GLY N N 110 108.580 108.580 111.367 -2.787 19554 4047 1 9 . 1 1 110 110 GLY C C 110 170.810 170.810 171.716 -0.906 19554 4048 1 9 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.016 0.364 19554 4049 1 9 . 1 1 110 110 GLY H H 110 8.780 8.780 7.583 1.197 19554 4050 1 9 . 1 1 111 111 VAL N N 111 116.930 116.930 121.352 -4.422 19554 4051 1 9 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.710 0.070 19554 4052 1 9 . 1 1 111 111 VAL C C 111 176.060 176.060 175.115 0.945 19554 4053 1 9 . 1 1 111 111 VAL CA C 111 59.770 59.770 59.164 0.606 19554 4054 1 9 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.510 1.240 19554 4055 1 9 . 1 1 111 111 VAL H H 111 7.810 7.810 8.286 -0.476 19554 4056 1 9 . 1 1 112 112 ILE N N 112 127.060 127.060 129.068 -2.008 19554 4057 1 9 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.179 0.051 19554 4058 1 9 . 1 1 112 112 ILE C C 112 176.180 176.180 175.787 0.393 19554 4059 1 9 . 1 1 112 112 ILE CA C 112 62.220 62.220 63.061 -0.841 19554 4060 1 9 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.508 0.973 19554 4061 1 9 . 1 1 112 112 ILE H H 112 9.240 9.240 8.142 1.098 19554 4062 1 9 . 1 1 113 113 ASN N N 113 127.510 127.510 126.520 0.990 19554 4063 1 9 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.761 0.179 19554 4064 1 9 . 1 1 113 113 ASN C C 113 175.020 175.020 175.591 -0.571 19554 4065 1 9 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.525 -1.235 19554 4066 1 9 . 1 1 113 113 ASN CB C 113 39.580 39.580 40.585 -1.005 19554 4067 1 9 . 1 1 113 113 ASN H H 113 9.010 9.010 8.185 0.825 19554 4068 1 9 . 1 1 114 114 GLY N N 114 107.150 107.150 107.790 -0.640 19554 4069 1 9 . 1 1 114 114 GLY C C 114 171.360 171.360 172.421 -1.061 19554 4070 1 9 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.403 1.117 19554 4071 1 9 . 1 1 114 114 GLY H H 114 7.620 7.620 7.759 -0.139 19554 4072 1 9 . 1 1 115 115 LYS N N 115 121.670 121.670 121.359 0.311 19554 4073 1 9 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.279 0.311 19554 4074 1 9 . 1 1 115 115 LYS C C 115 175.950 175.950 174.929 1.021 19554 4075 1 9 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.705 1.235 19554 4076 1 9 . 1 1 115 115 LYS CB C 115 34.040 34.040 33.851 0.189 19554 4077 1 9 . 1 1 115 115 LYS H H 115 8.550 8.550 8.159 0.391 19554 4078 1 9 . 1 1 116 116 VAL N N 116 118.750 118.750 119.757 -1.007 19554 4079 1 9 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.397 0.073 19554 4080 1 9 . 1 1 116 116 VAL C C 116 175.110 175.110 175.137 -0.027 19554 4081 1 9 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.297 -0.267 19554 4082 1 9 . 1 1 116 116 VAL CB C 116 35.500 35.500 33.680 1.820 19554 4083 1 9 . 1 1 116 116 VAL H H 116 8.070 8.070 7.921 0.149 19554 4084 1 9 . 1 1 117 117 LYS N N 117 122.520 122.520 121.693 0.827 19554 4085 1 9 . 1 1 117 117 LYS HA H 117 3.930 3.930 3.980 -0.050 19554 4086 1 9 . 1 1 117 117 LYS C C 117 177.970 177.970 176.741 1.229 19554 4087 1 9 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.243 1.427 19554 4088 1 9 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.156 -0.216 19554 4089 1 9 . 1 1 117 117 LYS H H 117 8.250 8.250 8.482 -0.232 19554 4090 1 9 . 1 1 118 118 GLY N N 118 113.440 113.440 111.508 1.932 19554 4091 1 9 . 1 1 118 118 GLY C C 118 175.540 175.540 173.822 1.718 19554 4092 1 9 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.187 0.013 19554 4093 1 9 . 1 1 118 118 GLY H H 118 8.820 8.820 7.969 0.851 19554 4094 1 9 . 1 1 119 119 GLY N N 119 109.130 109.130 106.482 2.648 19554 4095 1 9 . 1 1 119 119 GLY C C 119 170.530 170.530 172.372 -1.842 19554 4096 1 9 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.422 3.418 19554 4097 1 9 . 1 1 119 119 GLY H H 119 7.930 7.930 7.488 0.442 19554 4098 1 9 . 1 1 120 120 PHE N N 120 123.370 123.370 117.712 5.658 19554 4099 1 9 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.666 0.604 19554 4100 1 9 . 1 1 120 120 PHE C C 120 174.260 174.260 174.462 -0.202 19554 4101 1 9 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.101 -0.761 19554 4102 1 9 . 1 1 120 120 PHE CB C 120 43.730 43.730 43.171 0.559 19554 4103 1 9 . 1 1 120 120 PHE H H 120 8.820 8.820 8.704 0.116 19554 4104 1 9 . 1 1 121 121 THR N N 121 114.670 114.670 116.384 -1.714 19554 4105 1 9 . 1 1 121 121 THR HA H 121 5.000 5.000 4.768 0.232 19554 4106 1 9 . 1 1 121 121 THR C C 121 173.780 173.780 174.021 -0.241 19554 4107 1 9 . 1 1 121 121 THR CA C 121 60.500 60.500 60.658 -0.158 19554 4108 1 9 . 1 1 121 121 THR CB C 121 69.910 69.910 70.041 -0.131 19554 4109 1 9 . 1 1 121 121 THR H H 121 8.670 8.670 8.700 -0.030 19554 4110 1 9 . 1 1 122 122 VAL N N 122 124.340 124.340 121.210 3.130 19554 4111 1 9 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.460 0.140 19554 4112 1 9 . 1 1 122 122 VAL C C 122 174.240 174.240 173.777 0.463 19554 4113 1 9 . 1 1 122 122 VAL CA C 122 59.300 59.300 61.523 -2.223 19554 4114 1 9 . 1 1 122 122 VAL CB C 122 35.860 35.860 36.649 -0.789 19554 4115 1 9 . 1 1 122 122 VAL H H 122 8.560 8.560 8.288 0.272 19554 4116 1 9 . 1 1 123 123 GLU N N 123 126.950 126.950 126.658 0.292 19554 4117 1 9 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.859 -0.249 19554 4118 1 9 . 1 1 123 123 GLU C C 123 175.840 175.840 175.929 -0.089 19554 4119 1 9 . 1 1 123 123 GLU CA C 123 55.160 55.160 55.013 0.147 19554 4120 1 9 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.641 0.269 19554 4121 1 9 . 1 1 123 123 GLU H H 123 8.950 8.950 8.396 0.554 19554 4122 1 9 . 1 1 124 124 LEU N N 124 129.580 129.580 129.553 0.027 19554 4123 1 9 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.488 0.172 19554 4124 1 9 . 1 1 124 124 LEU C C 124 175.350 175.350 176.180 -0.830 19554 4125 1 9 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.690 -0.489 19554 4126 1 9 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.246 0.944 19554 4127 1 9 . 1 1 124 124 LEU H H 124 8.940 8.940 8.880 0.060 19554 4128 1 9 . 1 1 125 125 ASN N N 125 121.880 121.880 119.909 1.971 19554 4129 1 9 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.406 -0.216 19554 4130 1 9 . 1 1 125 125 ASN C C 125 174.690 174.690 175.050 -0.360 19554 4131 1 9 . 1 1 125 125 ASN CA C 125 53.880 53.880 53.948 -0.068 19554 4132 1 9 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.091 0.159 19554 4133 1 9 . 1 1 125 125 ASN H H 125 8.950 8.950 8.524 0.426 19554 4134 1 9 . 1 1 126 126 GLY N N 126 103.140 103.140 103.619 -0.479 19554 4135 1 9 . 1 1 126 126 GLY C C 126 173.680 173.680 174.672 -0.992 19554 4136 1 9 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.134 -0.254 19554 4137 1 9 . 1 1 126 126 GLY H H 126 8.070 8.070 8.040 0.030 19554 4138 1 9 . 1 1 127 127 ILE N N 127 122.120 122.120 122.276 -0.156 19554 4139 1 9 . 1 1 127 127 ILE HA H 127 3.970 3.970 4.012 -0.042 19554 4140 1 9 . 1 1 127 127 ILE C C 127 174.370 174.370 175.492 -1.122 19554 4141 1 9 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.748 -1.218 19554 4142 1 9 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.326 0.644 19554 4143 1 9 . 1 1 127 127 ILE H H 127 7.380 7.380 7.990 -0.610 19554 4144 1 9 . 1 1 128 128 ARG N N 128 126.630 126.630 125.173 1.457 19554 4145 1 9 . 1 1 128 128 ARG HA H 128 4.640 4.640 4.821 -0.181 19554 4146 1 9 . 1 1 128 128 ARG C C 128 174.720 174.720 175.221 -0.501 19554 4147 1 9 . 1 1 128 128 ARG CA C 128 55.650 55.650 55.373 0.278 19554 4148 1 9 . 1 1 128 128 ARG CB C 128 31.000 31.000 30.663 0.337 19554 4149 1 9 . 1 1 128 128 ARG H H 128 8.170 8.170 8.512 -0.342 19554 4150 1 9 . 1 1 129 129 ALA N N 129 127.320 127.320 127.377 -0.057 19554 4151 1 9 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.619 0.231 19554 4152 1 9 . 1 1 129 129 ALA C C 129 174.970 174.970 175.913 -0.943 19554 4153 1 9 . 1 1 129 129 ALA CA C 129 49.660 49.660 50.459 -0.799 19554 4154 1 9 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.601 2.789 19554 4155 1 9 . 1 1 129 129 ALA H H 129 9.240 9.240 8.760 0.480 19554 4156 1 9 . 1 1 130 130 PHE N N 130 121.060 121.060 120.196 0.864 19554 4157 1 9 . 1 1 130 130 PHE HA H 130 5.160 5.160 4.809 0.351 19554 4158 1 9 . 1 1 130 130 PHE C C 130 172.430 172.430 173.538 -1.108 19554 4159 1 9 . 1 1 130 130 PHE CA C 130 55.000 55.000 56.701 -1.701 19554 4160 1 9 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.149 0.251 19554 4161 1 9 . 1 1 130 130 PHE H H 130 8.660 8.660 8.487 0.173 19554 4162 1 9 . 1 1 131 131 LEU N N 131 130.250 130.250 127.436 2.814 19554 4163 1 9 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.950 0.030 19554 4164 1 9 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.792 -2.122 19554 4165 1 9 . 1 1 131 131 LEU CB C 131 44.330 44.330 44.540 -0.210 19554 4166 1 9 . 1 1 131 131 LEU H H 131 8.550 8.550 8.761 -0.211 19554 4167 1 9 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.577 -0.577 19554 4168 1 9 . 1 1 132 132 PRO C C 132 179.380 179.380 178.181 1.199 19554 4169 1 9 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.890 -0.730 19554 4170 1 9 . 1 1 133 133 GLY N N 133 111.470 111.470 107.552 3.918 19554 4171 1 9 . 1 1 133 133 GLY C C 133 175.590 175.590 176.829 -1.239 19554 4172 1 9 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.892 0.638 19554 4173 1 9 . 1 1 133 133 GLY H H 133 9.140 9.140 8.777 0.363 19554 4174 1 9 . 1 1 134 134 SER HA H 134 4.350 4.350 4.362 -0.012 19554 4175 1 9 . 1 1 134 134 SER C C 134 175.280 175.280 174.958 0.322 19554 4176 1 9 . 1 1 134 134 SER CA C 134 59.210 59.210 60.372 -1.162 19554 4177 1 9 . 1 1 134 134 SER CB C 134 62.730 62.730 63.365 -0.635 19554 4178 1 9 . 1 1 135 135 LEU N N 135 118.770 118.770 115.909 2.861 19554 4179 1 9 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.847 -0.267 19554 4180 1 9 . 1 1 135 135 LEU C C 135 177.500 177.500 177.284 0.216 19554 4181 1 9 . 1 1 135 135 LEU CA C 135 53.770 53.770 53.555 0.215 19554 4182 1 9 . 1 1 135 135 LEU H H 135 8.030 8.030 7.508 0.522 19554 4183 1 9 . 1 1 136 136 VAL N N 136 123.080 123.080 117.304 5.776 19554 4184 1 9 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.012 -0.402 19554 4185 1 9 . 1 1 136 136 VAL C C 136 173.150 173.150 175.602 -2.452 19554 4186 1 9 . 1 1 136 136 VAL CA C 136 65.220 65.220 64.055 1.165 19554 4187 1 9 . 1 1 136 136 VAL CB C 136 32.020 32.020 32.102 -0.082 19554 4188 1 9 . 1 1 136 136 VAL H H 136 7.550 7.550 7.450 0.100 19554 4189 1 9 . 1 1 137 137 ASP N N 137 117.300 117.300 113.588 3.712 19554 4190 1 9 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.510 -0.170 19554 4191 1 9 . 1 1 137 137 ASP C C 137 174.840 174.840 174.688 0.152 19554 4192 1 9 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.178 -1.108 19554 4193 1 9 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.414 3.046 19554 4194 1 9 . 1 1 137 137 ASP H H 137 7.940 7.940 7.609 0.331 19554 4195 1 9 . 1 1 138 138 VAL N N 138 116.750 116.750 122.509 -5.759 19554 4196 1 9 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.102 0.038 19554 4197 1 9 . 1 1 138 138 VAL CA C 138 61.190 61.190 63.070 -1.880 19554 4198 1 9 . 1 1 138 138 VAL CB C 138 33.330 33.330 32.429 0.901 19554 4199 1 9 . 1 1 138 138 VAL H H 138 10.000 10.000 8.280 1.720 19554 4200 1 9 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.552 -0.042 19554 4201 1 9 . 1 1 140 140 PRO C C 140 175.860 175.860 176.383 -0.523 19554 4202 1 9 . 1 1 141 141 VAL N N 141 124.910 124.910 122.126 2.784 19554 4203 1 9 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.453 -0.553 19554 4204 1 9 . 1 1 141 141 VAL C C 141 175.120 175.120 176.295 -1.175 19554 4205 1 9 . 1 1 141 141 VAL CA C 141 62.720 62.720 59.826 2.894 19554 4206 1 9 . 1 1 141 141 VAL CB C 141 31.870 31.870 35.018 -3.148 19554 4207 1 9 . 1 1 141 141 VAL H H 141 8.110 8.110 8.229 -0.119 19554 4208 1 9 . 1 1 142 142 ARG N N 142 119.730 119.730 120.844 -1.114 19554 4209 1 9 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.126 0.494 19554 4210 1 9 . 1 1 142 142 ARG C C 142 173.520 173.520 175.959 -2.439 19554 4211 1 9 . 1 1 142 142 ARG CA C 142 53.020 53.020 57.865 -4.845 19554 4212 1 9 . 1 1 142 142 ARG CB C 142 30.480 30.480 29.966 0.514 19554 4213 1 9 . 1 1 142 142 ARG H H 142 7.440 7.440 8.665 -1.225 19554 4214 1 9 . 1 1 143 143 ASP N N 143 119.780 119.780 118.428 1.352 19554 4215 1 9 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.699 -0.029 19554 4216 1 9 . 1 1 143 143 ASP C C 143 175.970 175.970 176.142 -0.172 19554 4217 1 9 . 1 1 143 143 ASP CA C 143 54.030 54.030 53.645 0.385 19554 4218 1 9 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.066 0.664 19554 4219 1 9 . 1 1 143 143 ASP H H 143 7.880 7.880 7.987 -0.107 19554 4220 1 9 . 1 1 144 144 THR N N 144 110.060 110.060 114.122 -4.062 19554 4221 1 9 . 1 1 144 144 THR HA H 144 4.110 4.110 4.378 -0.268 19554 4222 1 9 . 1 1 144 144 THR C C 144 175.730 175.730 174.695 1.035 19554 4223 1 9 . 1 1 144 144 THR CA C 144 61.520 61.520 61.031 0.489 19554 4224 1 9 . 1 1 144 144 THR CB C 144 68.610 68.610 68.838 -0.228 19554 4225 1 9 . 1 1 144 144 THR H H 144 8.030 8.030 8.555 -0.525 19554 4226 1 9 . 1 1 145 145 LEU N N 145 124.820 124.820 123.650 1.170 19554 4227 1 9 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.293 0.407 19554 4228 1 9 . 1 1 145 145 LEU C C 145 178.010 178.010 176.690 1.320 19554 4229 1 9 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.334 1.016 19554 4230 1 9 . 1 1 145 145 LEU CB C 145 42.100 42.100 42.346 -0.246 19554 4231 1 9 . 1 1 145 145 LEU H H 145 8.050 8.050 7.709 0.341 19554 4232 1 9 . 1 1 146 146 HIS N N 146 116.310 116.310 116.291 0.019 19554 4233 1 9 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.454 0.086 19554 4234 1 9 . 1 1 146 146 HIS C C 146 175.000 175.000 176.423 -1.423 19554 4235 1 9 . 1 1 146 146 HIS H H 146 8.120 8.120 7.755 0.365 19554 4236 1 9 . 1 1 147 147 LEU N N 147 120.320 120.320 119.897 0.423 19554 4237 1 9 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.630 0.440 19554 4238 1 9 . 1 1 147 147 LEU C C 147 176.810 176.810 176.646 0.164 19554 4239 1 9 . 1 1 147 147 LEU CA C 147 54.710 54.710 57.093 -2.383 19554 4240 1 9 . 1 1 147 147 LEU CB C 147 41.960 41.960 41.984 -0.024 19554 4241 1 9 . 1 1 147 147 LEU H H 147 7.620 7.620 7.594 0.026 19554 4242 1 9 . 1 1 148 148 GLU N N 148 118.950 118.950 115.658 3.292 19554 4243 1 9 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.234 -0.454 19554 4244 1 9 . 1 1 148 148 GLU C C 148 177.480 177.480 176.659 0.821 19554 4245 1 9 . 1 1 148 148 GLU CA C 148 58.430 58.430 56.073 2.357 19554 4246 1 9 . 1 1 148 148 GLU CB C 148 29.680 29.680 30.847 -1.167 19554 4247 1 9 . 1 1 148 148 GLU H H 148 7.760 7.760 7.587 0.173 19554 4248 1 9 . 1 1 149 149 GLY N N 149 111.070 111.070 110.431 0.639 19554 4249 1 9 . 1 1 149 149 GLY C C 149 173.820 173.820 174.656 -0.836 19554 4250 1 9 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.133 0.397 19554 4251 1 9 . 1 1 149 149 GLY H H 149 8.630 8.630 8.283 0.347 19554 4252 1 9 . 1 1 150 150 LYS N N 150 119.380 119.380 122.636 -3.256 19554 4253 1 9 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.153 0.177 19554 4254 1 9 . 1 1 150 150 LYS C C 150 175.110 175.110 175.398 -0.288 19554 4255 1 9 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.981 -1.811 19554 4256 1 9 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.056 0.494 19554 4257 1 9 . 1 1 150 150 LYS H H 150 7.520 7.520 8.259 -0.739 19554 4258 1 9 . 1 1 151 151 GLU N N 151 122.850 122.850 125.327 -2.477 19554 4259 1 9 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.557 -0.087 19554 4260 1 9 . 1 1 151 151 GLU C C 151 175.510 175.510 175.436 0.074 19554 4261 1 9 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.028 1.312 19554 4262 1 9 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.978 0.032 19554 4263 1 9 . 1 1 151 151 GLU H H 151 8.410 8.410 8.608 -0.198 19554 4264 1 9 . 1 1 152 152 LEU N N 152 127.520 127.520 126.022 1.498 19554 4265 1 9 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.691 -0.151 19554 4266 1 9 . 1 1 152 152 LEU C C 152 173.750 173.750 174.827 -1.077 19554 4267 1 9 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.366 -0.546 19554 4268 1 9 . 1 1 152 152 LEU H H 152 8.850 8.850 7.985 0.865 19554 4269 1 9 . 1 1 153 153 GLU N N 153 116.500 116.500 118.621 -2.121 19554 4270 1 9 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.099 0.481 19554 4271 1 9 . 1 1 153 153 GLU C C 153 175.120 175.120 175.261 -0.141 19554 4272 1 9 . 1 1 153 153 GLU CA C 153 55.160 55.160 55.564 -0.404 19554 4273 1 9 . 1 1 153 153 GLU H H 153 7.110 7.110 8.535 -1.425 19554 4274 1 9 . 1 1 154 154 PHE N N 154 115.150 115.150 119.661 -4.511 19554 4275 1 9 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.873 -0.013 19554 4276 1 9 . 1 1 154 154 PHE C C 154 175.630 175.630 174.970 0.660 19554 4277 1 9 . 1 1 154 154 PHE CA C 154 57.190 57.190 55.248 1.942 19554 4278 1 9 . 1 1 154 154 PHE CB C 154 44.250 44.250 41.836 2.414 19554 4279 1 9 . 1 1 154 154 PHE H H 154 8.910 8.910 8.318 0.592 19554 4280 1 9 . 1 1 155 155 LYS N N 155 114.560 114.560 120.902 -6.342 19554 4281 1 9 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.631 0.079 19554 4282 1 9 . 1 1 155 155 LYS C C 155 176.500 176.500 174.932 1.568 19554 4283 1 9 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.865 -2.265 19554 4284 1 9 . 1 1 155 155 LYS CB C 155 33.960 33.960 34.462 -0.502 19554 4285 1 9 . 1 1 155 155 LYS H H 155 8.100 8.100 8.677 -0.577 19554 4286 1 9 . 1 1 156 156 VAL N N 156 124.530 124.530 126.710 -2.180 19554 4287 1 9 . 1 1 156 156 VAL C C 156 175.630 175.630 175.722 -0.092 19554 4288 1 9 . 1 1 156 156 VAL CA C 156 62.690 62.690 64.130 -1.440 19554 4289 1 9 . 1 1 156 156 VAL CB C 156 31.600 31.600 31.981 -0.381 19554 4290 1 9 . 1 1 156 156 VAL H H 156 9.920 9.920 8.341 1.579 19554 4291 1 9 . 1 1 157 157 ILE N N 157 119.590 119.590 127.584 -7.994 19554 4292 1 9 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.076 0.644 19554 4293 1 9 . 1 1 157 157 ILE C C 157 176.190 176.190 175.322 0.868 19554 4294 1 9 . 1 1 157 157 ILE CA C 157 61.050 61.050 61.578 -0.527 19554 4295 1 9 . 1 1 157 157 ILE CB C 157 39.170 39.170 38.456 0.714 19554 4296 1 9 . 1 1 157 157 ILE H H 157 8.530 8.530 8.292 0.238 19554 4297 1 9 . 1 1 158 158 LYS N N 158 122.460 122.460 117.214 5.246 19554 4298 1 9 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.448 -0.248 19554 4299 1 9 . 1 1 158 158 LYS C C 158 173.000 173.000 174.110 -1.110 19554 4300 1 9 . 1 1 158 158 LYS CA C 158 56.800 56.800 55.838 0.962 19554 4301 1 9 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.654 0.986 19554 4302 1 9 . 1 1 158 158 LYS H H 158 7.600 7.600 7.983 -0.383 19554 4303 1 9 . 1 1 159 159 LEU N N 159 125.430 125.430 119.839 5.591 19554 4304 1 9 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.521 0.099 19554 4305 1 9 . 1 1 159 159 LEU C C 159 174.390 174.390 175.474 -1.084 19554 4306 1 9 . 1 1 159 159 LEU CA C 159 54.510 54.510 54.524 -0.014 19554 4307 1 9 . 1 1 159 159 LEU H H 159 7.950 7.950 8.149 -0.199 19554 4308 1 9 . 1 1 160 160 ASP N N 160 124.740 124.740 122.330 2.410 19554 4309 1 9 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.954 -0.284 19554 4310 1 9 . 1 1 160 160 ASP C C 160 176.020 176.020 176.000 0.020 19554 4311 1 9 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.510 -0.890 19554 4312 1 9 . 1 1 160 160 ASP CB C 160 42.050 42.050 41.736 0.314 19554 4313 1 9 . 1 1 160 160 ASP H H 160 8.760 8.760 8.314 0.446 19554 4314 1 9 . 1 1 161 161 GLN N N 161 126.490 126.490 123.692 2.798 19554 4315 1 9 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.143 -1.023 19554 4316 1 9 . 1 1 161 161 GLN C C 161 178.280 178.280 177.082 1.198 19554 4317 1 9 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.096 0.674 19554 4318 1 9 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.591 -0.751 19554 4319 1 9 . 1 1 161 161 GLN H H 161 9.110 9.110 8.647 0.463 19554 4320 1 9 . 1 1 162 162 LYS N N 162 119.150 119.150 119.836 -0.686 19554 4321 1 9 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.088 -0.288 19554 4322 1 9 . 1 1 162 162 LYS C C 162 177.900 177.900 177.827 0.073 19554 4323 1 9 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.564 0.136 19554 4324 1 9 . 1 1 162 162 LYS CB C 162 31.390 31.390 31.667 -0.277 19554 4325 1 9 . 1 1 162 162 LYS H H 162 8.070 8.070 8.199 -0.129 19554 4326 1 9 . 1 1 163 163 ARG N N 163 114.850 114.850 118.161 -3.311 19554 4327 1 9 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.207 -0.057 19554 4328 1 9 . 1 1 163 163 ARG C C 163 174.750 174.750 175.681 -0.931 19554 4329 1 9 . 1 1 163 163 ARG CA C 163 54.800 54.800 56.527 -1.727 19554 4330 1 9 . 1 1 163 163 ARG H H 163 7.010 7.010 8.329 -1.319 19554 4331 1 9 . 1 1 164 164 ASN N N 164 117.810 117.810 113.678 4.132 19554 4332 1 9 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.378 -0.248 19554 4333 1 9 . 1 1 164 164 ASN C C 164 173.880 173.880 173.412 0.468 19554 4334 1 9 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.239 -0.279 19554 4335 1 9 . 1 1 164 164 ASN CB C 164 37.530 37.530 36.585 0.945 19554 4336 1 9 . 1 1 164 164 ASN H H 164 7.750 7.750 8.132 -0.382 19554 4337 1 9 . 1 1 165 165 ASN N N 165 116.170 116.170 117.020 -0.850 19554 4338 1 9 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.952 0.108 19554 4339 1 9 . 1 1 165 165 ASN C C 165 172.990 172.990 173.093 -0.103 19554 4340 1 9 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.796 -0.356 19554 4341 1 9 . 1 1 165 165 ASN CB C 165 41.820 41.820 41.745 0.075 19554 4342 1 9 . 1 1 165 165 ASN H H 165 8.020 8.020 7.915 0.105 19554 4343 1 9 . 1 1 166 166 VAL N N 166 124.790 124.790 124.448 0.342 19554 4344 1 9 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.351 0.149 19554 4345 1 9 . 1 1 166 166 VAL C C 166 174.190 174.190 174.294 -0.104 19554 4346 1 9 . 1 1 166 166 VAL CA C 166 61.030 61.030 60.623 0.407 19554 4347 1 9 . 1 1 166 166 VAL CB C 166 34.620 34.620 33.252 1.368 19554 4348 1 9 . 1 1 166 166 VAL H H 166 8.380 8.380 8.451 -0.071 19554 4349 1 9 . 1 1 167 167 VAL N N 167 128.000 128.000 122.292 5.708 19554 4350 1 9 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.500 0.750 19554 4351 1 9 . 1 1 167 167 VAL C C 167 176.000 176.000 174.466 1.534 19554 4352 1 9 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.267 1.343 19554 4353 1 9 . 1 1 167 167 VAL CB C 167 33.900 33.900 35.069 -1.169 19554 4354 1 9 . 1 1 167 167 VAL H H 167 8.710 8.710 7.898 0.812 19554 4355 1 9 . 1 1 168 168 VAL N N 168 118.360 118.360 115.174 3.186 19554 4356 1 9 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.532 0.708 19554 4357 1 9 . 1 1 168 168 VAL C C 168 172.800 172.800 175.463 -2.663 19554 4358 1 9 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.355 -1.495 19554 4359 1 9 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.390 1.960 19554 4360 1 9 . 1 1 168 168 VAL H H 168 8.560 8.560 7.765 0.795 19554 4361 1 9 . 1 1 169 169 SER N N 169 106.720 106.720 117.180 -10.460 19554 4362 1 9 . 1 1 169 169 SER HA H 169 4.480 4.480 4.431 0.049 19554 4363 1 9 . 1 1 169 169 SER C C 169 175.950 175.950 174.644 1.306 19554 4364 1 9 . 1 1 169 169 SER CA C 169 55.550 55.550 58.401 -2.851 19554 4365 1 9 . 1 1 169 169 SER CB C 169 64.980 64.980 64.401 0.579 19554 4366 1 9 . 1 1 169 169 SER H H 169 8.600 8.600 8.465 0.135 19554 4367 1 9 . 1 1 170 170 ARG N N 170 129.620 129.620 121.824 7.796 19554 4368 1 9 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.430 0.280 19554 4369 1 9 . 1 1 170 170 ARG C C 170 177.870 177.870 177.318 0.552 19554 4370 1 9 . 1 1 170 170 ARG CA C 170 57.150 57.150 56.869 0.281 19554 4371 1 9 . 1 1 170 170 ARG H H 170 7.610 7.610 8.535 -0.925 19554 4372 1 9 . 1 1 171 171 ARG N N 171 122.230 122.230 120.040 2.190 19554 4373 1 9 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.265 -0.795 19554 4374 1 9 . 1 1 171 171 ARG C C 171 175.760 175.760 177.579 -1.819 19554 4375 1 9 . 1 1 171 171 ARG CA C 171 59.430 59.430 57.831 1.599 19554 4376 1 9 . 1 1 171 171 ARG CB C 171 30.410 30.410 30.377 0.034 19554 4377 1 9 . 1 1 171 171 ARG H H 171 8.260 8.260 8.473 -0.213 19554 4378 1 9 . 1 1 172 172 ALA N N 172 116.490 116.490 122.316 -5.826 19554 4379 1 9 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.271 -0.221 19554 4380 1 9 . 1 1 172 172 ALA C C 172 179.480 179.480 178.821 0.659 19554 4381 1 9 . 1 1 172 172 ALA CA C 172 54.010 54.010 54.377 -0.367 19554 4382 1 9 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.370 0.519 19554 4383 1 9 . 1 1 172 172 ALA H H 172 7.760 7.760 7.524 0.236 19554 4384 1 9 . 1 1 173 173 VAL N N 173 116.440 116.440 119.461 -3.021 19554 4385 1 9 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.865 -0.395 19554 4386 1 9 . 1 1 173 173 VAL C C 173 177.680 177.680 177.049 0.631 19554 4387 1 9 . 