NMR Restraints Grid |
Result table
image | mrblock_id | pdb_id | cing | stage | position | program | type |
627784 | 5xq5 | cing | 1-original | 3 | MR format | nomenclature mapping |
Entry H atom name Submitted Coord H atom name Start of MODEL 1 1 H LYS 1 H1 LYS 1 54.770 64.210 48.270 2 HA LYS 1 HA LYS 1 54.250 65.760 46.520 3 HB2 LYS 1 HB2 LYS 1 52.320 66.670 48.610 4 HB3 LYS 1 HB1 LYS 1 53.140 67.960 47.710 5 HG2 LYS 1 HG2 LYS 1 52.360 67.100 45.590 6 HG3 LYS 1 HG1 LYS 1 51.650 65.680 46.390 7 HD2 LYS 1 HD2 LYS 1 50.660 68.080 47.700 8 HD3 LYS 1 HD1 LYS 1 50.490 68.290 45.950 9 HE2 LYS 1 HE2 LYS 1 48.890 66.690 45.750 10 HE3 LYS 1 HE1 LYS 1 49.670 65.610 46.910 11 HZ1 LYS 1 HZ1 LYS 1 47.570 66.430 47.760 12 HZ2 LYS 1 HZ2 LYS 1 48.790 66.990 48.700 13 HZ3 LYS 1 HZ3 LYS 1 48.060 67.990 47.620 14 H ALA 2 H ALA 2 54.710 66.780 49.980 15 HA ALA 2 HA ALA 2 57.400 67.690 49.200 16 HB1 ALA 2 HB1 ALA 2 57.040 69.810 50.400 17 HB2 ALA 2 HB2 ALA 2 55.960 69.680 49.000 18 HB3 ALA 2 HB3 ALA 2 55.330 69.410 50.650 19 H ASN 3 H ASN 3 58.860 67.700 50.890 20 HA ASN 3 HA ASN 3 59.820 66.830 52.740 21 HB2 ASN 3 HB2 ASN 3 57.300 67.420 54.290 22 HB3 ASN 3 HB1 ASN 3 58.990 67.580 54.790 23 HD21 ASN 3 1HD2 ASN 3 56.230 69.110 53.520 24 HD22 ASN 3 2HD2 ASN 3 56.980 70.660 53.140 25 HA PRO 4 HA PRO 4 57.420 62.850 52.340 26 HB2 PRO 4 HB1 PRO 4 59.540 61.340 51.380 27 HB3 PRO 4 HB2 PRO 4 58.470 62.310 50.320 28 HG2 PRO 4 HG1 PRO 4 61.190 63.010 51.440 29 HG3 PRO 4 HG2 PRO 4 60.580 63.230 49.760 30 HD2 PRO 4 HD1 PRO 4 60.660 65.240 51.590 31 HD3 PRO 4 HD2 PRO 4 59.360 65.130 50.360 32 H TRP 5 H TRP 5 60.320 63.920 53.940 33 HA TRP 5 HA TRP 5 60.810 61.510 55.410 34 HB2 TRP 5 HB2 TRP 5 61.980 64.100 55.140 35 HB3 TRP 5 HB1 TRP 5 61.590 63.940 56.840 36 HD1 TRP 5 HD1 TRP 5 62.500 61.410 57.910 37 HE1 TRP 5 HE1 TRP 5 64.830 60.380 57.560 38 HE3 TRP 5 HE3 TRP 5 63.890 63.940 53.690 39 HZ2 TRP 5 HZ2 TRP 5 67.000 60.620 55.730 40 HZ3 TRP 5 HZ3 TRP 5 66.100 63.520 52.660 41 HH2 TRP 5 HH2 TRP 5 67.650 61.860 53.670 42 H GLN 6 H GLN 6 58.480 64.070 55.720 43 HA GLN 6 HA GLN 6 57.970 63.800 58.560 44 HB2 GLN 6 HB2 GLN 6 56.130 64.720 56.300 45 HB3 GLN 6 HB1 GLN 6 55.860 64.980 58.030 46 HG2 GLN 6 HG2 GLN 6 58.410 66.030 56.780 47 HG3 GLN 6 HG1 GLN 6 56.880 66.860 56.480 48 HE21 GLN 6 1HE2 GLN 6 59.310 66.030 58.890 49 HE22 GLN 6 2HE2 GLN 6 58.670 67.120 60.120 50 H GLN 7 H GLN 7 57.000 61.970 55.710 51 HA GLN 7 HA GLN 7 54.870 60.570 57.190 52 HB2 GLN 7 HB2 GLN 7 56.030 60.190 54.400 53 HB3 GLN 7 HB1 GLN 7 54.700 59.260 55.100 54 HG2 GLN 7 HG2 GLN 7 53.720 61.760 55.510 55 HG3 GLN 7 HG1 GLN 7 54.760 62.070 54.110 56 HE21 GLN 7 1HE2 GLN 7 53.610 62.040 52.290 57 HE22 GLN 7 2HE2 GLN 7 52.260 60.910 51.980 58 H PHE 8 H PHE 8 58.270 60.220 56.480 59 HA PHE 8 HA PHE 8 58.490 57.410 56.690 60 HB2 PHE 8 HB2 PHE 8 60.350 59.750 57.170 61 HB3 PHE 8 HB1 PHE 8 60.850 58.160 57.700 62 HD1 PHE 8 HD1 PHE 8 62.580 57.600 56.260 63 HD2 PHE 8 HD2 PHE 8 58.870 59.050 54.630 64 HE1 PHE 8 HE1 PHE 8 63.360 57.070 53.960 65 HE2 PHE 8 HE2 PHE 8 59.650 58.550 52.360 66 HZ PHE 8 HZ PHE 8 61.900 57.530 52.010 67 H ALA 9 H ALA 9 58.070 59.900 59.140 68 HA ALA 9 HA ALA 9 58.690 58.020 61.330 69 HB1 ALA 9 HB1 ALA 9 58.090 59.920 62.770 70 HB2 ALA 9 HB2 ALA 9 59.290 60.400 61.540 71 HB3 ALA 9 HB3 ALA 9 57.560 60.850 61.350 72 H GLU 10 H GLU 10 55.970 58.810 59.390 73 HA GLU 10 HA GLU 10 53.990 58.190 61.420 74 HB2 GLU 10 HB2 GLU 10 53.650 58.350 58.410 75 HB3 GLU 10 HB1 GLU 10 52.400 58.460 59.660 76 HG2 GLU 10 HG2 GLU 10 54.630 60.460 59.360 77 HG3 GLU 10 HG1 GLU 10 53.080 60.620 58.550 78 H THR 11 H THR 11 55.910 56.470 59.100 79 HA THR 11 HA THR 11 54.240 54.110 59.090 80 HB THR 11 HB THR 11 55.520 54.770 57.080 81 HG1 THR 11 HG1 THR 11 56.210 52.620 56.690 82 HG21 THR 11 1HG2 THR 11 57.930 54.170 57.050 83 HG22 THR 11 2HG2 THR 11 57.510 55.430 58.190 84 HG23 THR 11 3HG2 THR 11 57.870 53.800 58.800 85 H HIS 12 H HIS 12 55.950 55.390 61.480 86 HA HIS 12 HA HIS 12 57.600 53.120 62.250 87 HB2 HIS 12 HB2 HIS 12 58.090 54.380 64.210 88 HB3 HIS 12 HB1 HIS 12 57.960 55.570 62.900 89 HD2 HIS 12 HD2 HIS 12 57.400 56.250 66.110 90 HE1 HIS 12 HE1 HIS 12 53.400 56.810 64.750 91 HE2 HIS 12 HE2 HIS 12 55.040 57.300 66.640 92 H ASN 13 H ASN 13 54.310 53.600 62.230 93 HA ASN 13 HA ASN 13 53.540 52.470 64.730 94 HB2 ASN 13 HB2 ASN 13 52.230 53.250 62.200 95 HB3 ASN 13 HB1 ASN 13 51.490 51.860 62.920 96 HD21 ASN 13 1HD2 ASN 13 51.450 55.140 62.810 97 HD22 ASN 13 2HD2 ASN 13 50.630 55.460 64.340 98 H LYS 14 H LYS 14 52.110 50.420 64.690 99 HA LYS 14 HA LYS 14 52.760 48.280 63.000 100 HB2 LYS 14 HB2 LYS 14 54.250 46.920 64.430 101 HB3 LYS 14 HB1 LYS 14 55.040 48.330 63.780 102 HG2 LYS 14 HG2 LYS 14 55.650 48.970 65.830 103 HG3 LYS 14 HG1 LYS 14 53.970 49.230 66.250 104 HD2 LYS 14 HD2 LYS 14 54.240 47.690 67.810 105 HD3 LYS 14 HD1 LYS 14 54.100 46.490 66.520 106 HE2 LYS 14 HE2 LYS 14 56.450 46.270 66.270 107 HE3 LYS 14 HE1 LYS 14 56.770 47.750 67.200 108 HZ1 LYS 14 HZ1 LYS 14 57.170 45.790 68.530 109 HZ2 LYS 14 HZ2 LYS 14 55.910 46.650 69.160 110 HZ3 LYS 14 HZ3 LYS 14 55.620 45.260 68.310 111 H GLY 15 H