1 1 173 173 VAL CA C 173 65.080 65.080 64.061 1.019 19554 4388 1 9 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.270 0.610 19554 4389 1 9 . 1 1 173 173 VAL H H 173 7.210 7.210 8.073 -0.863 19554 4390 1 9 . 1 1 174 174 ILE N N 174 119.790 119.790 115.537 4.253 19554 4391 1 9 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.771 -0.091 19554 4392 1 9 . 1 1 174 174 ILE C C 174 178.310 178.310 177.058 1.252 19554 4393 1 9 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.227 -0.457 19554 4394 1 9 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.413 1.037 19554 4395 1 9 . 1 1 174 174 ILE H H 174 7.160 7.160 7.349 -0.189 19554 4396 1 9 . 1 1 175 175 GLU N N 175 117.810 117.810 118.241 -0.431 19554 4397 1 9 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.136 -0.106 19554 4398 1 9 . 1 1 175 175 GLU C C 175 177.170 177.170 178.143 -0.973 19554 4399 1 9 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.512 -1.322 19554 4400 1 9 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.729 -0.089 19554 4401 1 9 . 1 1 175 175 GLU H H 175 8.250 8.250 7.993 0.257 19554 4402 1 9 . 1 1 176 176 SER N N 176 114.300 114.300 114.970 -0.670 19554 4403 1 9 . 1 1 176 176 SER HA H 176 4.320 4.320 4.294 0.026 19554 4404 1 9 . 1 1 176 176 SER C C 176 174.930 174.930 176.909 -1.979 19554 4405 1 9 . 1 1 176 176 SER CA C 176 59.060 59.060 60.535 -1.475 19554 4406 1 9 . 1 1 176 176 SER CB C 176 63.640 63.640 62.820 0.820 19554 4407 1 9 . 1 1 176 176 SER H H 176 7.460 7.460 7.405 0.055 19554 4408 1 9 . 1 1 177 177 GLU N N 177 121.860 121.860 119.952 1.908 19554 4409 1 9 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.144 0.026 19554 4410 1 9 . 1 1 177 177 GLU C C 177 176.340 176.340 176.742 -0.402 19554 4411 1 9 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.846 -2.206 19554 4412 1 9 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.945 -0.195 19554 4413 1 9 . 1 1 177 177 GLU H H 177 7.890 7.890 8.189 -0.299 19554 4414 1 9 . 1 1 178 178 ASN N N 178 119.030 119.030 116.468 2.562 19554 4415 1 9 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.893 -0.193 19554 4416 1 9 . 1 1 178 178 ASN C C 178 174.230 174.230 174.943 -0.713 19554 4417 1 9 . 1 1 178 178 ASN CA C 178 53.010 53.010 52.003 1.007 19554 4418 1 9 . 1 1 178 178 ASN CB C 178 39.080 39.080 38.831 0.249 19554 4419 1 9 . 1 1 178 178 ASN H H 178 8.110 8.110 7.684 0.426 19554 4420 1 10 . 1 1 89 89 ALA HA H 89 4.160 4.160 3.961 0.199 19554 4421 1 10 . 1 1 89 89 ALA C C 89 179.720 179.720 179.882 -0.162 19554 4422 1 10 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.737 -0.247 19554 4423 1 10 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.173 0.047 19554 4424 1 10 . 1 1 90 90 LYS N N 90 119.500 119.500 116.936 2.564 19554 4425 1 10 . 1 1 90 90 LYS C C 90 179.090 179.090 178.954 0.136 19554 4426 1 10 . 1 1 90 90 LYS H H 90 7.980 7.980 8.334 -0.354 19554 4427 1 10 . 1 1 91 91 ARG N N 91 120.510 120.510 117.546 2.964 19554 4428 1 10 . 1 1 91 91 ARG HA H 91 4.150 4.150 4.206 -0.056 19554 4429 1 10 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.115 1.185 19554 4430 1 10 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.883 0.137 19554 4431 1 10 . 1 1 91 91 ARG H H 91 8.010 8.010 7.452 0.558 19554 4432 1 10 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.204 1.916 19554 4433 1 10 . 1 1 92 92 HIS C C 92 177.360 177.360 175.842 1.518 19554 4434 1 10 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.253 0.617 19554 4435 1 10 . 1 1 93 93 GLU N N 93 118.470 118.470 117.549 0.921 19554 4436 1 10 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.222 -0.322 19554 4437 1 10 . 1 1 93 93 GLU C C 93 178.740 178.740 177.793 0.947 19554 4438 1 10 . 1 1 93 93 GLU CA C 93 59.160 59.160 58.321 0.839 19554 4439 1 10 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.709 -0.749 19554 4440 1 10 . 1 1 93 93 GLU H H 93 8.190 8.190 7.805 0.385 19554 4441 1 10 . 1 1 94 94 ALA N N 94 123.080 123.080 123.120 -0.040 19554 4442 1 10 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.286 -0.216 19554 4443 1 10 . 1 1 94 94 ALA C C 94 180.330 180.330 179.910 0.420 19554 4444 1 10 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.227 0.713 19554 4445 1 10 . 1 1 94 94 ALA CB C 94 18.250 18.250 17.904 0.346 19554 4446 1 10 . 1 1 94 94 ALA H H 94 8.090 8.090 7.405 0.685 19554 4447 1 10 . 1 1 95 95 TRP N N 95 119.190 119.190 119.627 -0.437 19554 4448 1 10 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.390 -0.350 19554 4449 1 10 . 1 1 95 95 TRP C C 95 178.590 178.590 177.755 0.835 19554 4450 1 10 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.843 2.157 19554 4451 1 10 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.801 1.359 19554 4452 1 10 . 1 1 95 95 TRP H H 95 8.060 8.060 7.643 0.417 19554 4453 1 10 . 1 1 96 96 ILE N N 96 119.570 119.570 115.477 4.093 19554 4454 1 10 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.731 0.079 19554 4455 1 10 . 1 1 96 96 ILE C C 96 179.300 179.300 177.415 1.885 19554 4456 1 10 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.649 -0.109 19554 4457 1 10 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.445 -0.315 19554 4458 1 10 . 1 1 96 96 ILE H H 96 7.850 7.850 7.395 0.455 19554 4459 1 10 . 1 1 97 97 THR N N 97 117.030 117.030 111.580 5.450 19554 4460 1 10 . 1 1 97 97 THR HA H 97 3.830 3.830 4.281 -0.451 19554 4461 1 10 . 1 1 97 97 THR C C 97 177.080 177.080 176.246 0.834 19554 4462 1 10 . 1 1 97 97 THR CA C 97 66.430 66.430 64.474 1.956 19554 4463 1 10 . 1 1 97 97 THR CB C 97 68.450 68.450 69.790 -1.340 19554 4464 1 10 . 1 1 97 97 THR H H 97 7.900 7.900 7.946 -0.046 19554 4465 1 10 . 1 1 98 98 LEU N N 98 123.110 123.110 123.730 -0.620 19554 4466 1 10 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.169 -0.239 19554 4467 1 10 . 1 1 98 98 LEU C C 98 178.160 178.160 177.884 0.276 19554 4468 1 10 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.399 0.331 19554 4469 1 10 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.629 -0.089 19554 4470 1 10 . 1 1 98 98 LEU H H 98 7.830 7.830 7.605 0.225 19554 4471 1 10 . 1 1 99 99 GLU N N 99 120.520 120.520 119.098 1.422 19554 4472 1 10 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.007 -0.127 19554 4473 1 10 . 1 1 99 99 GLU C C 99 179.010 179.010 179.387 -0.377 19554 4474 1 10 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.481 0.439 19554 4475 1 10 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.263 0.087 19554 4476 1 10 . 1 1 99 99 GLU H H 99 8.560 8.560 7.958 0.602 19554 4477 1 10 . 1 1 100 100 LYS N N 100 119.950 119.950 118.229 1.721 19554 4478 1 10 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.198 -0.168 19554 4479 1 10 . 1 1 100 100 LYS C C 100 177.870 177.870 178.805 -0.935 19554 4480 1 10 . 1 1 100 100 LYS CA C 100 58.570 58.570 57.908 0.662 19554 4481 1 10 . 1 1 100 100 LYS CB C 100 31.720 31.720 31.616 0.104 19554 4482 1 10 . 1 1 100 100 LYS H H 100 7.800 7.800 8.094 -0.294 19554 4483 1 10 . 1 1 101 101 ALA N N 101 120.690 120.690 123.121 -2.431 19554 4484 1 10 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.089 -0.069 19554 4485 1 10 . 1 1 101 101 ALA C C 101 180.990 180.990 178.872 2.118 19554 4486 1 10 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.833 0.287 19554 4487 1 10 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.112 -0.532 19554 4488 1 10 . 1 1 101 101 ALA H H 101 7.800 7.800 7.665 0.135 19554 4489 1 10 . 1 1 102 102 TYR N N 102 118.440 118.440 119.840 -1.400 19554 4490 1 10 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.178 0.142 19554 4491 1 10 . 1 1 102 102 TYR C C 102 178.590 178.590 177.738 0.852 19554 4492 1 10 . 1 1 102 102 TYR CA C 102 59.810 59.810 59.685 0.125 19554 4493 1 10 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.879 0.811 19554 4494 1 10 . 1 1 102 102 TYR H H 102 8.580 8.580 7.826 0.754 19554 4495 1 10 . 1 1 103 103 GLU N N 103 120.860 120.860 118.735 2.125 19554 4496 1 10 . 1 1 103 103 GLU HA H 103 3.590 3.590 3.831 -0.241 19554 4497 1 10 . 1 1 103 103 GLU C C 103 178.100 178.100 177.304 0.796 19554 4498 1 10 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.689 0.391 19554 4499 1 10 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.466 -0.046 19554 4500 1 10 . 1 1 103 103 GLU H H 103 8.290 8.290 7.597 0.693 19554 4501 1 10 . 1 1 104 104 ASP N N 104 116.120 116.120 116.888 -0.768 19554 4502 1 10 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.575 0.035 19554 4503 1 10 . 1 1 104 104 ASP C C 104 174.970 174.970 175.285 -0.315 19554 4504 1 10 . 1 1 104 104 ASP CA C 104 54.120 54.120 54.123 -0.003 19554 4505 1 10 . 1 1 104 104 ASP CB C 104 40.480 40.480 41.934 -1.454 19554 4506 1 10 . 1 1 104 104 ASP H H 104 8.120 8.120 7.898 0.222 19554 4507 1 10 . 1 1 105 105 ALA N N 105 123.330 123.330 120.318 3.012 19554 4508 1 10 . 1 1 105 105 ALA HA H 105 4.150 4.150 3.990 0.160 19554 4509 1 10 . 1 1 105 105 ALA C C 105 177.130 177.130 176.039 1.091 19554 4510 1 10 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.701 -0.061 19554 4511 1 10 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.989 -0.689 19554 4512 1 10 . 1 1 105 105 ALA H H 105 7.710 7.710 7.308 0.402 19554 4513 1 10 . 1 1 106 106 GLU N N 106 118.950 118.950 117.872 1.078 19554 4514 1 10 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.251 0.049 19554 4515 1 10 . 1 1 106 106 GLU C C 106 176.730 176.730 176.329 0.401 19554 4516 1 10 . 1 1 106 106 GLU CA C 106 55.440 55.440 57.008 -1.568 19554 4517 1 10 . 1 1 106 106 GLU CB C 106 31.760 31.760 30.811 0.949 19554 4518 1 10 . 1 1 106 106 GLU H H 106 8.440 8.440 8.247 0.193 19554 4519 1 10 . 1 1 107 107 THR N N 107 118.780 118.780 115.082 3.698 19554 4520 1 10 . 1 1 107 107 THR HA H 107 4.550 4.550 4.401 0.149 19554 4521 1 10 . 1 1 107 107 THR C C 107 174.250 174.250 174.097 0.153 19554 4522 1 10 . 1 1 107 107 THR CA C 107 62.360 62.360 61.011 1.349 19554 4523 1 10 . 1 1 107 107 THR CB C 107 69.390 69.390 69.328 0.062 19554 4524 1 10 . 1 1 107 107 THR H H 107 8.740 8.740 8.164 0.576 19554 4525 1 10 . 1 1 108 108 VAL N N 108 120.540 120.540 118.555 1.985 19554 4526 1 10 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.670 -0.040 19554 4527 1 10 . 1 1 108 108 VAL C C 108 174.440 174.440 173.582 0.858 19554 4528 1 10 . 1 1 108 108 VAL CA C 108 59.000 59.000 60.363 -1.363 19554 4529 1 10 . 1 1 108 108 VAL CB C 108 34.650 34.650 34.525 0.125 19554 4530 1 10 . 1 1 108 108 VAL H H 108 9.040 9.040 8.362 0.678 19554 4531 1 10 . 1 1 109 109 THR N N 109 115.100 115.100 114.621 0.479 19554 4532 1 10 . 1 1 109 109 THR HA H 109 5.380 5.380 4.568 0.812 19554 4533 1 10 . 1 1 109 109 THR C C 109 174.580 174.580 173.727 0.853 19554 4534 1 10 . 1 1 109 109 THR CA C 109 60.410 60.410 61.217 -0.807 19554 4535 1 10 . 1 1 109 109 THR CB C 109 70.610 70.610 70.347 0.263 19554 4536 1 10 . 1 1 109 109 THR H H 109 8.170 8.170 8.229 -0.059 19554 4537 1 10 . 1 1 110 110 GLY N N 110 108.580 108.580 114.591 -6.011 19554 4538 1 10 . 1 1 110 110 GLY C C 110 170.810 170.810 172.218 -1.408 19554 4539 1 10 . 1 1 110 110 GLY CA C 110 45.380 45.380 44.339 1.042 19554 4540 1 10 . 1 1 110 110 GLY H H 110 8.780 8.780 8.026 0.754 19554 4541 1 10 . 1 1 111 111 VAL N N 111 116.930 116.930 121.897 -4.967 19554 4542 1 10 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.626 0.154 19554 4543 1 10 . 1 1 111 111 VAL C C 111 176.060 176.060 176.007 0.053 19554 4544 1 10 . 1 1 111 111 VAL CA C 111 59.770 59.770 61.213 -1.443 19554 4545 1 10 . 1 1 111 111 VAL CB C 111 35.750 35.750 35.388 0.362 19554 4546 1 10 . 1 1 111 111 VAL H H 111 7.810 7.810 7.711 0.099 19554 4547 1 10 . 1 1 112 112 ILE N N 112 127.060 127.060 128.256 -1.196 19554 4548 1 10 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.103 0.127 19554 4549 1 10 . 1 1 112 112 ILE C C 112 176.180 176.180 175.384 0.796 19554 4550 1 10 . 1 1 112 112 ILE CA C 112 62.220 62.220 63.224 -1.004 19554 4551 1 10 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.495 0.985 19554 4552 1 10 . 1 1 112 112 ILE H H 112 9.240 9.240 8.121 1.119 19554 4553 1 10 . 1 1 113 113 ASN N N 113 127.510 127.510 125.842 1.668 19554 4554 1 10 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.778 0.162 19554 4555 1 10 . 1 1 113 113 ASN C C 113 175.020 175.020 175.416 -0.396 19554 4556 1 10 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.221 -0.931 19554 4557 1 10 . 1 1 113 113 ASN CB C 113 39.580 39.580 40.586 -1.006 19554 4558 1 10 . 