GLY 15 50.830 47.330 63.190 112 HA2 GLY 15 HA2 GLY 15 49.620 45.600 64.490 113 HA3 GLY 15 HA1 GLY 15 49.870 46.610 65.940 114 H ASP 16 H ASP 16 49.220 48.570 63.280 115 HA ASP 16 HA ASP 16 46.430 48.880 64.180 116 HB2 ASP 16 HB2 ASP 16 47.810 50.800 62.330 117 HB3 ASP 16 HB1 ASP 16 46.540 51.080 63.530 118 H ARG 17 H ARG 17 45.060 49.900 62.250 119 HA ARG 17 HA ARG 17 45.340 48.020 59.940 120 HB2 ARG 17 HB2 ARG 17 42.700 49.080 60.930 121 HB3 ARG 17 HB1 ARG 17 43.020 47.750 59.820 122 HG2 ARG 17 HG2 ARG 17 42.750 46.370 61.600 123 HG3 ARG 17 HG1 ARG 17 44.310 46.960 62.220 124 HD2 ARG 17 HD2 ARG 17 43.110 48.870 63.270 125 HD3 ARG 17 HD1 ARG 17 41.610 47.950 62.960 126 HE ARG 17 HE ARG 17 43.620 46.320 64.250 127 HH11 ARG 17 1HH1 ARG 17 41.330 48.890 64.850 128 HH12 ARG 17 2HH1 ARG 17 41.110 48.510 66.530 129 HH21 ARG 17 1HH2 ARG 17 43.340 45.810 66.440 130 HH22 ARG 17 2HH2 ARG 17 42.260 46.750 67.430 131 H VAL 18 H VAL 18 45.550 48.910 58.030 132 HA VAL 18 HA VAL 18 44.700 51.760 57.710 133 HB VAL 18 HB VAL 18 46.540 52.090 56.130 134 HG11 VAL 18 1HG1 VAL 18 48.310 52.090 57.700 135 HG12 VAL 18 2HG1 VAL 18 46.870 52.680 58.470 136 HG13 VAL 18 3HG1 VAL 18 47.470 51.020 58.820 137 HG21 VAL 18 1HG2 VAL 18 48.300 50.400 55.890 138 HG22 VAL 18 2HG2 VAL 18 47.400 49.260 56.910 139 HG23 VAL 18 3HG2 VAL 18 46.770 49.760 55.320 140 H GLU 19 H GLU 19 44.840 52.200 55.110 141 HA GLU 19 HA GLU 19 43.520 49.990 53.700 142 HB2 GLU 19 HB2 GLU 19 42.220 52.490 54.630 143 HB3 GLU 19 HB1 GLU 19 42.090 52.230 52.890 144 HG2 GLU 19 HG2 GLU 19 41.300 49.810 53.580 145 HG3 GLU 19 HG1 GLU 19 41.050 50.520 55.160 146 H GLY 20 H GLY 20 43.890 49.940 51.580 147 HA2 GLY 20 HA2 GLY 20 46.200 51.230 50.570 148 HA3 GLY 20 HA1 GLY 20 45.000 50.360 49.570 149 H LYS 21 H LYS 21 46.550 53.050 49.500 150 HA LYS 21 HA LYS 21 44.250 54.860 49.190 151 HB2 LYS 21 HB2 LYS 21 45.900 56.640 48.890 152 HB3 LYS 21 HB1 LYS 21 46.190 55.730 50.380 153 HG2 LYS 21 HG2 LYS 21 48.030 54.500 49.320 154 HG3 LYS 21 HG1 LYS 21 47.680 55.290 47.780 155 HD2 LYS 21 HD2 LYS 21 49.470 56.500 48.560 156 HD3 LYS 21 HD1 LYS 21 48.060 57.510 48.990 157 HE2 LYS 21 HE2 LYS 21 48.120 56.390 51.280 158 HE3 LYS 21 HE1 LYS 21 49.660 55.670 50.820 159 HZ1 LYS 21 HZ1 LYS 21 49.960 57.690 52.080 160 HZ2 LYS 21 HZ2 LYS 21 50.550 57.880 50.550 161 HZ3 LYS 21 HZ3 LYS 21 49.090 58.550 51.000 162 H ILE 22 H ILE 22 43.600 55.770 47.280 163 HA ILE 22 HA ILE 22 44.440 54.330 44.850 164 HB ILE 22 HB ILE 22 42.030 55.030 45.440 165 HG12 ILE 22 2HG1 ILE 22 43.170 55.720 42.700 166 HG13 ILE 22 1HG1 ILE 22 42.640 54.150 43.330 167 HG21 ILE 22 1HG2 ILE 22 41.370 57.330 44.740 168 HG22 ILE 22 2HG2 ILE 22 42.550 57.390 46.050 169 HG23 ILE 22 3HG2 ILE 22 43.040 57.730 44.380 170 HD11 ILE 22 HD1 ILE 22 41.000 55.210 41.810 171 HD12 ILE 22 HD2 ILE 22 40.360 54.970 43.460 172 HD13 ILE 22 HD3 ILE 22 40.860 56.570 42.870 173 H LYS 23 H LYS 23 45.480 57.100 46.480 174 HA LYS 23 HA LYS 23 46.020 58.900 44.340 175 HB2 LYS 23 HB2 LYS 23 46.250 59.380 46.810 176 HB3 LYS 23 HB1 LYS 23 47.690 58.350 46.840 177 HG2 LYS 23 HG2 LYS 23 48.010 60.360 44.750 178 HG3 LYS 23 HG1 LYS 23 47.460 61.150 46.210 179 HD2 LYS 23 HD2 LYS 23 49.770 61.180 46.450 180 HD3 LYS 23 HD1 LYS 23 49.310 59.780 47.440 181 HE2 LYS 23 HE2 LYS 23 49.860 58.270 45.530 182 HE3 LYS 23 HE1 LYS 23 50.280 59.670 44.540 183 HZ1 LYS 23 HZ1 LYS 23 52.230 58.630 45.510 184 HZ2 LYS 23 HZ2 LYS 23 52.060 60.150 46.110 185 HZ3 LYS 23 HZ3 LYS 23 51.660 58.840 47.030 186 H SER 24 H SER 24 47.420 55.830 45.060 187 HA SER 24 HA SER 24 49.860 56.350 43.520 188 HB2 SER 24 HB2 SER 24 49.240 53.620 44.510 189 HB3 SER 24 HB1 SER 24 50.740 54.540 44.530 190 HG SER 24 HG SER 24 49.620 54.130 46.600 191 H ILE 25 H ILE 25 50.420 54.140 42.180 192 HA ILE 25 HA ILE 25 48.060 53.460 40.560 193 HB ILE 25 HB ILE 25 50.610 54.370 39.170 194 HG12 ILE 25 2HG1 ILE 25 48.180 56.120 39.760 195 HG13 ILE 25 1HG1 ILE 25 49.790 56.320 40.490 196 HG21 ILE 25 1HG2 ILE 25 49.070 54.620 37.240 197 HG22 ILE 25 2HG2 ILE 25 49.010 53.020 37.830 198 HG23 ILE 25 3HG2 ILE 25 47.690 54.130 38.270 199 HD11 ILE 25 HD1 ILE 25 49.500 57.930 38.770 200 HD12 ILE 25 HD2 ILE 25 50.800 56.780 38.350 201 HD13 ILE 25 HD3 ILE 25 49.190 56.680 37.570 202 H THR 26 H THR 26 48.620 51.750 38.950 203 HA THR 26 HA THR 26 50.410 49.810 40.220 204 HB THR 26 HB THR 26 48.490 49.300 37.960 205 HG1 THR 26 HG1 THR 26 47.040 48.670 39.670 206 HG21 THR 26 1HG2 THR 26 48.540 46.950 38.860 207 HG22 THR 26 2HG2 THR 26 50.140 47.500 38.330 208 HG23 THR 26 3HG2 THR 26 49.770 47.510 39.970 209 H ASP 27 H ASP 27 51.830 48.490 38.920 210 HA ASP 27 HA ASP 27 53.480 48.190 37.440 211 HB2 ASP 27 HB2 ASP 27 51.350 48.370 35.900 212 HB3 ASP 27 HB1 ASP 27 52.080 49.900 35.400 213 H PHE 28 H PHE 28 53.240 50.680 39.110 214 HA PHE 28 HA PHE 28 55.630 51.970 38.080 215 HB2 PHE 28 HB2 PHE 28 52.900 53.290 38.090 216 HB3 PHE 28 HB1 PHE 28 54.310 54.290 38.450 217 HD1 PHE 28 HD1 PHE 28 52.280 53.100 35.860 218 HD2 PHE 28 HD2 PHE 28 56.360 54.050 36.830 219 HE1 PHE 28 HE1 PHE 28 52.770 53.410 33.450 220 HE2 PHE 28 HE2 PHE 28 56.860 54.370 34.410 221 HZ PHE 28 HZ PHE 28 55.060 54.050 32.720 222 H GLY 29 H GLY 29 54.620 50.460 40.440 223 HA2 GLY 29 HA2 GLY 29 55.610 50.550 42.610 224 HA3 GLY 29 HA1 GLY 29 55.730 52.320 42.480 225 H ILE 30 H ILE 30 53.560 49.620 43.070 226 HA ILE 30 HA ILE 30 51.280 51.280 43.690 227 HB ILE 30 HB ILE 30 51.950 48.400 44.370 228 HG12 ILE 30 2HG1 ILE 30 49.970 49.710 42.460 229 HG13 ILE 30 1HG1 ILE 30 51.470 48.850 42.020 230 HG21 ILE 30 1HG2 ILE 30 49.630 48.160 45.220 231 HG22 ILE 30 2HG2 ILE 30 50.510 49.270 46.190 232 HG23 ILE 30 3HG2 ILE 30 49.370 49.910 44.980 233 HD11 ILE 30 HD1 ILE 30 49.420 47.430 41.800 234 HD12 ILE 30 HD2 ILE 30 50.550 46.740 42.960 235 HD13 ILE 30 HD3 ILE 30 49.020 47.600 43.370 236 H PHE 31 H PHE 31 50.990 52.550 45.360 237 HA PHE 31 HA PHE 31 52.490 51.920 47.850 238 HB2 PHE 31 HB2 PHE 31 51.460 54.660 47.170 239 HB3 PHE 31 HB1 PHE 31 52.620 54.240 48.360 240 HD1 PHE 31 HD1 PHE 31 52.230 55.740 45.270 241 HD2 PHE 31 HD2 PHE 31 54.690 52.860 47.260 242 HE1 PHE 31 HE1 PHE 31 54.040 56.130 43.610 243 HE2 PHE 31 HE2 PHE 31 56.520 53.250 45.620 244 HZ PHE 31 HZ PHE 31 56.180 54.900 43.790 245 H ILE 32 H ILE 32 51.440 51.630 49.720 246 HA ILE 32 HA ILE 32 48.510 52.280 49.770 247 HB ILE 32 HB ILE 32 48.220 50.220 51.170 248 HG12 ILE 32 2HG1 ILE 32 50.490 48.810 49.910 249 HG13 ILE 32 1HG1 ILE 32 51.050 50.060 50.990 250 HG21 ILE 32 1HG2 ILE 32 48.070 48.730 49.210 251 HG22 ILE 32 2HG2 ILE 32 47.450 50.360 48.860 252 HG23 ILE 32 3HG2 ILE 32 49.050 49.860 48.260 253 HD11 ILE 32 HD1 ILE 32 50.860 48.000 52.180 254 HD12 ILE 32 HD2 ILE 32 49.690 49.170 52.830 255 HD13 ILE 32 HD3 ILE 32 49.140 47.860 51.760 256 H GLY 33 H GLY 33 48.200 53.820 51.230 257 HA2 GLY 33 HA2 GLY 33 49.130 53.370 53.950 258 HA3 GLY 33 HA1 GLY 33 49.910 54.730 53.170 259 H LEU 34 H LEU 34 48.810 55.640 55.180 260 HA LEU 34 HA LEU 34 46.040 56.470 54.420 261 HB2 LEU 34 HB2 LEU 34 46.330 55.260 56.600 262 HB3 LEU 34 HB1 LEU 34 47.360 56.580 57.130 263 HG LEU 34 HG LEU 34 45.490 58.160 57.070 264 HD11 LEU 34 1HD1 LEU 34 43.210 57.380 56.560 265 HD12 LEU 34 2HD1 LEU 34 44.240 57.200 55.150 266 HD13 LEU 34 3HD1 LEU 34 43.850 55.770 56.140 267 HD21 LEU 34 1HD2 LEU 34 44.130 57.230 58.850 268 HD22 LEU 34 2HD2 LEU 34 44.800 55.610 58.530 269 HD23 LEU 34 3HD2 LEU 34 45.860 56.930 59.110 270 H ASP 35 H ASP 35 45.410 58.690 55.080 271 HA ASP 35 HA ASP 35 46.910 60.630 53.790 272 HB2 ASP 35 HB2 ASP 35 44.800 60.730 55.960 273 HB3 ASP 35 HB1 ASP 35 45.650 62.210 55.530 274 H GLY 36 H GLY 36 47.010 59.790 57.240 275 HA2 GLY 36 HA2 GLY 36 49.650 61.180 57.400 276 HA3 GLY 36 HA1 GLY 36 48.420 61.380 58.680 277 H GLY 37 H GLY 37 48.140 58.270 57.580 278 HA2 GLY 37 HA2 GLY 37 49.500 57.250 59.980 279 HA3 GLY 37 HA1 GLY 37 48.480 56.320 58.860 280 H ILE 38 H ILE 38 49.840 54.640 58.530 281 HA ILE 38 HA ILE 38 52.640 55.100 57.860 282 HB ILE 38 HB ILE 38 52.850 52.700 57.700 283 HG12 ILE 38 2HG1 ILE 38 50.220 51.790 58.210 284 HG13 ILE 38 1HG1 ILE 38 50.040 52.890 56.930 285 HG21 ILE 38 1HG2 ILE 38 52.010 51.990 59.890 286 HG22 ILE 38 2HG2 ILE 38 52.660 53.570 60.010 287 HG23 ILE 38 3HG2 ILE 38 50.920 53.400 59.970 288 HD11 ILE 38 HD1 ILE 38 50.370 50.630 56.090 289 HD12 ILE 38 HD2 ILE 38 51.710 51.680 55.590 290 HD13 ILE 38 HD3 ILE 38 51.930 50.530 56.890 291 H ASP 39 H ASP 39 53.580 53.960 55.900 292 HA ASP 39 HA ASP 39 51.820 54.120 53.550 293 HB2 ASP 39 HB2 ASP 39 53.570 55.360 52.330 294 HB3 ASP 39 HB1 ASP 39 52.870 56.300 53.640 295 H GLY 40 H GLY 40 52.290 52.790 51.900 296 HA2 GLY 40 HA2 GLY 40 54.600 50.950 52.320 297 HA3 GLY 40 HA1 GLY 40 53.000 50.390 51.810 298 H LEU 41 H LEU 41 55.100 49.630 50.320 299 HA LEU 41 HA LEU 41 54.520 50.910 47.810 300 HB2 LEU 41 HB2 LEU 41 56.690 51.630 47.230 301 HB3 LEU 41 HB1 LEU 41 56.360 52.290 48.830 302 HG LEU 41 HG LEU 41 57.620 49.980 49.570 303 HD11 LEU 41 1HD1 LEU 41 59.490 49.580 47.950 304 HD12 LEU 41 2HD1 LEU 41 57.990 49.280 47.190 305 HD13 LEU 41 3HD1 LEU 41 58.840 50.810 46.910 306 HD21 LEU 41 1HD2 LEU 41 59.580 51.450 49.880 307 HD22 LEU 41 2HD2 LEU 41 58.950 52.600 48.730 308 HD23 LEU 41 3HD2 LEU 41 58.140 52.260 50.310 309 H VAL 42 H VAL 42 54.810 49.640 46.060 310 HA VAL 42 HA VAL 42 56.290 47.090 46.430 311 HB VAL 42 HB VAL 42 53.470 47.190 45.290 312 HG11 VAL 42 1HG1 VAL 42 53.620 44.740 45.440 313 HG12 VAL 42 2HG1 VAL 42 54.880 45.380 44.390 314 HG13 VAL 42 3HG1 VAL 42 55.290 44.870 46.050 315 HG21 VAL 42 1HG2 VAL 42 52.740 46.050 47.340 316 HG22 VAL 42 2HG2 VAL 42 54.370 46.240 48.030 317 HG23 VAL 42 3HG2 VAL 42 53.350 47.660 47.690 318 H HIS 43 H HIS 43 57.860 47.470 45.020 319 HA HIS 43 HA HIS 43 57.260 48.590 42.360 320 HB2 HIS 43 HB2 HIS 43 59.820 47.380 43.480 321 HB3 HIS 43 HB1 HIS 43 59.660 48.290 41.970 322 HD2 HIS 43 HD2 HIS 43 57.810 50.720 43.350 323 HE1 HIS 43 HE1 HIS 43 61.380 51.340 45.590 324 HE2 HIS 43 HE2 HIS 43 59.180 52.390 44.870 325 H LEU 44 H LEU 44 57.290 45.480 43.790 326 HA LEU 44 HA LEU 44 58.060 43.900 41.530 327 HB2 LEU 44 HB2 LEU 44 56.000 43.100 43.620 328 HB3 LEU 44 HB1 LEU 44 57.090 42.050 42.700 329 HG LEU 44 HG LEU 44 57.930 44.000 44.890 330 HD11 LEU 44 1HD1 LEU 44 58.370 