1 1 113 113 ASN H H 113 9.010 9.010 8.075 0.935 19554 4559 1 10 . 1 1 114 114 GLY N N 114 107.150 107.150 108.009 -0.859 19554 4560 1 10 . 1 1 114 114 GLY C C 114 171.360 171.360 172.197 -0.837 19554 4561 1 10 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.440 1.080 19554 4562 1 10 . 1 1 114 114 GLY H H 114 7.620 7.620 7.540 0.080 19554 4563 1 10 . 1 1 115 115 LYS N N 115 121.670 121.670 122.138 -0.468 19554 4564 1 10 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.357 0.233 19554 4565 1 10 . 1 1 115 115 LYS C C 115 175.950 175.950 174.821 1.129 19554 4566 1 10 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.714 1.226 19554 4567 1 10 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.139 -0.099 19554 4568 1 10 . 1 1 115 115 LYS H H 115 8.550 8.550 8.198 0.352 19554 4569 1 10 . 1 1 116 116 VAL N N 116 118.750 118.750 119.163 -0.413 19554 4570 1 10 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.408 0.062 19554 4571 1 10 . 1 1 116 116 VAL C C 116 175.110 175.110 175.000 0.110 19554 4572 1 10 . 1 1 116 116 VAL CA C 116 59.030 59.030 58.854 0.176 19554 4573 1 10 . 1 1 116 116 VAL CB C 116 35.500 35.500 34.303 1.197 19554 4574 1 10 . 1 1 116 116 VAL H H 116 8.070 8.070 7.856 0.214 19554 4575 1 10 . 1 1 117 117 LYS N N 117 122.520 122.520 122.145 0.375 19554 4576 1 10 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.081 -0.151 19554 4577 1 10 . 1 1 117 117 LYS C C 117 177.970 177.970 177.068 0.902 19554 4578 1 10 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.154 1.516 19554 4579 1 10 . 1 1 117 117 LYS CB C 117 30.940 30.940 30.790 0.150 19554 4580 1 10 . 1 1 117 117 LYS H H 117 8.250 8.250 8.470 -0.220 19554 4581 1 10 . 1 1 118 118 GLY N N 118 113.440 113.440 112.156 1.284 19554 4582 1 10 . 1 1 118 118 GLY C C 118 175.540 175.540 174.239 1.301 19554 4583 1 10 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.032 0.168 19554 4584 1 10 . 1 1 118 118 GLY H H 118 8.820 8.820 8.133 0.687 19554 4585 1 10 . 1 1 119 119 GLY N N 119 109.130 109.130 106.292 2.838 19554 4586 1 10 . 1 1 119 119 GLY C C 119 170.530 170.530 172.086 -1.556 19554 4587 1 10 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.395 3.445 19554 4588 1 10 . 1 1 119 119 GLY H H 119 7.930 7.930 7.502 0.428 19554 4589 1 10 . 1 1 120 120 PHE N N 120 123.370 123.370 117.306 6.064 19554 4590 1 10 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.580 0.690 19554 4591 1 10 . 1 1 120 120 PHE C C 120 174.260 174.260 174.322 -0.062 19554 4592 1 10 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.168 -0.828 19554 4593 1 10 . 1 1 120 120 PHE CB C 120 43.730 43.730 42.933 0.797 19554 4594 1 10 . 1 1 120 120 PHE H H 120 8.820 8.820 7.242 1.578 19554 4595 1 10 . 1 1 121 121 THR N N 121 114.670 114.670 119.040 -4.370 19554 4596 1 10 . 1 1 121 121 THR HA H 121 5.000 5.000 5.057 -0.057 19554 4597 1 10 . 1 1 121 121 THR C C 121 173.780 173.780 173.917 -0.137 19554 4598 1 10 . 1 1 121 121 THR CA C 121 60.500 60.500 60.950 -0.450 19554 4599 1 10 . 1 1 121 121 THR CB C 121 69.910 69.910 70.091 -0.181 19554 4600 1 10 . 1 1 121 121 THR H H 121 8.670 8.670 8.725 -0.055 19554 4601 1 10 . 1 1 122 122 VAL N N 122 124.340 124.340 120.653 3.687 19554 4602 1 10 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.418 0.182 19554 4603 1 10 . 1 1 122 122 VAL C C 122 174.240 174.240 174.075 0.165 19554 4604 1 10 . 1 1 122 122 VAL CA C 122 59.300 59.300 61.146 -1.846 19554 4605 1 10 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.661 0.199 19554 4606 1 10 . 1 1 122 122 VAL H H 122 8.560 8.560 8.067 0.493 19554 4607 1 10 . 1 1 123 123 GLU N N 123 126.950 126.950 126.268 0.682 19554 4608 1 10 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.930 -0.320 19554 4609 1 10 . 1 1 123 123 GLU C C 123 175.840 175.840 175.608 0.232 19554 4610 1 10 . 1 1 123 123 GLU CA C 123 55.160 55.160 55.015 0.145 19554 4611 1 10 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.871 0.039 19554 4612 1 10 . 1 1 123 123 GLU H H 123 8.950 8.950 8.470 0.480 19554 4613 1 10 . 1 1 124 124 LEU N N 124 129.580 129.580 128.573 1.007 19554 4614 1 10 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.652 0.008 19554 4615 1 10 . 1 1 124 124 LEU C C 124 175.350 175.350 176.304 -0.954 19554 4616 1 10 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.637 -0.437 19554 4617 1 10 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.397 0.793 19554 4618 1 10 . 1 1 124 124 LEU H H 124 8.940 8.940 8.910 0.030 19554 4619 1 10 . 1 1 125 125 ASN N N 125 121.880 121.880 120.111 1.769 19554 4620 1 10 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.382 -0.192 19554 4621 1 10 . 1 1 125 125 ASN C C 125 174.690 174.690 175.415 -0.725 19554 4622 1 10 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.071 -0.191 19554 4623 1 10 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.029 0.221 19554 4624 1 10 . 1 1 125 125 ASN H H 125 8.950 8.950 8.607 0.343 19554 4625 1 10 . 1 1 126 126 GLY N N 126 103.140 103.140 103.309 -0.169 19554 4626 1 10 . 1 1 126 126 GLY C C 126 173.680 173.680 174.382 -0.702 19554 4627 1 10 . 1 1 126 126 GLY CA C 126 44.880 44.880 44.972 -0.092 19554 4628 1 10 . 1 1 126 126 GLY H H 126 8.070 8.070 8.241 -0.171 19554 4629 1 10 . 1 1 127 127 ILE N N 127 122.120 122.120 122.167 -0.047 19554 4630 1 10 . 1 1 127 127 ILE HA H 127 3.970 3.970 4.081 -0.111 19554 4631 1 10 . 1 1 127 127 ILE C C 127 174.370 174.370 175.372 -1.002 19554 4632 1 10 . 1 1 127 127 ILE CA C 127 59.530 59.530 59.841 -0.311 19554 4633 1 10 . 1 1 127 127 ILE CB C 127 38.970 38.970 37.987 0.983 19554 4634 1 10 . 1 1 127 127 ILE H H 127 7.380 7.380 7.484 -0.104 19554 4635 1 10 . 1 1 128 128 ARG N N 128 126.630 126.630 124.010 2.620 19554 4636 1 10 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.263 -0.623 19554 4637 1 10 . 1 1 128 128 ARG C C 128 174.720 174.720 175.109 -0.389 19554 4638 1 10 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.923 0.727 19554 4639 1 10 . 1 1 128 128 ARG CB C 128 31.000 31.000 32.761 -1.761 19554 4640 1 10 . 1 1 128 128 ARG H H 128 8.170 8.170 8.517 -0.347 19554 4641 1 10 . 1 1 129 129 ALA N N 129 127.320 127.320 125.854 1.466 19554 4642 1 10 . 1 1 129 129 ALA HA H 129 4.850 4.850 5.049 -0.199 19554 4643 1 10 . 1 1 129 129 ALA C C 129 174.970 174.970 175.132 -0.162 19554 4644 1 10 . 1 1 129 129 ALA CA C 129 49.660 49.660 49.565 0.096 19554 4645 1 10 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.784 2.606 19554 4646 1 10 . 1 1 129 129 ALA H H 129 9.240 9.240 8.417 0.823 19554 4647 1 10 . 1 1 130 130 PHE N N 130 121.060 121.060 118.625 2.435 19554 4648 1 10 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.383 -0.223 19554 4649 1 10 . 1 1 130 130 PHE C C 130 172.430 172.430 173.739 -1.309 19554 4650 1 10 . 1 1 130 130 PHE CA C 130 55.000 55.000 56.793 -1.793 19554 4651 1 10 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.823 -0.423 19554 4652 1 10 . 1 1 130 130 PHE H H 130 8.660 8.660 8.329 0.331 19554 4653 1 10 . 1 1 131 131 LEU N N 131 130.250 130.250 123.032 7.218 19554 4654 1 10 . 1 1 131 131 LEU HA H 131 4.980 4.980 5.167 -0.187 19554 4655 1 10 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.189 -1.519 19554 4656 1 10 . 1 1 131 131 LEU CB C 131 44.330 44.330 43.679 0.651 19554 4657 1 10 . 1 1 131 131 LEU H H 131 8.550 8.550 7.971 0.579 19554 4658 1 10 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.573 -0.573 19554 4659 1 10 . 1 1 132 132 PRO C C 132 179.380 179.380 178.060 1.320 19554 4660 1 10 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.740 -0.580 19554 4661 1 10 . 1 1 133 133 GLY N N 133 111.470 111.470 109.608 1.862 19554 4662 1 10 . 1 1 133 133 GLY C C 133 175.590 175.590 176.466 -0.876 19554 4663 1 10 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.624 0.906 19554 4664 1 10 . 1 1 133 133 GLY H H 133 9.140 9.140 8.466 0.674 19554 4665 1 10 . 1 1 134 134 SER HA H 134 4.350 4.350 4.200 0.150 19554 4666 1 10 . 1 1 134 134 SER C C 134 175.280 175.280 175.036 0.244 19554 4667 1 10 . 1 1 134 134 SER CA C 134 59.210 59.210 61.212 -2.002 19554 4668 1 10 . 1 1 134 134 SER CB C 134 62.730 62.730 63.226 -0.496 19554 4669 1 10 . 1 1 135 135 LEU N N 135 118.770 118.770 118.863 -0.093 19554 4670 1 10 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.528 0.052 19554 4671 1 10 . 1 1 135 135 LEU C C 135 177.500 177.500 176.487 1.013 19554 4672 1 10 . 1 1 135 135 LEU CA C 135 53.770 53.770 54.223 -0.453 19554 4673 1 10 . 1 1 135 135 LEU H H 135 8.030 8.030 7.455 0.575 19554 4674 1 10 . 1 1 136 136 VAL N N 136 123.080 123.080 117.840 5.240 19554 4675 1 10 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.161 -0.551 19554 4676 1 10 . 1 1 136 136 VAL C C 136 173.150 173.150 175.499 -2.349 19554 4677 1 10 . 1 1 136 136 VAL CA C 136 65.220 65.220 62.534 2.686 19554 4678 1 10 . 1 1 136 136 VAL CB C 136 32.020 32.020 33.930 -1.910 19554 4679 1 10 . 1 1 136 136 VAL H H 136 7.550 7.550 7.972 -0.422 19554 4680 1 10 . 1 1 137 137 ASP N N 137 117.300 117.300 121.995 -4.695 19554 4681 1 10 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.792 -0.452 19554 4682 1 10 . 1 1 137 137 ASP C C 137 174.840 174.840 175.874 -1.034 19554 4683 1 10 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.900 -1.830 19554 4684 1 10 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.704 2.756 19554 4685 1 10 . 1 1 137 137 ASP H H 137 7.940 7.940 7.783 0.157 19554 4686 1 10 . 1 1 138 138 VAL N N 138 116.750 116.750 122.557 -5.807 19554 4687 1 10 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.383 -0.243 19554 4688 1 10 . 1 1 138 138 VAL CA C 138 61.190 61.190 61.173 0.017 19554 4689 1 10 . 1 1 138 138 VAL CB C 138 33.330 33.330 34.165 -0.835 19554 4690 1 10 . 1 1 138 138 VAL H H 138 10.000 10.000 8.173 1.827 19554 4691 1 10 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.466 0.044 19554 4692 1 10 . 1 1 140 140 PRO C C 140 175.860 175.860 176.114 -0.254 19554 4693 1 10 . 1 1 141 141 VAL N N 141 124.910 124.910 117.065 7.845 19554 4694 1 10 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.562 -0.662 19554 4695 1 10 . 1 1 141 141 VAL C C 141 175.120 175.120 175.114 0.006 19554 4696 1 10 . 1 1 141 141 VAL CA C 141 62.720 62.720 60.913 1.807 19554 4697 1 10 . 1 1 141 141 VAL CB C 141 31.870 31.870 34.190 -2.320 19554 4698 1 10 . 1 1 141 141 VAL H H 141 8.110 8.110 8.003 0.107 19554 4699 1 10 . 1 1 142 142 ARG N N 142 119.730 119.730 123.320 -3.590 19554 4700 1 10 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.600 0.020 19554 4701 1 10 . 1 1 142 142 ARG C C 142 173.520 173.520 175.453 -1.933 19554 4702 1 10 . 1 1 142 142 ARG CA C 142 53.020 53.020 56.266 -3.246 19554 4703 1 10 . 1 1 142 142 ARG CB C 142 30.480 30.480 31.243 -0.763 19554 4704 1 10 . 1 1 142 142 ARG H H 142 7.440 7.440 8.680 -1.240 19554 4705 1 10 . 1 1 143 143 ASP N N 143 119.780 119.780 118.246 1.534 19554 4706 1 10 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.736 -0.066 19554 4707 1 10 . 1 1 143 143 ASP C C 143 175.970 175.970 174.951 1.019 19554 4708 1 10 . 1 1 143 143 ASP CA C 143 54.030 54.030 53.388 0.642 19554 4709 1 10 . 1 1 143 143 ASP CB C 143 41.730 41.730 42.705 -0.975 19554 4710 1 10 . 1 1 143 143 ASP H H 143 7.880 7.880 7.717 0.163 19554 4711 1 10 . 1 1 144 144 THR N N 144 110.060 110.060 111.453 -1.393 19554 4712 1 10 . 1 1 144 144 THR HA H 144 4.110 4.110 4.636 -0.526 19554 4713 1 10 . 1 1 144 144 THR C C 144 175.730 175.730 175.223 0.507 19554 4714 1 10 . 1 1 144 144 THR CA C 144 61.520 61.520 62.460 -0.940 19554 4715 1 10 . 1 1 144 144 THR CB C 144 68.610 68.610 69.403 -0.793 19554 4716 1 10 . 1 1 144 144 THR H H 144 8.030 8.030 8.291 -0.261 19554 4717 1 10 . 1 1 145 145 LEU N N 145 124.820 124.820 121.607 3.213 19554 4718 1 10 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.469 0.231 19554 4719 1 10 . 1 1 145 145 LEU C C 145 178.010 178.010 177.729 0.281 19554 4720 1 10 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.251 1.099 19554 4721 1 10 . 1 1 145 145 LEU CB C 145 42.100 42.100 41.593 0.507 19554 4722 1 10 . 1 1 145 145 LEU H H 145 8.050 8.050 7.912 0.138 19554 4723 1 10 . 1 1 146 146 HIS N N 146 116.310 116.310 115.950 0.360 19554 4724 1 10 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.485 0.055 19554 4725 1 10 . 1 1 146 146 HIS C C 146 175.000 175.000 176.108 -1.108 19554 4726 1 10 . 1 1 146 146 HIS H H 146 8.120 8.120 8.479 -0.359 19554 4727 1 10 . 1 1 147 147 LEU N N 147 120.320 120.320 119.726 0.594 19554 4728 1 10 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.616 0.454 19554 4729 1 10 . 1 1 147 147 LEU C C 147 176.810 176.810 176.828 -0.018 19554 4730 1 10 . 1 1 147 147 LEU CA C 147 54.710 54.710 56.817 -2.107 19554 4731 1 10 . 1 1 147 147 LEU CB C 147 41.960 41.960 42.261 -0.301 19554 4732 1 10 . 1 1 147 147 LEU H H 147 7.620 7.620 8.005 -0.385 19554 4733 1 10 . 1 1 148 148 GLU N N 148 118.950 118.950 116.169 2.781 19554 4734 1 10 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.376 -0.596 19554 4735 1 10 . 1 1 148 148 GLU C C 148 177.480 177.480 176.298 1.182 19554 4736 1 10 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.774 2.656 19554 4737 1 10 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.547 -1.867 19554 4738 1 10 . 1 1 148 148 GLU H H 148 7.760 7.760 7.453 0.307 19554 4739 1 10 . 1 1 149 149 GLY N N 149 111.070 111.070 110.623 0.447 19554 4740 1 10 . 1 1 149 149 GLY C C 149 173.820 173.820 174.709 -0.889 19554 4741 1 10 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.263 0.267 19554 4742 1 10 . 1 1 149 149 GLY H H 149 8.630 8.630 8.351 0.279 19554 4743 1 10 . 1 1 150 150 LYS N N 150 119.380 119.380 122.907 -3.527 19554 4744 1 10 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.121 0.209 19554 4745 1 10 . 1 1 150 150 LYS C C 150 175.110 175.110 175.908 -0.798 19554 4746 1 10 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.956 -1.786 19554 4747 1 10 . 1 1 150 150 LYS CB C 150 33.550 33.550 32.942 0.608 19554 4748 1 10 . 1 1 150 150 LYS H H 150 7.520 7.520 8.185 -0.665 19554 4749 1 10 . 1 1 151 151 GLU N N 151 122.850 122.850 124.459 -1.609 19554 4750 1 10 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.525 -0.055 19554 4751 1 10 . 1 1 151 151 GLU C C 151 175.510 175.510 175.117 0.393 19554 4752 1 10 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.872 0.468 19554 4753 1 10 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.357 0.653 19554 4754 1 10 . 1 1 151 151 GLU H H 151 8.410 8.410 8.505 -0.095 19554 4755 1 10 . 1 1 152 152 LEU N N 152 127.520 127.520 125.457 2.063 19554 4756 1 10 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.451 0.089 19554 4757 1 10 . 1 1 152 152 LEU C C 152 173.750 173.750 174.515 -0.765 19554 4758 1 10 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.003 -0.183 19554 4759 1 10 . 1 1 152 152 LEU H H 152 8.850 8.850 7.736 1.114 19554 4760 1 10 . 1 1 153 153 GLU N N 153 116.500 116.500 117.869 -1.369 19554 4761 1 10 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.439 0.141 19554 4762 1 10 . 1 1 153 153 GLU C C 153 175.120 175.120 173.847 1.273 19554 4763 1 10 . 1 1 153 153 GLU CA C 153 55.160 55.160 54.721 0.439 19554 4764 1 10 . 1 1 153 153 GLU H H 153 7.110 7.110 7.613 -0.503 19554 4765 1 10 . 1 1 154 154 PHE N N 154 115.150 115.150 120.653 -5.503 19554 4766 1 10 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.803 0.057 19554 4767 1 10 . 1 1 154 154 PHE C C 154 175.630 175.630 174.362 1.268 19554 4768 1 10 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.331 0.859 19554 4769 1 10 . 1 1 154 154 PHE CB C 154 44.250 44.250 41.817 2.433 19554 4770 1 10 . 1 1 154 154 PHE H H 154 8.910 8.910 8.343 0.567 19554 4771 1 10 . 1 1 155 155 LYS N N 155 114.560 114.560 118.618 -4.058 19554 4772 1 10 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.629 0.081 19554 4773 1 10 . 1 1 155 155 LYS C C 155 176.500 176.500 175.904 0.596 19554 4774 1 10 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.317 -1.717 19554 4775 1 10 . 1 1 155 155 LYS CB C 155 33.960 33.960 36.351 -2.391 19554 4776 1 10 . 1 1 155 155 LYS H H 155 8.100 8.100 8.564 -0.464 19554 4777 1 10 . 1 1 156 156 VAL N N 156 124.530 124.530 123.892 0.638 19554 4778 1 10 . 1 1 156 156 VAL C C 156 175.630 175.630 175.899 -0.269 19554 4779 1 10 . 1 1 156 156 VAL CA C 156 62.690 62.690 62.002 0.688 19554 4780 1 10 . 1 1 156 156 VAL CB C 156 31.600 31.600 29.298 2.302 19554 4781 1 10 . 1 1 156 156 VAL H H 156 9.920 9.920 8.293 1.627 19554 4782 1 10 . 1 1 157 157 ILE N N 157 119.590 119.590 128.126 -8.536 19554 4783 1 10 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.009 0.711 19554 4784 1 10 . 1 1 157 157 ILE C C 157 176.190 176.190 175.865 0.325 19554 4785 1 10 . 1 1 157 157 ILE CA C 157 61.050 61.050 63.358 -2.308 19554 4786 1 10 . 1 1 157 157 ILE CB C 157 39.170 39.170 38.648 0.522 19554 4787 1 10 . 1 1 157 157 ILE H H 157 8.530 8.530 8.059 0.471 19554 4788 1 10 . 1 1 158 158 LYS N N 158 122.460 122.460 115.273 7.187 19554 4789 1 10 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.240 -0.040 19554 4790 1 10 . 1 1 158 158 LYS C C 158 173.000 173.000 173.738 -0.738 19554 4791 1 10 . 1 1 158 158 LYS CA C 158 56.800 56.800 55.849 0.951 19554 4792 1 10 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.458 1.182 19554 4793 1 10 . 1 1 158 158 LYS H H 158 7.600 7.600 7.474 0.126 19554 4794 1 10 . 1 1 159 159 LEU N N 159 125.430 125.430 117.638 7.792 19554 4795 1 10 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.633 -0.013 19554 4796 1 10 . 1 1 159 159 LEU C C 159 174.390 174.390 175.263 -0.873 19554 4797 1 10 . 1 1 159 159 LEU CA C 159 54.510 54.510 53.818 0.692 19554 4798 1 10 . 1 1 159 159 LEU H H 159 7.950 7.950 8.103 -0.153 19554 4799 1 10 . 1 1 160 160 ASP N N 160 124.740 124.740 122.395 2.345 19554 4800 1 10 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.411 0.259 19554 4801 1 10 . 1 1 160 160 ASP C C 160 176.020 176.020 176.380 -0.360 19554 4802 1 10 . 1 1 160 160 ASP CA C 160 52.620 52.620 54.199 -1.579 19554 4803 1 10 . 1 1 160 160 ASP CB C 160 42.050 42.050 39.785 2.265 19554 4804 1 10 . 1 1 160 160 ASP H H 160 8.760 8.760 8.330 0.430 19554 4805 1 10 . 1 1 161 161 GLN N N 161 126.490 126.490 123.844 2.646 19554 4806 1 10 . 1 1 161 161 GLN HA H 161 3.120 3.120 3.884 -0.764 19554 4807 1 10 . 1 1 161 161 GLN C C 161 178.280 178.280 177.704 0.576 19554 4808 1 10 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.755 0.015 19554 4809 1 10 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.636 -0.796 19554 4810 1 10 . 1 1 161 161 GLN H H 161 9.110 9.110 8.059 1.051 19554 4811 1 10 . 1 1 162 162 LYS N N 162 119.150 119.150 120.442 -1.292 19554 4812 1 10 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.071 -0.271 19554 4813 1 10 . 1 1 162 162 LYS C C 162 177.900 177.900 177.607 0.293 19554 4814 1 10 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.392 0.308 19554 4815 1 10 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.329 -0.939 19554 4816 1 10 . 1 1 162 162 LYS H H 162 8.070 8.070 8.233 -0.163 19554 4817 1 10 . 1 1 163 163 ARG N N 163 114.850 114.850 116.135 -1.285 19554 4818 1 10 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.466 -0.316 19554 4819 1 10 . 1 1 163 163 ARG C C 163 174.750 174.750 175.228 -0.478 19554 4820 1 10 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.401 -0.601 19554 4821 1 10 . 1 1 163 163 ARG H H 163 7.010 7.010 7.508 -0.498 19554 4822 1 10 . 1 1 164 164 ASN N N 164 117.810 117.810 118.118 -0.308 19554 4823 1 10 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.339 -0.209 19554 4824 1 10 . 1 1 164 164 ASN C C 164 173.880 173.880 173.815 0.065 19554 4825 1 10 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.938 -0.979 19554 4826 1 10 . 1 1 164 164 ASN CB C 164 37.530 37.530 38.062 -0.532 19554 4827 1 10 . 1 1 164 164 ASN H H 164 7.750 7.750 8.091 -0.341 19554 4828 1 10 . 1 1 165 165 ASN N N 165 116.170 116.170 116.661 -0.491 19554 4829 1 10 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.767 0.293 19554 4830 1 10 . 1 1 165 165 ASN C C 165 172.990 172.990 173.277 -0.287 19554 4831 1 10 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.658 -0.218 19554 4832 1 10 . 1 1 165 165 ASN CB C 165 41.820 41.820 41.608 0.212 19554 4833 1 10 . 1 1 165 165 ASN H H 165 8.020 8.020 7.705 0.315 19554 4834 1 10 . 1 1 166 166 VAL N N 166 124.790 124.790 121.212 3.578 19554 4835 1 10 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.278 0.222 19554 4836 1 10 . 1 1 166 166 VAL C C 166 174.190 174.190 173.670 0.520 19554 4837 1 10 . 1 1 166 166 VAL CA C 166 61.030 61.030 59.690 1.341 19554 4838 1 10 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.197 0.423 19554 4839 1 10 . 1 1 166 166 VAL H H 166 8.380 8.380 7.828 0.552 19554 4840 1 10 . 1 1 167 167 VAL N N 167 128.000 128.000 121.719 6.281 19554 4841 1 10 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.618 0.632 19554 4842 1 10 . 1 1 167 167 VAL C C 167 176.000 176.000 173.440 2.560 19554 4843 1 10 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.659 0.951 19554 4844 1 10 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.416 -0.516 19554 4845 1 10 . 1 1 167 167 VAL H H 167 8.710 8.710 7.822 0.888 19554 4846 1 10 . 1 1 168 168 VAL N N 168 118.360 118.360 114.320 4.040 19554 4847 1 10 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.711 0.529 19554 4848 1 10 . 1 1 168 168 VAL C C 168 172.800 172.800 175.083 -2.283 19554 4849 1 10 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.166 -1.306 19554 4850 1 10 . 1 1 168 168 VAL CB C 168 35.350 35.350 34.049 1.301 19554 4851 1 10 . 1 1 168 168 VAL H H 168 8.560 8.560 8.157 0.403 19554 4852 1 10 . 1 1 169 169 SER N N 169 106.720 106.720 115.939 -9.219 19554 4853 1 10 . 1 1 169 169 SER HA H 169 4.480 4.480 4.710 -0.230 19554 4854 1 10 . 1 1 169 169 SER C C 169 175.950 175.950 174.946 1.004 19554 4855 1 10 . 1 1 169 169 SER CA C 169 55.550 55.550 56.571 -1.021 19554 4856 1 10 . 1 1 169 169 SER CB C 169 64.980 64.980 64.703 0.277 19554 4857 1 10 . 1 1 169 169 SER H H 169 8.600 8.600 8.483 0.117 19554 4858 1 10 . 1 1 170 170 ARG N N 170 129.620 129.620 122.347 7.273 19554 4859 1 10 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.224 0.486 19554 4860 1 10 . 1 1 170 170 ARG C C 170 177.870 177.870 178.710 -0.840 19554 4861 1 10 . 1 1 170 170 ARG CA C 170 57.150 57.150 58.634 -1.484 19554 4862 1 10 . 1 1 170 170 ARG H H 170 7.610 7.610 8.736 -1.126 19554 4863 1 10 . 1 1 171 171 ARG N N 171 122.230 122.230 120.087 2.143 19554 4864 1 10 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.132 -0.662 19554 4865 1 10 . 1 1 171 171 ARG C C 171 175.760 175.760 177.680 -1.920 19554 4866 1 10 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.715 0.715 19554 4867 1 10 . 1 1 171 171 ARG CB C 171 30.410 30.410 29.414 0.996 19554 4868 1 10 . 1 1 171 171 ARG H H 171 8.260 8.260 8.600 -0.340 19554 4869 1 10 . 1 1 172 172 ALA N N 172 116.490 116.490 122.297 -5.807 19554 4870 1 10 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.224 -0.174 19554 4871 1 10 . 1 1 172 172 ALA C C 172 179.480 179.480 179.333 0.147 19554 4872 1 10 . 1 1 172 172 ALA CA C 172 54.010 54.010 53.882 0.128 19554 4873 1 10 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.002 0.888 19554 4874 1 10 . 1 1 172 172 ALA H H 172 7.760 7.760 7.979 -0.219 19554 4875 1 10 . 1 1 173 173 VAL N N 173 116.440 116.440 120.555 -4.115 19554 4876 1 10 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.647 -0.177 19554 4877 1 10 . 1 1 173 173 VAL C C 173 177.680 177.680 176.944 0.736 19554 4878 1 10 . 1 1 173 173 VAL CA C 173 65.080 65.080 65.607 -0.527 19554 4879 1 10 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.867 0.013 19554 4880 1 10 . 1 1 173 173 VAL H H 173 7.210 7.210 8.096 -0.886 19554 4881 1 10 . 1 1 174 174 ILE N N 174 119.790 119.790 115.837 3.953 19554 4882 1 10 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.580 0.100 19554 4883 1 10 . 1 1 174 174 ILE C C 174 178.310 178.310 177.479 0.831 19554 4884 1 10 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.311 -0.541 19554 4885 1 10 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.282 1.169 19554 4886 1 10 . 1 1 174 174 ILE H H 174 7.160 7.160 7.430 -0.270 19554 4887 1 10 . 1 1 175 175 GLU N N 175 117.810 117.810 118.629 -0.819 19554 4888 1 10 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.093 -0.063 19554 4889 1 10 . 1 1 175 175 GLU C C 175 177.170 177.170 178.169 -0.999 19554 4890 1 10 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.446 -1.256 19554 4891 1 10 . 1 1 175 175 GLU CB C 175 29.640 29.640 28.988 0.652 19554 4892 1 10 . 1 1 175 175 GLU H H 175 8.250 8.250 8.295 -0.045 19554 4893 1 10 . 1 1 176 176 SER N N 176 114.300 114.300 114.564 -0.264 19554 4894 1 10 . 