41.980 46.200 331 HD12 LEU 44 2HD1 LEU 44 56.660 42.110 45.760 332 HD13 LEU 44 3HD1 LEU 44 57.710 40.970 44.890 333 HD21 LEU 44 1HD2 LEU 44 60.130 42.890 44.700 334 HD22 LEU 44 2HD2 LEU 44 59.530 41.920 43.330 335 HD23 LEU 44 3HD2 LEU 44 59.690 43.680 43.180 336 H SER 45 H SER 45 55.300 45.820 42.080 337 HA SER 45 HA SER 45 53.490 44.290 40.370 338 HB2 SER 45 HB2 SER 45 52.850 45.900 42.320 339 HB3 SER 45 HB1 SER 45 53.150 47.200 41.140 340 HG SER 45 HG SER 45 50.960 46.510 41.150 341 H ASP 46 H ASP 46 56.250 45.980 39.680 342 HA ASP 46 HA ASP 46 55.340 47.460 37.370 343 HB2 ASP 46 HB2 ASP 46 58.020 46.690 38.520 344 HB3 ASP 46 HB1 ASP 46 57.920 47.370 36.930 345 H ILE 47 H ILE 47 55.500 44.250 37.940 346 HA ILE 47 HA ILE 47 56.360 43.550 35.180 347 HB ILE 47 HB ILE 47 55.600 41.560 37.350 348 HG12 ILE 47 2HG1 ILE 47 57.300 42.940 38.370 349 HG13 ILE 47 1HG1 ILE 47 57.980 41.380 37.940 350 HG21 ILE 47 1HG2 ILE 47 57.080 40.070 36.070 351 HG22 ILE 47 2HG2 ILE 47 55.770 40.710 35.050 352 HG23 ILE 47 3HG2 ILE 47 57.400 41.380 34.900 353 HD11 ILE 47 HD1 ILE 47 59.520 43.220 37.420 354 HD12 ILE 47 HD2 ILE 47 59.030 42.390 35.930 355 HD13 ILE 47 HD3 ILE 47 58.330 43.960 36.350 356 H SER 48 H SER 48 53.700 42.850 37.400 357 HA SER 48 HA SER 48 51.500 42.380 37.000 358 HB2 SER 48 HB2 SER 48 51.280 43.360 34.260 359 HB3 SER 48 HB1 SER 48 50.500 43.940 35.750 360 HG SER 48 HG SER 48 51.990 45.520 34.670 361 H TRP 49 H TRP 49 49.990 40.990 35.850 362 HA TRP 49 HA TRP 49 51.440 38.720 34.660 363 HB2 TRP 49 HB2 TRP 49 48.660 39.280 35.650 364 HB3 TRP 49 HB1 TRP 49 48.850 38.040 34.410 365 HD1 TRP 49 HD1 TRP 49 51.050 38.740 37.540 366 HE1 TRP 49 HE1 TRP 49 51.270 36.540 38.850 367 HE3 TRP 49 HE3 TRP 49 48.090 35.780 34.610 368 HZ2 TRP 49 HZ2 TRP 49 50.300 33.870 38.650 369 HZ3 TRP 49 HZ3 TRP 49 47.760 33.390 35.200 370 HH2 TRP 49 HH2 TRP 49 48.850 32.430 37.220 371 H ASN 50 H ASN 50 48.920 40.970 33.590 372 HA ASN 50 HA ASN 50 49.950 40.790 30.870 373 HB2 ASN 50 HB2 ASN 50 47.720 39.140 31.650 374 HB3 ASN 50 HB1 ASN 50 47.070 40.440 30.650 375 HD21 ASN 50 1HD2 ASN 50 48.950 40.930 28.770 376 HD22 ASN 50 2HD2 ASN 50 49.230 39.470 27.830 377 H VAL 51 H VAL 51 47.270 41.970 32.890 378 HA VAL 51 HA VAL 51 47.240 44.480 31.320 379 HB VAL 51 HB VAL 51 45.120 44.970 32.560 380 HG11 VAL 51 1HG1 VAL 51 43.750 43.370 31.290 381 HG12 VAL 51 2HG1 VAL 51 45.080 44.010 30.310 382 HG13 VAL 51 3HG1 VAL 51 45.180 42.360 30.980 383 HG21 VAL 51 1HG2 VAL 51 44.000 43.110 33.750 384 HG22 VAL 51 2HG2 VAL 51 45.440 42.090 33.550 385 HG23 VAL 51 3HG2 VAL 51 45.520 43.570 34.550 386 H ALA 52 H ALA 52 46.920 46.510 32.540 387 HA ALA 52 HA ALA 52 48.720 46.510 34.900 388 HB1 ALA 52 HB1 ALA 52 48.970 48.910 34.450 389 HB2 ALA 52 HB2 ALA 52 49.410 47.930 33.040 390 HB3 ALA 52 HB3 ALA 52 47.840 48.780 33.080 391 H GLY 53 H GLY 53 48.120 47.240 36.840 392 HA2 GLY 53 HA2 GLY 53 45.280 47.300 37.440 393 HA3 GLY 53 HA1 GLY 53 46.580 47.650 38.570 394 H GLU 54 H GLU 54 47.340 49.700 36.160 395 HA GLU 54 HA GLU 54 46.570 52.040 37.460 396 HB2 GLU 54 HB2 GLU 54 48.270 51.900 35.670 397 HB3 GLU 54 HB1 GLU 54 47.010 51.570 34.470 398 HG2 GLU 54 HG2 GLU 54 46.540 54.050 36.050 399 HG3 GLU 54 HG1 GLU 54 48.040 54.060 35.140 400 H GLU 55 H GLU 55 44.730 50.020 35.250 401 HA GLU 55 HA GLU 55 42.580 52.020 35.040 402 HB2 GLU 55 HB2 GLU 55 43.110 49.290 33.810 403 HB3 GLU 55 HB1 GLU 55 41.490 50.030 33.760 404 HG2 GLU 55 HG2 GLU 55 42.870 52.130 32.840 405 HG3 GLU 55 HG1 GLU 55 44.020 50.870 32.380 406 H ALA 56 H ALA 56 43.070 48.710 36.350 407 HA ALA 56 HA ALA 56 40.460 48.390 37.380 408 HB1 ALA 56 HB1 ALA 56 41.500 46.700 38.870 409 HB2 ALA 56 HB2 ALA 56 42.100 46.550 37.200 410 HB3 ALA 56 HB3 ALA 56 43.120 47.310 38.460 411 H VAL 57 H VAL 57 43.230 50.120 38.660 412 HA VAL 57 HA VAL 57 41.930 50.560 41.240 413 HB VAL 57 HB VAL 57 44.460 51.820 40.090 414 HG11 VAL 57 1HG1 VAL 57 45.010 52.360 42.440 415 HG12 VAL 57 2HG1 VAL 57 43.570 53.150 41.870 416 HG13 VAL 57 3HG1 VAL 57 43.450 51.730 42.930 417 HG21 VAL 57 1HG2 VAL 57 45.670 50.200 41.510 418 HG22 VAL 57 2HG2 VAL 57 44.110 49.440 41.980 419 HG23 VAL 57 3HG2 VAL 57 44.670 49.340 40.340 420 H ARG 58 H ARG 58 41.980 52.070 38.120 421 HA ARG 58 HA ARG 58 41.460 54.750 39.020 422 HB2 ARG 58 HB2 ARG 58 42.220 53.720 36.680 423 HB3 ARG 58 HB1 ARG 58 40.500 53.740 36.340 424 HG2 ARG 58 HG2 ARG 58 40.400 56.100 36.500 425 HG3 ARG 58 HG1 ARG 58 41.930 56.200 37.410 426 HD2 ARG 58 HD2 ARG 58 42.650 54.950 34.970 427 HD3 ARG 58 HD1 ARG 58 41.440 56.170 34.520 428 HE ARG 58 HE ARG 58 43.500 57.130 36.340 429 HH11 ARG 58 1HH1 ARG 58 42.790 56.420 33.000 430 HH12 ARG 58 2HH1 ARG 58 43.920 57.550 32.350 431 HH21 ARG 58 1HH2 ARG 58 45.010 58.610 35.510 432 HH22 ARG 58 2HH2 ARG 58 45.190 58.800 33.780 433 H GLU 59 H GLU 59 39.610 51.940 39.120 434 HA GLU 59 HA GLU 59 37.030 53.300 38.730 435 HB2 GLU 59 HB2 GLU 59 37.570 50.430 39.610 436 HB3 GLU 59 HB1 GLU 59 36.050 51.130 39.030 437 HG2 GLU 59 HG2 GLU 59 37.570 51.680 36.880 438 HG3 GLU 59 HG1 GLU 59 38.500 50.300 37.510 439 H TYR 60 H TYR 60 39.150 52.180 41.310 440 HA TYR 60 HA TYR 60 37.280 