1 1 176 176 SER HA H 176 4.320 4.320 4.198 0.122 19554 4895 1 10 . 1 1 176 176 SER C C 176 174.930 174.930 175.807 -0.877 19554 4896 1 10 . 1 1 176 176 SER CA C 176 59.060 59.060 60.910 -1.850 19554 4897 1 10 . 1 1 176 176 SER CB C 176 63.640 63.640 63.287 0.353 19554 4898 1 10 . 1 1 176 176 SER H H 176 7.460 7.460 7.840 -0.380 19554 4899 1 10 . 1 1 177 177 GLU N N 177 121.860 121.860 119.465 2.395 19554 4900 1 10 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.132 0.038 19554 4901 1 10 . 1 1 177 177 GLU C C 177 176.340 176.340 176.716 -0.376 19554 4902 1 10 . 1 1 177 177 GLU CA C 177 56.640 56.640 57.724 -1.083 19554 4903 1 10 . 1 1 177 177 GLU CB C 177 29.750 29.750 30.104 -0.354 19554 4904 1 10 . 1 1 177 177 GLU H H 177 7.890 7.890 7.591 0.299 19554 4905 1 10 . 1 1 178 178 ASN N N 178 119.030 119.030 115.814 3.216 19554 4906 1 10 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.447 0.253 19554 4907 1 10 . 1 1 178 178 ASN C C 178 174.230 174.230 174.843 -0.613 19554 4908 1 10 . 1 1 178 178 ASN CA C 178 53.010 53.010 53.579 -0.569 19554 4909 1 10 . 1 1 178 178 ASN CB C 178 39.080 39.080 37.684 1.396 19554 4910 1 10 . 1 1 178 178 ASN H H 178 8.110 8.110 8.260 -0.150 19554 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 84 3.451 -0.131 3.469 19554 2 1 1 "Average Difference" HA 94 0.379 0.015 0.381 19554 3 1 1 "Average Difference" C 86 0.965 0.006 0.970 19554 4 1 1 "Average Difference" CA 85 1.159 0.158 1.155 19554 5 1 1 "Average Difference" CB 72 0.819 -0.202 0.800 19554 6 1 1 "Average Difference" HN 84 0.571 -0.162 0.551 19554 7 1 2 "Average Difference" N 84 3.514 -0.296 3.523 19554 8 1 2 "Average Difference" HA 94 0.400 0.040 0.400 19554 9 1 2 "Average Difference" C 86 1.099 -0.067 1.103 19554 10 1 2 "Average Difference" CA 85 1.341 0.075 1.347 19554 11 1 2 "Average Difference" CB 72 0.977 -0.192 0.965 19554 12 1 2 "Average Difference" HN 84 0.554 -0.118 0.544 19554 13 1 3 "Average Difference" N 84 3.267 -0.323 3.270 19554 14 1 3 "Average Difference" HA 94 0.394 0.017 0.395 19554 15 1 3 "Average Difference" C 86 1.077 -0.012 1.083 19554 16 1 3 "Average Difference" CA 85 1.277 0.169 1.274 19554 17 1 3 "Average Difference" CB 72 1.095 -0.072 1.101 19554 18 1 3 "Average Difference" HN 84 0.611 -0.146 0.597 19554 19 1 4 "Average Difference" N 84 3.451 -0.121 3.470 19554 20 1 4 "Average Difference" HA 94 0.368 0.035 0.368 19554 21 1 4 "Average Difference" C 86 1.063 0.032 1.069 19554 22 1 4 "Average Difference" CA 85 1.139 0.199 1.129 19554 23 1 4 "Average Difference" CB 72 0.956 -0.159 0.949 19554 24 1 4 "Average Difference" HN 84 0.568 -0.123 0.558 19554 25 1 5 "Average Difference" N 84 3.817 -0.353 3.824 19554 26 1 5 "Average Difference" HA 94 0.384 0.070 0.380 19554 27 1 5 "Average Difference" C 86 1.003 -0.078 1.006 19554 28 1 5 "Average Difference" CA 85 1.251 0.023 1.259 19554 29 1 5 "Average Difference" CB 72 1.130 -0.211 1.118 19554 30 1 5 "Average Difference" HN 84 0.559 -0.144 0.543 19554 31 1 6 "Average Difference" N 84 3.557 -0.312 3.564 19554 32 1 6 "Average Difference" HA 94 0.375 0.027 0.376 19554 33 1 6 "Average Difference" C 86 0.974 0.003 0.979 19554 34 1 6 "Average Difference" CA 85 1.195 0.075 1.200 19554 35 1 6 "Average Difference" CB 72 1.058 -0.292 1.024 19554 36 1 6 "Average Difference" HN 84 0.559 -0.172 0.535 19554 37 1 7 "Average Difference" N 84 3.477 -0.363 3.479 19554 38 1 7 "Average Difference" HA 94 0.404 0.030 0.405 19554 39 1 7 "Average Difference" C 86 1.024 -0.022 1.029 19554 40 1 7 "Average Difference" CA 85 1.294 0.103 1.297 19554 41 1 7 "Average Difference" CB 72 0.937 -0.118 0.936 19554 42 1 7 "Average Difference" HN 84 0.600 -0.130 0.589 19554 43 1 8 "Average Difference" N 84 3.315 -0.297 3.321 19554 44 1 8 "Average Difference" HA 94 0.400 0.021 0.402 19554 45 1 8 "Average Difference" C 86 0.989 0.004 0.995 19554 46 1 8 "Average Difference" CA 85 1.261 0.237 1.246 19554 47 1 8 "Average Difference" CB 72 1.092 -0.172 1.086 19554 48 1 8 "Average Difference" HN 84 0.568 -0.143 0.553 19554 49 1 9 "Average Difference" N 84 3.274 -0.632 3.232 19554 50 1 9 "Average Difference" HA 94 0.387 0.008 0.389 19554 51 1 9 "Average Difference" C 86 0.997 0.029 1.002 19554 52 1 9 "Average Difference" CA 85 1.328 0.117 1.330 19554 53 1 9 "Average Difference" CB 72 0.975 -0.253 0.949 19554 54 1 9 "Average Difference" HN 84 0.591 -0.141 0.577 19554 55 1 10 "Average Difference" N 84 3.576 -0.668 3.535 19554 56 1 10 "Average Difference" HA 94 0.411 0.023 0.413 19554 57 1 10 "Average Difference" C 86 0.964 -0.029 0.969 19554 58 1 10 "Average Difference" CA 85 1.232 0.088 1.237 19554 59 1 10 "Average Difference" CB 72 1.078 -0.143 1.076 19554 60 1 10 "Average Difference" HN 84 0.592 -0.213 0.556 19554 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 19554 _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 89 89 ALA HA H 89 4.160 4.160 4.017 0.143 19554 2 1 . 1 1 89 89 ALA C C 89 179.720 179.720 179.045 0.675 19554 3 1 . 1 1 89 89 ALA CA C 89 54.490 54.490 54.278 0.212 19554 4 1 . 1 1 89 89 ALA CB C 89 18.220 18.220 18.525 -0.305 19554 5 1 . 1 1 90 90 LYS N N 90 119.500 119.500 117.929 1.571 19554 6 1 . 1 1 90 90 LYS C C 90 179.090 179.090 178.603 0.487 19554 7 1 . 1 1 90 90 LYS H H 90 7.980 7.980 8.394 -0.414 19554 8 1 . 1 1 91 91 ARG N N 91 120.510 120.510 118.651 1.859 19554 9 1 . 1 1 91 91 ARG HA H 91 4.150 4.150 4.000 0.150 19554 10 1 . 1 1 91 91 ARG CA C 91 58.300 58.300 57.851 0.449 19554 11 1 . 1 1 91 91 ARG CB C 91 30.020 30.020 29.509 0.511 19554 12 1 . 1 1 91 91 ARG H H 91 8.010 8.010 7.838 0.172 19554 13 1 . 1 1 92 92 HIS HA H 92 4.120 4.120 2.603 1.517 19554 14 1 . 1 1 92 92 HIS C C 92 177.360 177.360 176.141 1.219 19554 15 1 . 1 1 92 92 HIS CB C 92 29.870 29.870 29.203 0.667 19554 16 1 . 1 1 93 93 GLU N N 93 118.470 118.470 117.717 0.753 19554 17 1 . 1 1 93 93 GLU HA H 93 3.900 3.900 4.123 -0.223 19554 18 1 . 1 1 93 93 GLU C C 93 178.740 178.740 178.084 0.656 19554 19 1 . 1 1 93 93 GLU CA C 93 59.160 59.160 57.984 1.176 19554 20 1 . 1 1 93 93 GLU CB C 93 28.960 28.960 29.897 -0.937 19554 21 1 . 1 1 93 93 GLU H H 93 8.190 8.190 7.537 0.653 19554 22 1 . 1 1 94 94 ALA N N 94 123.080 123.080 123.141 -0.061 19554 23 1 . 1 1 94 94 ALA HA H 94 4.070 4.070 4.221 -0.151 19554 24 1 . 1 1 94 94 ALA C C 94 180.330 180.330 179.807 0.523 19554 25 1 . 1 1 94 94 ALA CA C 94 54.940 54.940 54.357 0.583 19554 26 1 . 1 1 94 94 ALA CB C 94 18.250 18.250 18.018 0.233 19554 27 1 . 1 1 94 94 ALA H H 94 8.090 8.090 7.385 0.705 19554 28 1 . 1 1 95 95 TRP N N 95 119.190 119.190 119.401 -0.211 19554 29 1 . 1 1 95 95 TRP HA H 95 4.040 4.040 4.447 -0.407 19554 30 1 . 1 1 95 95 TRP C C 95 178.590 178.590 178.076 0.513 19554 31 1 . 1 1 95 95 TRP CA C 95 61.000 61.000 58.652 2.348 19554 32 1 . 1 1 95 95 TRP CB C 95 29.160 29.160 27.926 1.233 19554 33 1 . 1 1 95 95 TRP H H 95 8.060 8.060 7.937 0.123 19554 34 1 . 1 1 96 96 ILE N N 96 119.570 119.570 117.892 1.678 19554 35 1 . 1 1 96 96 ILE HA H 96 3.810 3.810 3.786 0.024 19554 36 1 . 1 1 96 96 ILE C C 96 179.300 179.300 177.645 1.655 19554 37 1 . 1 1 96 96 ILE CA C 96 64.540 64.540 64.603 -0.063 19554 38 1 . 1 1 96 96 ILE CB C 96 37.130 37.130 37.375 -0.245 19554 39 1 . 1 1 96 96 ILE H H 96 7.850 7.850 7.534 0.316 19554 40 1 . 1 1 97 97 THR N N 97 117.030 117.030 114.124 2.906 19554 41 1 . 1 1 97 97 THR HA H 97 3.830 3.830 4.186 -0.356 19554 42 1 . 1 1 97 97 THR C C 97 177.080 177.080 176.537 0.543 19554 43 1 . 1 1 97 97 THR CA C 97 66.430 66.430 65.341 1.089 19554 44 1 . 1 1 97 97 THR CB C 97 68.450 68.450 69.056 -0.606 19554 45 1 . 1 1 97 97 THR H H 97 7.900 7.900 7.996 -0.096 19554 46 1 . 1 1 98 98 LEU N N 98 123.110 123.110 120.876 2.234 19554 47 1 . 1 1 98 98 LEU HA H 98 3.930 3.930 4.077 -0.146 19554 48 1 . 1 1 98 98 LEU C C 98 178.160 178.160 178.223 -0.063 19554 49 1 . 1 1 98 98 LEU CA C 98 57.730 57.730 57.415 0.315 19554 50 1 . 1 1 98 98 LEU CB C 98 41.540 41.540 41.068 0.473 19554 51 1 . 1 1 98 98 LEU H H 98 7.830 7.830 7.728 0.102 19554 52 1 . 1 1 99 99 GLU N N 99 120.520 120.520 119.691 0.829 19554 53 1 . 1 1 99 99 GLU HA H 99 3.880 3.880 4.079 -0.199 19554 54 1 . 1 1 99 99 GLU C C 99 179.010 179.010 178.829 0.181 19554 55 1 . 1 1 99 99 GLU CA C 99 59.920 59.920 59.524 0.396 19554 56 1 . 1 1 99 99 GLU CB C 99 29.350 29.350 29.318 0.032 19554 57 1 . 1 1 99 99 GLU H H 99 8.560 8.560 8.256 0.304 19554 58 1 . 1 1 100 100 LYS N N 100 119.950 119.950 117.961 1.989 19554 59 1 . 1 1 100 100 LYS HA H 100 4.030 4.030 4.192 -0.162 19554 60 1 . 1 1 100 100 LYS C C 100 177.870 177.870 178.509 -0.639 19554 61 1 . 1 1 100 100 LYS CA C 100 58.570 58.570 58.379 0.191 19554 62 1 . 1 1 100 100 LYS CB C 100 31.720 31.720 32.202 -0.482 19554 63 1 . 1 1 100 100 LYS H H 100 7.800 7.800 7.723 0.077 19554 64 1 . 1 1 101 101 ALA N N 101 120.690 120.690 122.693 -2.003 19554 65 1 . 1 1 101 101 ALA HA H 101 4.020 4.020 4.126 -0.106 19554 66 1 . 1 1 101 101 ALA C C 101 180.990 180.990 179.560 1.430 19554 67 1 . 1 1 101 101 ALA CA C 101 55.120 55.120 54.570 0.550 19554 68 1 . 1 1 101 101 ALA CB C 101 17.580 17.580 18.156 -0.576 19554 69 1 . 1 1 101 101 ALA H H 101 7.800 7.800 7.539 0.261 19554 70 1 . 1 1 102 102 TYR N N 102 118.440 118.440 118.601 -0.161 19554 71 1 . 1 1 102 102 TYR HA H 102 4.320 4.320 4.173 0.147 19554 72 1 . 1 1 102 102 TYR C C 102 178.590 178.590 178.278 0.312 19554 73 1 . 1 1 102 102 TYR CA C 102 59.810 59.810 60.391 -0.581 19554 74 1 . 1 1 102 102 TYR CB C 102 38.690 38.690 37.620 1.070 19554 75 1 . 1 1 102 102 TYR H H 102 8.580 8.580 7.792 0.788 19554 76 1 . 1 1 103 103 GLU N N 103 120.860 120.860 119.073 1.787 19554 77 1 . 1 1 103 103 GLU HA H 103 3.590 3.590 3.999 -0.409 19554 78 1 . 1 1 103 103 GLU C C 103 178.100 178.100 177.099 1.001 19554 79 1 . 1 1 103 103 GLU CA C 103 59.080 59.080 58.791 0.289 19554 80 1 . 1 1 103 103 GLU CB C 103 29.420 29.420 29.419 0.001 19554 81 1 . 1 1 103 103 GLU H H 103 8.290 8.290 7.857 0.433 19554 82 1 . 1 1 104 104 ASP N N 104 116.120 116.120 116.975 -0.855 19554 83 1 . 1 1 104 104 ASP HA H 104 4.610 4.610 4.682 -0.072 19554 84 1 . 1 1 104 104 ASP C C 104 174.970 174.970 175.011 -0.041 19554 85 1 . 1 1 104 104 ASP CA C 104 54.120 54.120 53.658 0.462 19554 86 1 . 1 1 104 104 ASP CB C 104 40.480 40.480 40.934 -0.454 19554 87 1 . 1 1 104 104 ASP H H 104 8.120 8.120 7.701 0.419 19554 88 1 . 1 1 105 105 ALA N N 105 123.330 123.330 120.493 2.837 19554 89 1 . 1 1 105 105 ALA HA H 105 4.150 4.150 4.037 0.113 19554 90 1 . 1 1 105 105 ALA C C 105 177.130 177.130 176.520 0.610 19554 91 1 . 1 1 105 105 ALA CA C 105 52.640 52.640 52.858 -0.219 19554 92 1 . 1 1 105 105 ALA CB C 105 16.300 16.300 16.916 -0.616 19554 93 1 . 1 1 105 105 ALA H H 105 7.710 7.710 7.615 0.095 19554 94 1 . 1 1 106 106 GLU N N 106 118.950 118.950 118.943 0.007 19554 95 1 . 1 1 106 106 GLU HA H 106 4.300 4.300 4.313 -0.013 19554 96 1 . 1 1 106 106 GLU C C 106 176.730 176.730 176.449 0.281 19554 97 1 . 1 1 106 106 GLU CA C 106 55.440 55.440 56.102 -0.662 19554 98 1 . 1 1 106 106 GLU CB C 106 31.760 31.760 31.232 0.528 19554 99 1 . 1 1 106 106 GLU H H 106 8.440 8.440 8.144 0.296 19554 100 1 . 1 1 107 107 THR N N 107 118.780 118.780 114.393 4.387 19554 101 1 . 1 1 107 107 THR HA H 107 4.550 4.550 4.534 0.016 19554 102 1 . 1 1 107 107 THR C C 107 174.250 174.250 173.999 0.251 19554 103 1 . 1 1 107 107 THR CA C 107 62.360 62.360 60.900 1.460 19554 104 1 . 1 1 107 107 THR CB C 107 69.390 69.390 69.840 -0.450 19554 105 1 . 1 1 107 107 THR H H 107 8.740 8.740 8.187 0.553 19554 106 1 . 1 1 108 108 VAL N N 108 120.540 120.540 118.636 1.904 19554 107 1 . 1 1 108 108 VAL HA H 108 4.630 4.630 4.686 -0.056 19554 108 1 . 1 1 108 108 VAL C C 108 174.440 174.440 173.907 0.533 19554 109 1 . 1 1 108 108 VAL CA C 108 59.000 59.000 59.785 -0.785 19554 110 1 . 1 1 108 108 VAL CB C 108 34.650 34.650 34.795 -0.145 19554 111 1 . 1 1 108 108 VAL H H 108 9.040 9.040 8.374 0.666 19554 112 1 . 1 1 109 109 THR N N 109 115.100 115.100 114.755 0.345 19554 113 1 . 1 1 109 109 THR HA H 109 5.380 5.380 4.575 0.805 19554 114 1 . 1 1 109 109 THR C C 109 174.580 174.580 173.359 1.221 19554 115 1 . 1 1 109 109 THR CA C 109 60.410 60.410 61.753 -1.343 19554 116 1 . 1 1 109 109 THR CB C 109 70.610 70.610 70.030 0.580 19554 117 1 . 1 1 109 109 THR H H 109 8.170 8.170 8.290 -0.120 19554 118 1 . 1 1 110 110 GLY N N 110 108.580 108.580 113.825 -5.245 19554 119 1 . 