52.140 43.410 441 HB2 TYR 60 HB2 TYR 60 40.230 52.870 43.470 442 HB3 TYR 60 HB1 TYR 60 39.270 52.450 44.880 443 HD1 TYR 60 HD1 TYR 60 41.820 51.160 43.860 444 HD2 TYR 60 HD2 TYR 60 37.690 50.140 43.450 445 HE1 TYR 60 HE1 TYR 60 42.460 48.770 43.500 446 HE2 TYR 60 HE2 TYR 60 38.270 47.790 43.140 447 HH TYR 60 HH TYR 60 39.920 46.280 43.010 448 H LYS 61 H LYS 61 37.910 53.750 45.390 449 HA LYS 61 HA LYS 61 37.180 56.450 44.320 450 HB2 LYS 61 HB2 LYS 61 36.050 54.770 46.490 451 HB3 LYS 61 HB1 LYS 61 36.480 56.370 47.030 452 HG2 LYS 61 HG2 LYS 61 35.140 56.860 44.580 453 HG3 LYS 61 HG1 LYS 61 34.290 55.480 45.280 454 HD2 LYS 61 HD2 LYS 61 34.630 57.210 47.480 455 HD3 LYS 61 HD1 LYS 61 34.380 58.320 46.110 456 HE2 LYS 61 HE2 LYS 61 32.280 57.220 45.570 457 HE3 LYS 61 HE1 LYS 61 32.600 55.930 46.740 458 HZ1 LYS 61 HZ1 LYS 61 31.090 57.560 47.640 459 HZ2 LYS 61 HZ2 LYS 61 32.490 57.560 48.510 460 HZ3 LYS 61 HZ3 LYS 61 32.190 58.780 47.430 461 H LYS 62 H LYS 62 37.560 58.130 46.200 462 HA LYS 62 HA LYS 62 40.380 58.470 46.310 463 HB2 LYS 62 HB2 LYS 62 38.820 60.350 46.400 464 HB3 LYS 62 HB1 LYS 62 38.170 59.780 47.940 465 HG2 LYS 62 HG2 LYS 62 41.100 60.100 48.080 466 HG3 LYS 62 HG1 LYS 62 40.300 61.580 47.530 467 HD2 LYS 62 HD2 LYS 62 38.740 61.430 49.480 468 HD3 LYS 62 HD1 LYS 62 39.640 60.020 50.070 469 HE2 LYS 62 HE2 LYS 62 41.190 62.520 49.420 470 HE3 LYS 62 HE1 LYS 62 40.150 62.560 50.850 471 HZ1 LYS 62 HZ1 LYS 62 42.390 61.800 51.440 472 HZ2 LYS 62 HZ2 LYS 62 41.310 60.610 51.700 473 HZ3 LYS 62 HZ3 LYS 62 42.280 60.540 50.390 474 H GLY 63 H GLY 63 41.720 57.230 47.410 475 HA2 GLY 63 HA2 GLY 63 42.810 56.420 49.350 476 HA3 GLY 63 HA1 GLY 63 41.390 56.940 50.320 477 H ASP 64 H ASP 64 40.390 55.140 47.590 478 HA ASP 64 HA ASP 64 40.000 52.790 49.350 479 HB2 ASP 64 HB2 ASP 64 38.370 54.180 47.340 480 HB3 ASP 64 HB1 ASP 64 38.500 52.460 47.000 481 H GLU 65 H GLU 65 40.580 50.790 48.720 482 HA GLU 65 HA GLU 65 41.430 49.960 46.180 483 HB2 GLU 65 HB2 GLU 65 43.310 51.450 46.240 484 HB3 GLU 65 HB1 GLU 65 43.640 51.040 47.920 485 HG2 GLU 65 HG2 GLU 65 44.650 49.090 47.420 486 HG3 GLU 65 HG1 GLU 65 43.850 48.920 45.840 487 H ILE 66 H ILE 66 42.950 49.580 49.390 488 HA ILE 66 HA ILE 66 41.830 46.840 49.540 489 HB ILE 66 HB ILE 66 44.040 45.890 50.180 490 HG12 ILE 66 2HG1 ILE 66 45.620 48.120 49.000 491 HG13 ILE 66 1HG1 ILE 66 44.860 48.480 50.550 492 HG21 ILE 66 1HG2 ILE 66 45.040 45.800 47.940 493 HG22 ILE 66 2HG2 ILE 66 43.250 45.630 47.900 494 HG23 ILE 66 3HG2 ILE 66 44.010 47.130 47.420 495 HD11 ILE 66 HD1 ILE 66 47.080 47.680 50.870 496 HD12 ILE 66 HD2 ILE 66 45.910 46.570 51.590 497 HD13 ILE 66 HD3 ILE 66 46.690 46.160 50.030 498 H ALA 67 H ALA 67 42.650 45.810 51.740 499 HA ALA 67 HA ALA 67 42.870 47.860 53.840 500 HB1 ALA 67 HB1 ALA 67 40.950 46.920 55.080 501 HB2 ALA 67 HB2 ALA 67 40.450 47.610 53.520 502 HB3 ALA 67 HB3 ALA 67 40.590 45.840 53.710 503 H ALA 68 H ALA 68 44.310 47.270 55.270 504 HA ALA 68 HA ALA 68 44.420 44.570 56.270 505 HB1 ALA 68 HB1 ALA 68 46.750 44.100 55.530 506 HB2 ALA 68 HB2 ALA 68 45.630 44.260 54.160 507 HB3 ALA 68 HB3 ALA 68 46.750 45.580 54.550 508 H VAL 69 H VAL 69 46.530 44.330 57.630 509 HA VAL 69 HA VAL 69 46.780 46.820 59.210 510 HB VAL 69 HB VAL 69 47.440 45.360 61.120 511 HG11 VAL 69 1HG1 VAL 69 45.220 44.410 61.540 512 HG12 VAL 69 2HG1 VAL 69 45.140 45.990 60.730 513 HG13 VAL 69 3HG1 VAL 69 44.800 44.560 59.800 514 HG21 VAL 69 1HG2 VAL 69 47.150 42.960 60.990 515 HG22 VAL 69 2HG2 VAL 69 46.810 43.070 59.240 516 HG23 VAL 69 3HG2 VAL 69 48.390 43.520 59.870 517 H VAL 70 H VAL 70 48.700 47.650 59.840 518 HA VAL 70 HA VAL 70 51.050 46.560 58.340 519 HB VAL 70 HB VAL 70 50.640 48.840 57.820 520 HG11 VAL 70 1HG1 VAL 70 50.590 50.570 59.610 521 HG12 VAL 70 2HG1 VAL 70 49.220 49.480 59.710 522 HG13 VAL 70 3HG1 VAL 70 50.620 49.450 60.820 523 HG21 VAL 70 1HG2 VAL 70 52.780 49.910 58.620 524 HG22 VAL 70 2HG2 VAL 70 52.960 48.680 59.830 525 HG23 VAL 70 3HG2 VAL 70 52.960 48.200 58.120 526 H LEU 71 H LEU 71 52.380 45.320 59.430 527 HA LEU 71 HA LEU 71 52.710 45.810 62.380 528 HB2 LEU 71 HB2 LEU 71 53.550 43.240 61.080 529 HB3 LEU 71 HB1 LEU 71 53.040 43.560 62.730 530 HG LEU 71 HG LEU 71 51.320 42.280 61.850 531 HD11 LEU 71 1HD1 LEU 71 49.350 43.720 61.690 532 HD12 LEU 71 2HD1 LEU 71 50.430 44.280 62.980 533 HD13 LEU 71 3HD1 LEU 71 50.290 45.090 61.440 534 HD21 LEU 71 1HD2 LEU 71 50.330 42.670 59.760 535 HD22 LEU 71 2HD2 LEU 71 51.420 43.920 59.310 536 HD23 LEU 71 3HD2 LEU 71 52.050 42.280 59.530 537 H GLN 72 H GLN 72 54.400 45.170 59.330 538 HA GLN 72 HA GLN 72 56.820 46.280 60.630 539 HB2 GLN 72 HB2 GLN 72 56.510 43.530 59.930 540 HB3 GLN 72 HB1 GLN 72 57.450 44.270 58.620 541 HG2 GLN 72 HG2 GLN 72 59.150 43.710 59.910 542 HG3 GLN 72 HG1 GLN 72 58.870 45.330 60.530 543 HE21 GLN 72 1HE2 GLN 72 58.930 41.920 61.210 544 HE22 GLN 72 2HE2 GLN 72 58.440 42.070 62.900 545 H VAL 73 H VAL 73 57.750 47.870 59.470 546 HA VAL 73 HA VAL 73 57.590 47.890 56.590 547 HB VAL 73 HB VAL 73 56.660 50.290 56.650 548 HG11 VAL 73 1HG1 VAL 73 54.360 49.520 56.510 549 HG12 VAL 73 2HG1 VAL 73 55.590 48.340 55.900 550 HG13 VAL 73 3HG1 VAL 73 54.780 48.020 57.350 551 HG21 VAL 73 1HG2 VAL 73 55.080 50.740 58.520 552 HG22 VAL 73 2HG2 VAL 73 55.630 49.300 59.360 553 HG23 VAL 73 3HG2 VAL 73 56.780 50.630 59.070 554 H ASP 74 H ASP 74 59.340 48.760 55.760 555 HA ASP 74 HA ASP 74 60.970 50.530 57.550 556 HB2 ASP 74 HB2 ASP 74 62.090 48.650 55.520 557 HB3 ASP 74 HB1 ASP 74 62.970 49.540 56.750 558 H ALA 75 H ALA 75 61.570 52.440 56.760 559 HA ALA 75 HA ALA 75 60.630 53.200 54.110 560 HB1 ALA 75 HB1 ALA 75 61.530 55.350 54.690 561 HB2 ALA 75 HB2 ALA 75 60.540 54.760 56.020 562 HB3 ALA 75 HB3 ALA 75 62.330 54.720 56.150 563 H GLU 76 H GLU 76 63.670 52.220 55.480 564 HA GLU 76 HA GLU 76 65.160 53.050 53.070 565 HB2 GLU 76 HB2 GLU 76 65.930 51.780 55.730 566 HB3 GLU 76 HB1 GLU 76 67.070 51.820 54.390 567 HG2 GLU 76 HG2 GLU 76 65.760 54.250 55.670 568 HG3 GLU 76 HG1 GLU 76 67.420 53.690 55.920 569 H ARG 77 H ARG 77 63.960 50.110 54.630 570 HA ARG 77 HA ARG 77 65.250 48.440 52.580 571 HB2 ARG 77 HB2 ARG 77 64.630 47.960 55.200 572 HB3 ARG 77 HB1 ARG 77 63.190 47.340 54.390 573 HG2 ARG 77 HG2 ARG 77 64.310 45.410 54.170 574 HG3 ARG 77 HG1 ARG 77 65.140 46.200 52.840 575 HD2 ARG 77 HD2 ARG 77 66.020 46.190 55.780 576 HD3 ARG 77 HD1 ARG 77 66.670 45.140 54.520 577 HE ARG 77 HE ARG 77 67.360 47.910 55.000 578 HH11 ARG 77 1HH1 ARG 77 67.030 45.510 52.470 579 HH12 ARG 77 2HH1 ARG 77 68.190 46.270 51.420 580 HH21 ARG 77 1HH2 ARG 77 68.850 48.900 53.620 581 HH22 ARG 77 2HH2 ARG 77 69.220 48.200 52.090 582 H GLU 78 H GLU 78 62.240 50.070 53.070 583 HA GLU 78 HA GLU 78 60.330 50.170 51.900 584 HB2 GLU 78 HB2 GLU 78 61.900 48.790 49.670 585 HB3 GLU 78 HB1 GLU 78 60.480 49.730 49.580 586 HG2 GLU 78 HG2 GLU 78 61.740 51.760 50.400 587 HG3 GLU 78 HG1 GLU 78 63.200 50.750 50.390 588 H ARG 79 H ARG 79 60.970 47.760 53.480 589 HA ARG 79 HA ARG 79 59.490 45.640 52.030 590 HB2 ARG 79 HB2 ARG 79 60.220 44.150 53.810 591 HB3 ARG 79 HB1 ARG 79 61.570 44.920 52.970 592 HG2 ARG 79 HG2 ARG 79 62.370 45.530 54.960 593 HG3 ARG 79 HG1 ARG 79 61.030 46.640 55.130 594 HD2 ARG 79 HD2 ARG 79 60.660 45.470 57.020 595 HD3 ARG 79 HD1 ARG 79 59.810 44.380 55.930 596 HE ARG 79 HE ARG 79 62.660 43.820 56.180 597 HH11 ARG 79 1HH1 ARG 79 59.540 43.370 57.620 598 HH12 ARG 79 2HH1 ARG 79 59.950 41.880 58.460 599 HH21 ARG 79 1HH2 ARG 79 63.230 41.890 57.250 600 HH22 ARG 79 2HH2 ARG 79 62.070 41.050 58.240 601 H ILE 80 H ILE 80 57.370 45.780 52.220 602 HA ILE 80 HA ILE 80 56.240 46.550 54.880 603 HB ILE 80 HB ILE 80 54.750 46.480 52.240 604 HG12 ILE 80 2HG1 ILE 80 56.610 48.020 51.920 605 HG13 ILE 80 1HG1 ILE 80 55.090 48.880 52.050 606 HG21 ILE 80 1HG2 ILE 80 53.190 48.020 53.380 607 HG22 ILE 80 2HG2 ILE 80 53.340 46.470 54.280 608 HG23 ILE 80 3HG2 ILE 80 54.070 47.910 54.810 609 HD11 ILE 80 HD1 ILE 80 56.930 50.030 53.250 610 HD12 ILE 80 HD2 ILE 80 55.610 49.590 54.290 611 HD13 ILE 80 HD3 ILE 80 57.130 48.610 54.300 612 H SER 81 H SER 81 55.040 45.230 56.030 613 HA SER 81 HA SER 81 54.070 42.740 54.730 614 HB2 SER 81 HB2 SER 81 54.730 41.970 57.320 615 HB3 SER 81 HB1 SER 81 55.610 41.570 55.840 616 HG SER 81 HG SER 81 56.930 42.490 57.480 617 H LEU 82 H LEU 82 52.070 42.190 55.180 618 HA LEU 82 HA LEU 82 50.730 43.580 57.400 619 HB2 LEU 82 HB2 LEU 82 48.640 43.180 55.960 620 HB3 LEU 82 HB1 LEU 82 49.690 44.540 55.610 621 HG LEU 82 HG LEU 82 50.780 43.250 53.790 622 HD11 LEU 82 1HD1 LEU 82 49.730 41.160 52.960 623 HD12 LEU 82 2HD1 LEU 82 50.420 40.960 54.550 624 HD13 LEU 82 3HD1 LEU 82 48.710 41.090 54.370 625 HD21 LEU 82 1HD2 LEU 82 48.920 43.360 52.210 626 HD22 LEU 82 2HD2 LEU 82 47.780 43.470 53.550 627 HD23 LEU 82 3HD2 LEU 82 48.950 44.770 53.290 628 H GLY 83 H GLY 83 49.010 42.510 58.460 629 HA2 GLY 83 HA2 GLY 83 49.430 39.570 58.550 630 HA3 GLY 83 HA1 GLY 83 48.760 40.580 59.850 631 H VAL 84 H VAL 84 47.390 41.620 57.030 632 HA VAL 84 HA VAL 84 44.810 40.790 57.670 633 HB VAL 84 HB VAL 84 45.190 42.600 56.160 634 HG11 VAL 84 1HG1 VAL 84 45.970 42.240 53.800 635 HG12 VAL 84 2HG1 VAL 84 47.110 41.900 55.100 636 HG13 VAL 84 3HG1 VAL 84 46.320 40.570 54.190 637 HG21 VAL 84 1HG2 VAL 84 43.600 42.080 54.330 638 HG22 VAL 84 2HG2 VAL 84 43.750 40.360 54.690 639 HG23 VAL 84 3HG2 VAL 84 43.050 41.460 55.920 640 H LYS 85 H LYS 85 47.340 39.170 55.810 641 HA LYS 85 HA LYS 85 45.560 37.160 54.710 642 HB2 LYS 85 HB2 LYS 85 48.530 37.710 54.800 643 HB3 LYS 85 HB1 LYS 85 48.050 36.020 54.630 644 HG2 LYS 85 HG2 LYS 85 46.440 37.490 52.770 645 HG3 LYS 85 HG1 LYS 85 48.090 38.130 52.650 646 HD2 LYS 85 HD2 LYS 85 48.880 35.690 52.510 647 HD3 LYS 85 HD1 LYS 85 47.160 35.260 52.330 648 HE2 LYS 85 HE2 LYS 85 47.050 36.820 50.350 649 HE3 LYS 85 HE1 LYS 85 48.800 37.090 50.510 650 HZ1 LYS 85 HZ1 LYS 85 48.300 35.390 48.880 651 HZ2 LYS 85 HZ2 LYS 85 49.130 34.720 50.140 652 HZ3 LYS 85 HZ3 LYS 85 47.500 34.480 49.990 653 H GLN 86 H GLN 86 47.450 37.480 57.640 654 HA GLN 86 HA GLN 86 47.020 34.650 58.380 655 HB2 GLN 86 HB2 GLN 86 49.140 35.680 59.010 656 HB3 GLN 86 HB1 GLN 86 48.320 37.030 59.800 657 HG2 GLN 86 HG2 GLN 86 49.160 35.450 61.460 658 HG3 GLN 86 HG1 GLN 86 47.410 35.550 61.530 659 HE21 GLN 86 1HE2 GLN 86 49.770 33.720 