1 1 110 110 GLY C C 110 170.810 170.810 171.697 -0.887 19554 120 1 . 1 1 110 110 GLY CA C 110 45.380 45.380 45.054 0.326 19554 121 1 . 1 1 110 110 GLY H H 110 8.780 8.780 8.067 0.713 19554 122 1 . 1 1 111 111 VAL N N 111 116.930 116.930 120.383 -3.453 19554 123 1 . 1 1 111 111 VAL HA H 111 4.780 4.780 4.830 -0.050 19554 124 1 . 1 1 111 111 VAL C C 111 176.060 176.060 175.462 0.599 19554 125 1 . 1 1 111 111 VAL CA C 111 59.770 59.770 59.607 0.163 19554 126 1 . 1 1 111 111 VAL CB C 111 35.750 35.750 34.813 0.937 19554 127 1 . 1 1 111 111 VAL H H 111 7.810 7.810 8.247 -0.437 19554 128 1 . 1 1 112 112 ILE N N 112 127.060 127.060 128.617 -1.557 19554 129 1 . 1 1 112 112 ILE HA H 112 4.230 4.230 4.168 0.061 19554 130 1 . 1 1 112 112 ILE C C 112 176.180 176.180 175.598 0.582 19554 131 1 . 1 1 112 112 ILE CA C 112 62.220 62.220 62.851 -0.630 19554 132 1 . 1 1 112 112 ILE CB C 112 37.480 37.480 36.355 1.125 19554 133 1 . 1 1 112 112 ILE H H 112 9.240 9.240 8.093 1.147 19554 134 1 . 1 1 113 113 ASN N N 113 127.510 127.510 126.219 1.291 19554 135 1 . 1 1 113 113 ASN HA H 113 4.940 4.940 4.772 0.168 19554 136 1 . 1 1 113 113 ASN C C 113 175.020 175.020 175.500 -0.480 19554 137 1 . 1 1 113 113 ASN CA C 113 52.290 52.290 53.792 -1.502 19554 138 1 . 1 1 113 113 ASN CB C 113 39.580 39.580 40.020 -0.440 19554 139 1 . 1 1 113 113 ASN H H 113 9.010 9.010 8.253 0.757 19554 140 1 . 1 1 114 114 GLY N N 114 107.150 107.150 107.862 -0.713 19554 141 1 . 1 1 114 114 GLY C C 114 171.360 171.360 172.141 -0.780 19554 142 1 . 1 1 114 114 GLY CA C 114 45.520 45.520 44.510 1.010 19554 143 1 . 1 1 114 114 GLY H H 114 7.620 7.620 7.588 0.032 19554 144 1 . 1 1 115 115 LYS N N 115 121.670 121.670 121.979 -0.309 19554 145 1 . 1 1 115 115 LYS HA H 115 4.590 4.590 4.389 0.201 19554 146 1 . 1 1 115 115 LYS C C 115 175.950 175.950 174.919 1.031 19554 147 1 . 1 1 115 115 LYS CA C 115 55.940 55.940 54.707 1.233 19554 148 1 . 1 1 115 115 LYS CB C 115 34.040 34.040 34.180 -0.140 19554 149 1 . 1 1 115 115 LYS H H 115 8.550 8.550 8.189 0.361 19554 150 1 . 1 1 116 116 VAL N N 116 118.750 118.750 118.459 0.291 19554 151 1 . 1 1 116 116 VAL HA H 116 4.470 4.470 4.441 0.029 19554 152 1 . 1 1 116 116 VAL C C 116 175.110 175.110 174.979 0.131 19554 153 1 . 1 1 116 116 VAL CA C 116 59.030 59.030 59.114 -0.084 19554 154 1 . 1 1 116 116 VAL CB C 116 35.500 35.500 33.934 1.566 19554 155 1 . 1 1 116 116 VAL H H 116 8.070 8.070 7.907 0.163 19554 156 1 . 1 1 117 117 LYS N N 117 122.520 122.520 121.925 0.595 19554 157 1 . 1 1 117 117 LYS HA H 117 3.930 3.930 4.033 -0.103 19554 158 1 . 1 1 117 117 LYS C C 117 177.970 177.970 176.996 0.974 19554 159 1 . 1 1 117 117 LYS CA C 117 58.670 58.670 57.045 1.625 19554 160 1 . 1 1 117 117 LYS CB C 117 30.940 30.940 31.033 -0.093 19554 161 1 . 1 1 117 117 LYS H H 117 8.250 8.250 8.457 -0.207 19554 162 1 . 1 1 118 118 GLY N N 118 113.440 113.440 112.467 0.973 19554 163 1 . 1 1 118 118 GLY C C 118 175.540 175.540 173.753 1.787 19554 164 1 . 1 1 118 118 GLY CA C 118 45.200 45.200 45.106 0.094 19554 165 1 . 1 1 118 118 GLY H H 118 8.820 8.820 8.000 0.820 19554 166 1 . 1 1 119 119 GLY N N 119 109.130 109.130 106.362 2.768 19554 167 1 . 1 1 119 119 GLY C C 119 170.530 170.530 172.170 -1.640 19554 168 1 . 1 1 119 119 GLY CA C 119 46.840 46.840 43.347 3.493 19554 169 1 . 1 1 119 119 GLY H H 119 7.930 7.930 7.500 0.430 19554 170 1 . 1 1 120 120 PHE N N 120 123.370 123.370 117.372 5.998 19554 171 1 . 1 1 120 120 PHE HA H 120 5.270 5.270 4.597 0.673 19554 172 1 . 1 1 120 120 PHE C C 120 174.260 174.260 174.385 -0.125 19554 173 1 . 1 1 120 120 PHE CA C 120 56.340 56.340 57.058 -0.718 19554 174 1 . 1 1 120 120 PHE CB C 120 43.730 43.730 43.106 0.624 19554 175 1 . 1 1 120 120 PHE H H 120 8.820 8.820 7.633 1.187 19554 176 1 . 1 1 121 121 THR N N 121 114.670 114.670 119.325 -4.655 19554 177 1 . 1 1 121 121 THR HA H 121 5.000 5.000 4.920 0.080 19554 178 1 . 1 1 121 121 THR C C 121 173.780 173.780 173.845 -0.065 19554 179 1 . 1 1 121 121 THR CA C 121 60.500 60.500 61.099 -0.599 19554 180 1 . 1 1 121 121 THR CB C 121 69.910 69.910 69.915 -0.005 19554 181 1 . 1 1 121 121 THR H H 121 8.670 8.670 8.771 -0.101 19554 182 1 . 1 1 122 122 VAL N N 122 124.340 124.340 121.245 3.095 19554 183 1 . 1 1 122 122 VAL HA H 122 4.600 4.600 4.390 0.210 19554 184 1 . 1 1 122 122 VAL C C 122 174.240 174.240 174.134 0.106 19554 185 1 . 1 1 122 122 VAL CA C 122 59.300 59.300 60.531 -1.231 19554 186 1 . 1 1 122 122 VAL CB C 122 35.860 35.860 35.731 0.129 19554 187 1 . 1 1 122 122 VAL H H 122 8.560 8.560 8.079 0.481 19554 188 1 . 1 1 123 123 GLU N N 123 126.950 126.950 125.866 1.084 19554 189 1 . 1 1 123 123 GLU HA H 123 4.610 4.610 4.993 -0.383 19554 190 1 . 1 1 123 123 GLU C C 123 175.840 175.840 175.808 0.032 19554 191 1 . 1 1 123 123 GLU CA C 123 55.160 55.160 54.948 0.212 19554 192 1 . 1 1 123 123 GLU CB C 123 30.910 30.910 30.863 0.047 19554 193 1 . 1 1 123 123 GLU H H 123 8.950 8.950 8.351 0.599 19554 194 1 . 1 1 124 124 LEU N N 124 129.580 129.580 128.781 0.798 19554 195 1 . 1 1 124 124 LEU HA H 124 4.660 4.660 4.681 -0.021 19554 196 1 . 1 1 124 124 LEU C C 124 175.350 175.350 176.225 -0.875 19554 197 1 . 1 1 124 124 LEU CA C 124 53.200 53.200 53.693 -0.493 19554 198 1 . 1 1 124 124 LEU CB C 124 42.190 42.190 41.493 0.697 19554 199 1 . 1 1 124 124 LEU H H 124 8.940 8.940 8.922 0.018 19554 200 1 . 1 1 125 125 ASN N N 125 121.880 121.880 119.603 2.277 19554 201 1 . 1 1 125 125 ASN HA H 125 4.190 4.190 4.425 -0.235 19554 202 1 . 1 1 125 125 ASN C C 125 174.690 174.690 175.433 -0.743 19554 203 1 . 1 1 125 125 ASN CA C 125 53.880 53.880 54.084 -0.204 19554 204 1 . 1 1 125 125 ASN CB C 125 37.250 37.250 37.215 0.035 19554 205 1 . 1 1 125 125 ASN H H 125 8.950 8.950 8.857 0.093 19554 206 1 . 1 1 126 126 GLY N N 126 103.140 103.140 103.040 0.100 19554 207 1 . 1 1 126 126 GLY C C 126 173.680 173.680 174.322 -0.642 19554 208 1 . 1 1 126 126 GLY CA C 126 44.880 44.880 45.118 -0.238 19554 209 1 . 1 1 126 126 GLY H H 126 8.070 8.070 8.285 -0.215 19554 210 1 . 1 1 127 127 ILE N N 127 122.120 122.120 122.359 -0.239 19554 211 1 . 1 1 127 127 ILE HA H 127 3.970 3.970 3.909 0.060 19554 212 1 . 1 1 127 127 ILE C C 127 174.370 174.370 175.340 -0.970 19554 213 1 . 1 1 127 127 ILE CA C 127 59.530 59.530 60.589 -1.059 19554 214 1 . 1 1 127 127 ILE CB C 127 38.970 38.970 38.095 0.875 19554 215 1 . 1 1 127 127 ILE H H 127 7.380 7.380 7.564 -0.184 19554 216 1 . 1 1 128 128 ARG N N 128 126.630 126.630 124.934 1.696 19554 217 1 . 1 1 128 128 ARG HA H 128 4.640 4.640 5.101 -0.461 19554 218 1 . 1 1 128 128 ARG C C 128 174.720 174.720 175.132 -0.412 19554 219 1 . 1 1 128 128 ARG CA C 128 55.650 55.650 54.949 0.702 19554 220 1 . 1 1 128 128 ARG CB C 128 31.000 31.000 31.611 -0.611 19554 221 1 . 1 1 128 128 ARG H H 128 8.170 8.170 8.481 -0.311 19554 222 1 . 1 1 129 129 ALA N N 129 127.320 127.320 126.678 0.642 19554 223 1 . 1 1 129 129 ALA HA H 129 4.850 4.850 4.760 0.090 19554 224 1 . 1 1 129 129 ALA C C 129 174.970 174.970 175.537 -0.567 19554 225 1 . 1 1 129 129 ALA CA C 129 49.660 49.660 49.981 -0.321 19554 226 1 . 1 1 129 129 ALA CB C 129 24.390 24.390 21.452 2.938 19554 227 1 . 1 1 129 129 ALA H H 129 9.240 9.240 8.644 0.596 19554 228 1 . 1 1 130 130 PHE N N 130 121.060 121.060 118.826 2.234 19554 229 1 . 1 1 130 130 PHE HA H 130 5.160 5.160 5.103 0.057 19554 230 1 . 1 1 130 130 PHE C C 130 172.430 172.430 173.612 -1.182 19554 231 1 . 1 1 130 130 PHE CA C 130 55.000 55.000 57.022 -2.022 19554 232 1 . 1 1 130 130 PHE CB C 130 42.400 42.400 42.592 -0.192 19554 233 1 . 1 1 130 130 PHE H H 130 8.660 8.660 8.363 0.297 19554 234 1 . 1 1 131 131 LEU N N 131 130.250 130.250 127.073 3.177 19554 235 1 . 1 1 131 131 LEU HA H 131 4.980 4.980 4.985 -0.005 19554 236 1 . 1 1 131 131 LEU CA C 131 49.670 49.670 51.526 -1.856 19554 237 1 . 1 1 131 131 LEU CB C 131 44.330 44.330 43.712 0.618 19554 238 1 . 1 1 131 131 LEU H H 131 8.550 8.550 8.430 0.120 19554 239 1 . 1 1 132 132 PRO HA H 132 4.000 4.000 4.603 -0.604 19554 240 1 . 1 1 132 132 PRO C C 132 179.380 179.380 178.172 1.208 19554 241 1 . 1 1 132 132 PRO CA C 132 62.160 62.160 62.880 -0.720 19554 242 1 . 1 1 133 133 GLY N N 133 111.470 111.470 110.365 1.105 19554 243 1 . 1 1 133 133 GLY C C 133 175.590 175.590 176.507 -0.917 19554 244 1 . 1 1 133 133 GLY CA C 133 47.530 47.530 46.794 0.736 19554 245 1 . 1 1 133 133 GLY H H 133 9.140 9.140 8.762 0.377 19554 246 1 . 1 1 134 134 SER HA H 134 4.350 4.350 4.322 0.028 19554 247 1 . 1 1 134 134 SER C C 134 175.280 175.280 174.881 0.399 19554 248 1 . 1 1 134 134 SER CA C 134 59.210 59.210 60.522 -1.311 19554 249 1 . 1 1 134 134 SER CB C 134 62.730 62.730 63.210 -0.480 19554 250 1 . 1 1 135 135 LEU N N 135 118.770 118.770 120.249 -1.479 19554 251 1 . 1 1 135 135 LEU HA H 135 4.580 4.580 4.562 0.017 19554 252 1 . 1 1 135 135 LEU C C 135 177.500 177.500 176.720 0.780 19554 253 1 . 1 1 135 135 LEU CA C 135 53.770 53.770 54.664 -0.894 19554 254 1 . 1 1 135 135 LEU H H 135 8.030 8.030 7.591 0.439 19554 255 1 . 1 1 136 136 VAL N N 136 123.080 123.080 118.643 4.437 19554 256 1 . 1 1 136 136 VAL HA H 136 3.610 3.610 4.043 -0.433 19554 257 1 . 1 1 136 136 VAL C C 136 173.150 173.150 175.754 -2.603 19554 258 1 . 1 1 136 136 VAL CA C 136 65.220 65.220 63.890 1.330 19554 259 1 . 1 1 136 136 VAL CB C 136 32.020 32.020 33.174 -1.154 19554 260 1 . 1 1 136 136 VAL H H 136 7.550 7.550 7.697 -0.147 19554 261 1 . 1 1 137 137 ASP N N 137 117.300 117.300 118.835 -1.535 19554 262 1 . 1 1 137 137 ASP HA H 137 4.340 4.340 4.762 -0.422 19554 263 1 . 1 1 137 137 ASP C C 137 174.840 174.840 175.103 -0.263 19554 264 1 . 1 1 137 137 ASP CA C 137 52.070 52.070 53.632 -1.562 19554 265 1 . 1 1 137 137 ASP CB C 137 44.460 44.460 41.783 2.677 19554 266 1 . 1 1 137 137 ASP H H 137 7.940 7.940 7.838 0.102 19554 267 1 . 1 1 138 138 VAL N N 138 116.750 116.750 120.418 -3.668 19554 268 1 . 1 1 138 138 VAL HA H 138 4.140 4.140 4.263 -0.123 19554 269 1 . 1 1 138 138 VAL CA C 138 61.190 61.190 61.985 -0.795 19554 270 1 . 1 1 138 138 VAL CB C 138 33.330 33.330 33.106 0.224 19554 271 1 . 1 1 138 138 VAL H H 138 10.000 10.000 8.294 1.706 19554 272 1 . 1 1 140 140 PRO HA H 140 4.510 4.510 4.522 -0.012 19554 273 1 . 1 1 140 140 PRO C C 140 175.860 175.860 176.252 -0.392 19554 274 1 . 1 1 141 141 VAL N N 141 124.910 124.910 119.597 5.313 19554 275 1 . 1 1 141 141 VAL HA H 141 3.900 3.900 4.284 -0.384 19554 276 1 . 1 1 141 141 VAL C C 141 175.120 175.120 175.588 -0.468 19554 277 1 . 1 1 141 141 VAL CA C 141 62.720 62.720 61.453 1.267 19554 278 1 . 1 1 141 141 VAL CB C 141 31.870 31.870 33.596 -1.726 19554 279 1 . 1 1 141 141 VAL H H 141 8.110 8.110 8.174 -0.064 19554 280 1 . 1 1 142 142 ARG N N 142 119.730 119.730 122.341 -2.611 19554 281 1 . 1 1 142 142 ARG HA H 142 4.620 4.620 4.336 0.284 19554 282 1 . 1 1 142 142 ARG C C 142 173.520 173.520 175.381 -1.861 19554 283 1 . 1 1 142 142 ARG CA C 142 53.020 53.020 56.485 -3.465 19554 284 1 . 1 1 142 142 ARG CB C 142 30.480 30.480 30.469 0.011 19554 285 1 . 1 1 142 142 ARG H H 142 7.440 7.440 8.414 -0.974 19554 286 1 . 1 1 143 143 ASP N N 143 119.780 119.780 120.228 -0.448 19554 287 1 . 1 1 143 143 ASP HA H 143 4.670 4.670 4.657 0.013 19554 288 1 . 1 1 143 143 ASP C C 143 175.970 175.970 175.725 0.245 19554 289 1 . 1 1 143 143 ASP CA C 143 54.030 54.030 54.243 -0.213 19554 290 1 . 1 1 143 143 ASP CB C 143 41.730 41.730 41.543 0.187 19554 291 1 . 1 1 143 143 ASP H H 143 7.880 7.880 8.190 -0.311 19554 292 1 . 1 1 144 144 THR N N 144 110.060 110.060 114.442 -4.382 19554 293 1 . 1 1 144 144 THR HA H 144 4.110 4.110 4.449 -0.338 19554 294 1 . 1 1 144 144 THR C C 144 175.730 175.730 175.153 0.577 19554 295 1 . 1 1 144 144 THR CA C 144 61.520 61.520 61.847 -0.327 19554 296 1 . 1 1 144 144 THR CB C 144 68.610 68.610 69.612 -1.001 19554 297 1 . 1 1 144 144 THR H H 144 8.030 8.030 8.401 -0.371 19554 298 1 . 1 1 145 145 LEU N N 145 124.820 124.820 123.060 1.760 19554 299 1 . 1 1 145 145 LEU HA H 145 4.700 4.700 4.406 0.294 19554 300 1 . 1 1 145 145 LEU C C 145 178.010 178.010 177.345 0.665 19554 301 1 . 1 1 145 145 LEU CA C 145 57.350 57.350 56.141 1.209 19554 302 1 . 1 1 145 145 LEU CB C 145 42.100 42.100 41.806 0.294 19554 303 1 . 1 1 145 145 LEU H H 145 8.050 8.050 8.140 -0.090 19554 304 1 . 1 1 146 146 HIS N N 146 116.310 116.310 115.692 0.618 19554 305 1 . 