59.510 660 HE22 GLN 86 2HE2 GLN 86 49.020 32.150 59.840 661 H LEU 87 H LEU 87 45.430 37.720 58.740 662 HA LEU 87 HA LEU 87 44.090 37.180 61.190 663 HB2 LEU 87 HB2 LEU 87 44.310 39.350 59.500 664 HB3 LEU 87 HB1 LEU 87 42.710 38.780 59.040 665 HG LEU 87 HG LEU 87 42.300 38.770 61.690 666 HD11 LEU 87 1HD1 LEU 87 43.490 40.670 62.740 667 HD12 LEU 87 2HD1 LEU 87 44.620 39.390 62.260 668 HD13 LEU 87 3HD1 LEU 87 44.490 40.870 61.280 669 HD21 LEU 87 1HD2 LEU 87 41.410 41.060 61.450 670 HD22 LEU 87 2HD2 LEU 87 42.330 41.270 59.940 671 HD23 LEU 87 3HD2 LEU 87 41.030 40.060 60.040 672 H ALA 88 H ALA 88 42.840 36.970 57.810 673 HA ALA 88 HA ALA 88 41.630 34.460 58.190 674 HB1 ALA 88 HB1 ALA 88 39.240 35.160 58.220 675 HB2 ALA 88 HB2 ALA 88 40.070 35.680 59.690 676 HB3 ALA 88 HB3 ALA 88 39.750 36.850 58.390 677 H GLU 89 H GLU 89 40.450 33.740 56.340 678 HA GLU 89 HA GLU 89 41.480 34.880 53.900 679 HB2 GLU 89 HB2 GLU 89 40.350 32.380 54.740 680 HB3 GLU 89 HB1 GLU 89 39.290 32.990 53.470 681 HG2 GLU 89 HG2 GLU 89 41.250 33.280 51.970 682 HG3 GLU 89 HG1 GLU 89 42.300 32.620 53.230 683 H ASP 90 H ASP 90 39.690 34.890 51.990 684 HA ASP 90 HA ASP 90 37.350 36.420 52.880 685 HB2 ASP 90 HB2 ASP 90 39.230 37.520 50.770 686 HB3 ASP 90 HB1 ASP 90 37.820 38.310 51.450 687 HA PRO 91 HA PRO 91 35.390 34.290 49.580 688 HB2 PRO 91 HB1 PRO 91 33.380 36.070 48.890 689 HB3 PRO 91 HB2 PRO 91 33.370 35.130 50.420 690 HG2 PRO 91 HG1 PRO 91 34.260 37.980 49.940 691 HG3 PRO 91 HG2 PRO 91 33.230 37.330 51.270 692 HD2 PRO 91 HD1 PRO 91 35.870 37.830 51.570 693 HD3 PRO 91 HD2 PRO 91 35.090 36.470 52.410 694 H PHE 92 H PHE 92 37.120 37.140 49.060 695 HA PHE 92 HA PHE 92 37.220 36.590 46.190 696 HB2 PHE 92 HB2 PHE 92 36.020 39.010 47.440 697 HB3 PHE 92 HB1 PHE 92 37.250 39.380 46.250 698 HD1 PHE 92 HD1 PHE 92 33.850 38.440 46.740 699 HD2 PHE 92 HD2 PHE 92 37.110 38.300 43.920 700 HE1 PHE 92 HE1 PHE 92 32.230 38.090 44.880 701 HE2 PHE 92 HE2 PHE 92 35.500 37.950 42.070 702 HZ PHE 92 HZ PHE 92 33.060 37.840 42.550 703 H ASN 93 H ASN 93 38.920 38.210 45.190 704 HA ASN 93 HA ASN 93 41.100 38.750 47.070 705 HB2 ASN 93 HB2 ASN 93 41.190 36.290 46.110 706 HB3 ASN 93 HB1 ASN 93 41.730 37.070 44.620 707 HD21 ASN 93 1HD2 ASN 93 42.460 36.390 47.990 708 HD22 ASN 93 2HD2 ASN 93 44.170 36.820 47.870 709 H ASN 94 H ASN 94 42.180 40.530 46.480 710 HA ASN 94 HA ASN 94 41.330 42.170 44.350 711 HB2 ASN 94 HB2 ASN 94 43.170 43.600 44.960 712 HB3 ASN 94 HB1 ASN 94 42.450 42.990 46.460 713 HD21 ASN 94 1HD2 ASN 94 45.300 43.610 44.980 714 HD22 ASN 94 2HD2 ASN 94 46.340 42.480 45.820 Start of MODEL 2 1 H LYS 1 H1 LYS 1 61.793 67.442 48.440 2 HA LYS 1 HA LYS 1 60.563 67.072 46.420 3 HB2 LYS 1 HB2 LYS 1 63.233 67.612 45.250 4 HB3 LYS 1 HB1 LYS 1 62.483 66.152 44.620 5 HG2 LYS 1 HG2 LYS 1 60.333 67.812 44.440 6 HG3 LYS 1 HG1 LYS 1 61.643 69.012 44.340 7 HD2 LYS 1 HD2 LYS 1 62.683 67.512 42.530 8 HD3 LYS 1 HD1 LYS 1 61.183 66.582 42.550 9 HE2 LYS 1 HE2 LYS 1 60.753 69.512 42.350 10 HE3 LYS 1 HE1 LYS 1 61.763 68.892 41.040 11 HZ1 LYS 1 HZ1 LYS 1 59.423 68.792 40.450 12 HZ2 LYS 1 HZ2 LYS 1 60.043 67.272 40.520 13 HZ3 LYS 1 HZ3 LYS 1 59.083 67.822 41.740 14 H ALA 2 H ALA 2 63.433 65.532 47.870 15 HA ALA 2 HA ALA 2 61.943 62.982 47.830 16 HB1 ALA 2 HB1 ALA 2 64.033 61.842 47.210 17 HB2 ALA 2 HB2 ALA 2 63.513 62.932 45.910 18 HB3 ALA 2 HB3 ALA 2 64.863 63.392 47.010 19 H ASN 3 H ASN 3 61.753 64.462 50.000 20 HA ASN 3 HA ASN 3 63.603 63.132 51.890 21 HB2 ASN 3 HB2 ASN 3 63.093 66.122 52.010 22 HB3 ASN 3 HB1 ASN 3 64.063 65.152 53.140 23 HD21 ASN 3 1HD2 ASN 3 64.143 67.072 50.400 24 HD22 ASN 3 2HD2 ASN 3 65.773 66.612 49.850 25 HA PRO 4 HA PRO 4 59.103 63.152 53.070 26 HB2 PRO 4 HB1 PRO 4 58.833 60.412 53.340 27 HB3 PRO 4 HB2 PRO 4 58.623 61.262 51.800 28 HG2 PRO 4 HG1 PRO 4 61.063 59.822 52.870 29 HG3 PRO 4 HG2 PRO 4 60.323 59.712 51.240 30 HD2 PRO 4 HD1 PRO 4 62.493 61.262 51.780 31 HD3 PRO 4 HD2 PRO 4 61.233 61.762 50.600 32 H TRP 5 H TRP 5 60.263 64.242 54.910 33 HA TRP 5 HA TRP 5 61.143 62.482 57.090 34 HB2 TRP 5 HB2 TRP 5 60.713 65.472 56.780 35 HB3 TRP 5 HB1 TRP 5 61.113 64.752 58.330 36 HD1 TRP 5 HD1 TRP 5 63.273 62.592 57.170 37 HE1 TRP 5 HE1 TRP 5 65.583 63.442 56.510 38 HE3 TRP 5 HE3 TRP 5 62.133 67.542 56.560 39 HZ2 TRP 5 HZ2 TRP 5 66.793 65.952 55.810 40 HZ3 TRP 5 HZ3 TRP 5 63.903 69.152 55.900 41 HH2 TRP 5 HH2 TRP 5 66.233 68.372 55.520 42 H GLN 6 H GLN 6 58.183 64.042 56.170 43 HA GLN 6 HA GLN 6 56.913 63.722 58.800 44 HB2 GLN 6 HB2 GLN 6 55.663 64.182 56.050 45 HB3 GLN 6 HB1 GLN 6 54.863 64.372 57.610 46 HG2 GLN 6 HG2 GLN 6 57.363 66.012 57.180 47 HG3 GLN 6 HG1 GLN 6 55.953 66.412 56.220 48 HE21 GLN 6 1HE2 GLN 6 54.523 67.802 57.130 49 HE22 GLN 6 2HE2 GLN 6 54.433 68.102 58.870 50 H GLN 7 H GLN 7 57.373 61.732 55.910 51 HA GLN 7 HA GLN 7 55.223 59.862 56.610 52 HB2 GLN 7 HB2 GLN 7 57.543 59.512 54.680 53 HB3 GLN 7 HB1 GLN 7 56.063 58.562 54.760 54 HG2 GLN 7 HG2 GLN 7 54.863 60.872 54.350 55 HG3 GLN 7 HG1 GLN 7 56.443 61.392 53.740 56 HE21 GLN 7 1HE2 GLN 7 53.663 60.702 52.520 57 HE22 GLN 7 2HE2 GLN 7 54.133 59.672 51.170 58 H PHE 8 H PHE 8 58.643 60.292 57.330 59 HA PHE 8 HA PHE 8 