1 1 146 146 HIS HA H 146 4.540 4.540 4.438 0.102 19554 306 1 . 1 1 146 146 HIS C C 146 175.000 175.000 175.524 -0.524 19554 307 1 . 1 1 146 146 HIS H H 146 8.120 8.120 8.233 -0.113 19554 308 1 . 1 1 147 147 LEU N N 147 120.320 120.320 119.156 1.164 19554 309 1 . 1 1 147 147 LEU HA H 147 4.070 4.070 3.974 0.097 19554 310 1 . 1 1 147 147 LEU C C 147 176.810 176.810 176.266 0.544 19554 311 1 . 1 1 147 147 LEU CA C 147 54.710 54.710 55.343 -0.633 19554 312 1 . 1 1 147 147 LEU CB C 147 41.960 41.960 41.929 0.031 19554 313 1 . 1 1 147 147 LEU H H 147 7.620 7.620 7.515 0.105 19554 314 1 . 1 1 148 148 GLU N N 148 118.950 118.950 117.476 1.474 19554 315 1 . 1 1 148 148 GLU HA H 148 3.780 3.780 4.415 -0.635 19554 316 1 . 1 1 148 148 GLU C C 148 177.480 177.480 176.495 0.985 19554 317 1 . 1 1 148 148 GLU CA C 148 58.430 58.430 55.609 2.821 19554 318 1 . 1 1 148 148 GLU CB C 148 29.680 29.680 31.216 -1.536 19554 319 1 . 1 1 148 148 GLU H H 148 7.760 7.760 7.488 0.272 19554 320 1 . 1 1 149 149 GLY N N 149 111.070 111.070 111.144 -0.074 19554 321 1 . 1 1 149 149 GLY C C 149 173.820 173.820 174.266 -0.446 19554 322 1 . 1 1 149 149 GLY CA C 149 45.530 45.530 45.467 0.063 19554 323 1 . 1 1 149 149 GLY H H 149 8.630 8.630 8.415 0.215 19554 324 1 . 1 1 150 150 LYS N N 150 119.380 119.380 121.502 -2.123 19554 325 1 . 1 1 150 150 LYS HA H 150 4.330 4.330 4.203 0.127 19554 326 1 . 1 1 150 150 LYS C C 150 175.110 175.110 175.476 -0.366 19554 327 1 . 1 1 150 150 LYS CA C 150 55.170 55.170 56.463 -1.293 19554 328 1 . 1 1 150 150 LYS CB C 150 33.550 33.550 33.110 0.440 19554 329 1 . 1 1 150 150 LYS H H 150 7.520 7.520 8.030 -0.510 19554 330 1 . 1 1 151 151 GLU N N 151 122.850 122.850 125.334 -2.484 19554 331 1 . 1 1 151 151 GLU HA H 151 4.470 4.470 4.482 -0.011 19554 332 1 . 1 1 151 151 GLU C C 151 175.510 175.510 175.150 0.360 19554 333 1 . 1 1 151 151 GLU CA C 151 56.340 56.340 55.386 0.954 19554 334 1 . 1 1 151 151 GLU CB C 151 30.010 30.010 29.607 0.404 19554 335 1 . 1 1 151 151 GLU H H 151 8.410 8.410 8.556 -0.146 19554 336 1 . 1 1 152 152 LEU N N 152 127.520 127.520 125.057 2.463 19554 337 1 . 1 1 152 152 LEU HA H 152 4.540 4.540 4.622 -0.082 19554 338 1 . 1 1 152 152 LEU C C 152 173.750 173.750 174.836 -1.086 19554 339 1 . 1 1 152 152 LEU CA C 152 52.820 52.820 53.071 -0.251 19554 340 1 . 1 1 152 152 LEU H H 152 8.850 8.850 7.885 0.965 19554 341 1 . 1 1 153 153 GLU N N 153 116.500 116.500 119.426 -2.926 19554 342 1 . 1 1 153 153 GLU HA H 153 4.580 4.580 4.300 0.280 19554 343 1 . 1 1 153 153 GLU C C 153 175.120 175.120 174.674 0.446 19554 344 1 . 1 1 153 153 GLU CA C 153 55.160 55.160 55.382 -0.222 19554 345 1 . 1 1 153 153 GLU H H 153 7.110 7.110 8.251 -1.141 19554 346 1 . 1 1 154 154 PHE N N 154 115.150 115.150 119.766 -4.616 19554 347 1 . 1 1 154 154 PHE HA H 154 4.860 4.860 4.822 0.038 19554 348 1 . 1 1 154 154 PHE C C 154 175.630 175.630 174.419 1.211 19554 349 1 . 1 1 154 154 PHE CA C 154 57.190 57.190 56.407 0.783 19554 350 1 . 1 1 154 154 PHE CB C 154 44.250 44.250 42.240 2.010 19554 351 1 . 1 1 154 154 PHE H H 154 8.910 8.910 8.262 0.648 19554 352 1 . 1 1 155 155 LYS N N 155 114.560 114.560 119.825 -5.265 19554 353 1 . 1 1 155 155 LYS HA H 155 4.710 4.710 4.623 0.087 19554 354 1 . 1 1 155 155 LYS C C 155 176.500 176.500 175.290 1.210 19554 355 1 . 1 1 155 155 LYS CA C 155 53.600 53.600 55.420 -1.820 19554 356 1 . 1 1 155 155 LYS CB C 155 33.960 33.960 35.320 -1.360 19554 357 1 . 1 1 155 155 LYS H H 155 8.100 8.100 8.619 -0.519 19554 358 1 . 1 1 156 156 VAL N N 156 124.530 124.530 125.056 -0.526 19554 359 1 . 1 1 156 156 VAL C C 156 175.630 175.630 175.463 0.167 19554 360 1 . 1 1 156 156 VAL CA C 156 62.690 62.690 63.341 -0.652 19554 361 1 . 1 1 156 156 VAL CB C 156 31.600 31.600 31.522 0.078 19554 362 1 . 1 1 156 156 VAL H H 156 9.920 9.920 8.290 1.630 19554 363 1 . 1 1 157 157 ILE N N 157 119.590 119.590 127.408 -7.818 19554 364 1 . 1 1 157 157 ILE HA H 157 4.720 4.720 4.254 0.466 19554 365 1 . 1 1 157 157 ILE C C 157 176.190 176.190 175.136 1.054 19554 366 1 . 1 1 157 157 ILE CA C 157 61.050 61.050 61.276 -0.226 19554 367 1 . 1 1 157 157 ILE CB C 157 39.170 39.170 39.320 -0.150 19554 368 1 . 1 1 157 157 ILE H H 157 8.530 8.530 8.446 0.084 19554 369 1 . 1 1 158 158 LYS N N 158 122.460 122.460 118.859 3.601 19554 370 1 . 1 1 158 158 LYS HA H 158 4.200 4.200 4.446 -0.245 19554 371 1 . 1 1 158 158 LYS C C 158 173.000 173.000 174.058 -1.058 19554 372 1 . 1 1 158 158 LYS CA C 158 56.800 56.800 56.104 0.696 19554 373 1 . 1 1 158 158 LYS CB C 158 35.640 35.640 34.677 0.963 19554 374 1 . 1 1 158 158 LYS H H 158 7.600 7.600 7.938 -0.338 19554 375 1 . 1 1 159 159 LEU N N 159 125.430 125.430 120.642 4.788 19554 376 1 . 1 1 159 159 LEU HA H 159 4.620 4.620 4.704 -0.084 19554 377 1 . 1 1 159 159 LEU C C 159 174.390 174.390 175.216 -0.826 19554 378 1 . 1 1 159 159 LEU CA C 159 54.510 54.510 54.085 0.425 19554 379 1 . 1 1 159 159 LEU H H 159 7.950 7.950 8.105 -0.155 19554 380 1 . 1 1 160 160 ASP N N 160 124.740 124.740 122.655 2.085 19554 381 1 . 1 1 160 160 ASP HA H 160 4.670 4.670 4.814 -0.144 19554 382 1 . 1 1 160 160 ASP C C 160 176.020 176.020 176.289 -0.269 19554 383 1 . 1 1 160 160 ASP CA C 160 52.620 52.620 53.636 -1.016 19554 384 1 . 1 1 160 160 ASP CB C 160 42.050 42.050 41.453 0.597 19554 385 1 . 1 1 160 160 ASP H H 160 8.760 8.760 8.373 0.387 19554 386 1 . 1 1 161 161 GLN N N 161 126.490 126.490 123.050 3.440 19554 387 1 . 1 1 161 161 GLN HA H 161 3.120 3.120 4.075 -0.955 19554 388 1 . 1 1 161 161 GLN C C 161 178.280 178.280 177.465 0.815 19554 389 1 . 1 1 161 161 GLN CA C 161 58.770 58.770 58.346 0.424 19554 390 1 . 1 1 161 161 GLN CB C 161 27.840 27.840 28.669 -0.829 19554 391 1 . 1 1 161 161 GLN H H 161 9.110 9.110 8.473 0.637 19554 392 1 . 1 1 162 162 LYS N N 162 119.150 119.150 120.218 -1.068 19554 393 1 . 1 1 162 162 LYS HA H 162 3.800 3.800 4.099 -0.299 19554 394 1 . 1 1 162 162 LYS C C 162 177.900 177.900 177.689 0.211 19554 395 1 . 1 1 162 162 LYS CA C 162 58.700 58.700 58.463 0.237 19554 396 1 . 1 1 162 162 LYS CB C 162 31.390 31.390 32.211 -0.822 19554 397 1 . 1 1 162 162 LYS H H 162 8.070 8.070 8.183 -0.113 19554 398 1 . 1 1 163 163 ARG N N 163 114.850 114.850 116.816 -1.966 19554 399 1 . 1 1 163 163 ARG HA H 163 4.150 4.150 4.389 -0.239 19554 400 1 . 1 1 163 163 ARG C C 163 174.750 174.750 175.627 -0.877 19554 401 1 . 1 1 163 163 ARG CA C 163 54.800 54.800 55.437 -0.637 19554 402 1 . 1 1 163 163 ARG H H 163 7.010 7.010 7.727 -0.717 19554 403 1 . 1 1 164 164 ASN N N 164 117.810 117.810 116.689 1.121 19554 404 1 . 1 1 164 164 ASN HA H 164 4.130 4.130 4.393 -0.263 19554 405 1 . 1 1 164 164 ASN C C 164 173.880 173.880 173.788 0.092 19554 406 1 . 1 1 164 164 ASN CA C 164 53.960 53.960 54.487 -0.527 19554 407 1 . 1 1 164 164 ASN CB C 164 37.530 37.530 37.191 0.339 19554 408 1 . 1 1 164 164 ASN H H 164 7.750 7.750 8.180 -0.430 19554 409 1 . 1 1 165 165 ASN N N 165 116.170 116.170 116.347 -0.177 19554 410 1 . 1 1 165 165 ASN HA H 165 5.060 5.060 4.945 0.115 19554 411 1 . 1 1 165 165 ASN C C 165 172.990 172.990 173.018 -0.028 19554 412 1 . 1 1 165 165 ASN CA C 165 52.440 52.440 52.719 -0.279 19554 413 1 . 1 1 165 165 ASN CB C 165 41.820 41.820 41.957 -0.137 19554 414 1 . 1 1 165 165 ASN H H 165 8.020 8.020 7.754 0.266 19554 415 1 . 1 1 166 166 VAL N N 166 124.790 124.790 119.622 5.168 19554 416 1 . 1 1 166 166 VAL HA H 166 4.500 4.500 4.411 0.089 19554 417 1 . 1 1 166 166 VAL C C 166 174.190 174.190 173.973 0.217 19554 418 1 . 1 1 166 166 VAL CA C 166 61.030 61.030 60.584 0.446 19554 419 1 . 1 1 166 166 VAL CB C 166 34.620 34.620 34.115 0.505 19554 420 1 . 1 1 166 166 VAL H H 166 8.380 8.380 8.228 0.152 19554 421 1 . 1 1 167 167 VAL N N 167 128.000 128.000 121.350 6.650 19554 422 1 . 1 1 167 167 VAL HA H 167 5.250 5.250 4.679 0.571 19554 423 1 . 1 1 167 167 VAL C C 167 176.000 176.000 174.019 1.981 19554 424 1 . 1 1 167 167 VAL CA C 167 60.610 60.610 59.784 0.826 19554 425 1 . 1 1 167 167 VAL CB C 167 33.900 33.900 34.848 -0.948 19554 426 1 . 1 1 167 167 VAL H H 167 8.710 8.710 7.972 0.738 19554 427 1 . 1 1 168 168 VAL N N 168 118.360 118.360 116.212 2.148 19554 428 1 . 1 1 168 168 VAL HA H 168 5.240 5.240 4.590 0.650 19554 429 1 . 1 1 168 168 VAL C C 168 172.800 172.800 175.432 -2.632 19554 430 1 . 1 1 168 168 VAL CA C 168 57.860 57.860 59.670 -1.810 19554 431 1 . 1 1 168 168 VAL CB C 168 35.350 35.350 33.944 1.406 19554 432 1 . 1 1 168 168 VAL H H 168 8.560 8.560 8.044 0.516 19554 433 1 . 1 1 169 169 SER N N 169 106.720 106.720 118.182 -11.462 19554 434 1 . 1 1 169 169 SER HA H 169 4.480 4.480 4.641 -0.161 19554 435 1 . 1 1 169 169 SER C C 169 175.950 175.950 174.932 1.018 19554 436 1 . 1 1 169 169 SER CA C 169 55.550 55.550 57.523 -1.973 19554 437 1 . 1 1 169 169 SER CB C 169 64.980 64.980 64.830 0.150 19554 438 1 . 1 1 169 169 SER H H 169 8.600 8.600 8.560 0.040 19554 439 1 . 1 1 170 170 ARG N N 170 129.620 129.620 122.514 7.106 19554 440 1 . 1 1 170 170 ARG HA H 170 4.710 4.710 4.298 0.412 19554 441 1 . 1 1 170 170 ARG C C 170 177.870 177.870 178.145 -0.275 19554 442 1 . 1 1 170 170 ARG CA C 170 57.150 57.150 58.170 -1.020 19554 443 1 . 1 1 170 170 ARG H H 170 7.610 7.610 8.763 -1.153 19554 444 1 . 1 1 171 171 ARG N N 171 122.230 122.230 119.933 2.297 19554 445 1 . 1 1 171 171 ARG HA H 171 3.470 3.470 4.204 -0.734 19554 446 1 . 1 1 171 171 ARG C C 171 175.760 175.760 177.842 -2.082 19554 447 1 . 1 1 171 171 ARG CA C 171 59.430 59.430 58.376 1.054 19554 448 1 . 1 1 171 171 ARG CB C 171 30.410 30.410 29.768 0.642 19554 449 1 . 1 1 171 171 ARG H H 171 8.260 8.260 8.425 -0.165 19554 450 1 . 1 1 172 172 ALA N N 172 116.490 116.490 122.260 -5.770 19554 451 1 . 1 1 172 172 ALA HA H 172 4.050 4.050 4.229 -0.179 19554 452 1 . 1 1 172 172 ALA C C 172 179.480 179.480 179.243 0.237 19554 453 1 . 1 1 172 172 ALA CA C 172 54.010 54.010 54.212 -0.202 19554 454 1 . 1 1 172 172 ALA CB C 172 18.890 18.890 18.079 0.811 19554 455 1 . 1 1 172 172 ALA H H 172 7.760 7.760 7.992 -0.232 19554 456 1 . 1 1 173 173 VAL N N 173 116.440 116.440 119.950 -3.510 19554 457 1 . 1 1 173 173 VAL HA H 173 3.470 3.470 3.728 -0.258 19554 458 1 . 1 1 173 173 VAL C C 173 177.680 177.680 177.069 0.611 19554 459 1 . 1 1 173 173 VAL CA C 173 65.080 65.080 65.298 -0.218 19554 460 1 . 1 1 173 173 VAL CB C 173 31.880 31.880 31.745 0.136 19554 461 1 . 1 1 173 173 VAL H H 173 7.210 7.210 7.680 -0.470 19554 462 1 . 1 1 174 174 ILE N N 174 119.790 119.790 116.094 3.696 19554 463 1 . 1 1 174 174 ILE HA H 174 3.680 3.680 3.752 -0.072 19554 464 1 . 1 1 174 174 ILE C C 174 178.310 178.310 177.496 0.814 19554 465 1 . 1 1 174 174 ILE CA C 174 63.770 63.770 64.238 -0.468 19554 466 1 . 1 1 174 174 ILE CB C 174 38.450 38.450 37.153 1.297 19554 467 1 . 1 1 174 174 ILE H H 174 7.160 7.160 7.511 -0.351 19554 468 1 . 1 1 175 175 GLU N N 175 117.810 117.810 119.982 -2.172 19554 469 1 . 1 1 175 175 GLU HA H 175 4.030 4.030 4.074 -0.044 19554 470 1 . 1 1 175 175 GLU C C 175 177.170 177.170 178.601 -1.431 19554 471 1 . 1 1 175 175 GLU CA C 175 57.190 57.190 58.755 -1.565 19554 472 1 . 1 1 175 175 GLU CB C 175 29.640 29.640 29.401 0.239 19554 473 1 . 1 1 175 175 GLU H H 175 8.250 8.250 8.212 0.038 19554 474 1 . 1 1 176 176 SER N N 176 114.300 114.300 114.847 -0.547 19554 475 1 . 1 1 176 176 SER HA H 176 4.320 4.320 4.139 0.181 19554 476 1 . 1 1 176 176 SER C C 176 174.930 174.930 176.502 -1.572 19554 477 1 . 1 1 176 176 SER CA C 176 59.060 59.060 60.787 -1.727 19554 478 1 . 1 1 176 176 SER CB C 176 63.640 63.640 62.950 0.690 19554 479 1 . 1 1 176 176 SER H H 176 7.460 7.460 7.662 -0.202 19554 480 1 . 1 1 177 177 GLU N N 177 121.860 121.860 121.006 0.854 19554 481 1 . 1 1 177 177 GLU HA H 177 4.170 4.170 4.039 0.131 19554 482 1 . 1 1 177 177 GLU C C 177 176.340 176.340 177.585 -1.245 19554 483 1 . 1 1 177 177 GLU CA C 177 56.640 56.640 58.489 -1.849 19554 484 1 . 1 1 177 177 GLU CB C 177 29.750 29.750 29.772 -0.022 19554 485 1 . 1 1 177 177 GLU H H 177 7.890 7.890 7.848 0.042 19554 486 1 . 1 1 178 178 ASN N N 178 119.030 119.030 116.980 2.050 19554 487 1 . 1 1 178 178 ASN HA H 178 4.700 4.700 4.700 0.000 19554 488 1 . 1 1 178 178 ASN C C 178 174.230 174.230 174.943 -0.713 19554 489 1 . 1 1 178 178 ASN CA C 178 53.010 53.010 52.940 0.070 19554 490 1 . 1 1 178 178 ASN CB C 178 39.080 39.080 38.597 0.483 19554 491 1 . 1 1 178 178 ASN H H 178 8.110 8.110 7.909 0.202 19554 stop_ save_