59.293 57.632 58.020 60 HB2 PHE 8 HB2 PHE 8 60.323 60.362 58.620 61 HB3 PHE 8 HB1 PHE 8 60.663 59.182 59.860 62 HD1 PHE 8 HD1 PHE 8 62.843 58.432 59.720 63 HD2 PHE 8 HD2 PHE 8 60.563 58.952 56.100 64 HE1 PHE 8 HE1 PHE 8 64.753 57.572 58.390 65 HE2 PHE 8 HE2 PHE 8 62.473 58.132 54.770 66 HZ PHE 8 HZ PHE 8 64.573 57.432 55.910 67 H ALA 9 H ALA 9 57.383 60.022 59.750 68 HA ALA 9 HA ALA 9 57.383 58.442 62.240 69 HB1 ALA 9 HB1 ALA 9 55.833 60.202 63.010 70 HB2 ALA 9 HB2 ALA 9 57.303 60.932 62.310 71 HB3 ALA 9 HB3 ALA 9 55.773 60.902 61.380 72 H GLU 10 H GLU 10 55.483 58.692 59.300 73 HA GLU 10 HA GLU 10 53.083 57.532 60.440 74 HB2 GLU 10 HB2 GLU 10 53.963 57.702 57.530 75 HB3 GLU 10 HB1 GLU 10 52.333 57.382 58.120 76 HG2 GLU 10 HG2 GLU 10 53.913 59.932 58.500 77 HG3 GLU 10 HG1 GLU 10 52.613 59.712 57.350 78 H THR 11 H THR 11 56.013 56.352 58.830 79 HA THR 11 HA THR 11 55.103 53.562 58.680 80 HB THR 11 HB THR 11 56.513 54.462 56.920 81 HG1 THR 11 HG1 THR 11 58.023 52.752 56.980 82 HG21 THR 11 1HG2 THR 11 58.903 54.872 57.420 83 HG22 THR 11 2HG2 THR 11 57.853 55.992 58.280 84 HG23 THR 11 3HG2 THR 11 58.593 54.642 59.170 85 H HIS 12 H HIS 12 55.793 55.342 61.270 86 HA HIS 12 HA HIS 12 57.533 53.322 62.600 87 HB2 HIS 12 HB2 HIS 12 58.053 55.662 62.970 88 HB3 HIS 12 HB1 HIS 12 56.403 55.972 63.540 89 HD2 HIS 12 HD2 HIS 12 55.823 55.292 66.070 90 HE1 HIS 12 HE1 HIS 12 59.703 53.862 67.130 91 HE2 HIS 12 HE2 HIS 12 57.393 54.522 68.040 92 H ASN 13 H ASN 13 54.193 54.102 62.220 93 HA ASN 13 HA ASN 13 53.253 53.082 64.750 94 HB2 ASN 13 HB2 ASN 13 52.133 54.122 62.250 95 HB3 ASN 13 HB1 ASN 13 51.243 52.722 62.840 96 HD21 ASN 13 1HD2 ASN 13 50.873 55.802 62.740 97 HD22 ASN 13 2HD2 ASN 13 50.223 56.132 64.340 98 H LYS 14 H LYS 14 51.543 51.222 64.590 99 HA LYS 14 HA LYS 14 51.993 49.002 62.950 100 HB2 LYS 14 HB2 LYS 14 53.243 47.492 64.540 101 HB3 LYS 14 HB1 LYS 14 54.223 48.702 63.760 102 HG2 LYS 14 HG2 LYS 14 53.123 49.712 66.320 103 HG3 LYS 14 HG1 LYS 14 54.003 48.202 66.530 104 HD2 LYS 14 HD2 LYS 14 56.013 49.122 65.820 105 HD3 LYS 14 HD1 LYS 14 55.243 50.362 64.850 106 HE2 LYS 14 HE2 LYS 14 55.013 51.842 66.530 107 HE3 LYS 14 HE1 LYS 14 54.543 50.602 67.700 108 HZ1 LYS 14 HZ1 LYS 14 56.673 51.562 68.250 109 HZ2 LYS 14 HZ2 LYS 14 56.873 49.972 67.860 110 HZ3 LYS 14 HZ3 LYS 14 57.293 51.152 66.770 111 H GLY 15 H GLY 15 50.033 48.162 63.090 112 HA2 GLY 15 HA2 GLY 15 48.623 46.612 64.390 113 HA3 GLY 15 HA1 GLY 15 48.843 47.682 65.810 114 H ASP 16 H ASP 16 48.513 49.552 63.030 115 HA ASP 16 HA ASP 16 45.723 50.152 63.710 116 HB2 ASP 16 HB2 ASP 16 47.323 51.762 61.740 117 HB3 ASP 16 HB1 ASP 16 46.093 52.262 62.900 118 H ARG 17 H ARG 17 44.493 51.022 61.690 119 HA ARG 17 HA ARG 17 44.683 48.992 59.510 120 HB2 ARG 17 HB2 ARG 17 42.263 49.082 59.300 121 HB3 ARG 17 HB1 ARG 17 42.713 48.582 60.940 122 HG2 ARG 17 HG2 ARG 17 42.403 50.962 61.710 123 HG3 ARG 17 HG1 ARG 17 41.703 51.302 60.100 124 HD2 ARG 17 HD2 ARG 17 40.413 48.972 60.950 125 HD3 ARG 17 HD1 ARG 17 40.553 49.952 62.430 126 HE ARG 17 HE ARG 17 39.673 51.692 60.440 127 HH11 ARG 17 1HH1 ARG 17 38.533 48.692 61.820 128 HH12 ARG 17 2HH1 ARG 17 36.843 49.032 61.550 129 HH21 ARG 17 1HH2 ARG 17 37.473 52.152 60.080 130 HH22 ARG 17 2HH2 ARG 17 36.253 51.012 60.560 131 H VAL 18 H VAL 18 45.003 49.642 57.570 132 HA VAL 18 HA VAL 18 44.473 52.502 56.930 133 HB VAL 18 HB VAL 18 46.313 52.502 55.400 134 HG11 VAL 18 1HG1 VAL 18 48.173 52.322 57.010 135 HG12 VAL 18 2HG1 VAL 18 46.773 53.162 57.710 136 HG13 VAL 18 3HG1 VAL 18 47.153 51.482 58.150 137 HG21 VAL 18 1HG2 VAL 18 47.883 50.592 55.250 138 HG22 VAL 18 2HG2 VAL 18 46.843 49.642 56.320 139 HG23 VAL 18 3HG2 VAL 18 46.263 50.122 54.710 140 H GLU 19 H GLU 19 44.613 52.672 54.350 141 HA GLU 19 HA GLU 19 43.073 50.512 53.120 142 HB2 GLU 19 HB2 GLU 19 41.993 53.182 53.860 143 HB3 GLU 19 HB1 GLU 19 41.833 52.782 52.140 144 HG2 GLU 19 HG2 GLU 19 40.883 50.492 53.080 145 HG3 GLU 19 HG1 GLU 19 40.643 51.402 54.560 146 H GLY 20 H GLY 20 43.403 50.292 51.020 147 HA2 GLY 20 HA2 GLY 20 45.773 51.392 49.890 148 HA3 GLY 20 HA1 GLY 20 44.613 50.402 49.010 149 H LYS 21 H LYS 21 46.053 53.232 48.890 150 HA LYS 21 HA LYS 21 43.673 54.662 47.880 151 HB2 LYS 21 HB2 LYS 21 45.073 56.692 47.910 152 HB3 LYS 21 HB1 LYS 21 44.883 55.962 49.510 153 HG2 LYS 21 HG2 LYS 21 47.043 55.182 49.600 154 HG3 LYS 21 HG1 LYS 21 47.333 55.282 47.870 155 HD2 LYS 21 HD2 LYS 21 46.683 57.882 49.090 156 HD3 LYS 21 HD1 LYS 21 48.153 57.142 49.740 157 HE2 LYS 21 HE2 LYS 21 49.123 56.872 47.520 158 HE3 LYS 21 HE1 LYS 21 47.623 57.392 46.760 159 HZ1 LYS 21 HZ1 LYS 21 49.233 59.192 46.870 160 HZ2 LYS 21 HZ2 LYS 21 47.903 59.562 47.810 161 HZ3 LYS 21 HZ3 LYS 21 49.303 59.062 48.510 162 H ILE 22 H ILE 22 43.423 55.202 45.810 163 HA ILE 22 HA ILE 22 45.323 54.102 43.860 164 HB ILE 22 HB ILE 22 43.703 54.852 42.160 165 HG12 ILE 22 2HG1 ILE 22 41.423 55.652 43.590 166 HG13 ILE 22 1HG1 ILE 22 42.693 56.532 44.420 167 HG21 ILE 22 1HG2 ILE 22 41.853 53.382 43.050 168 HG22 ILE 22 2HG2 ILE 22 43.433 52.732 43.190 169 HG23 ILE 22 3HG2 ILE 22 42.623 53.472 44.590 170 HD11 ILE 22 HD1 ILE 22 41.763 57.892 42.640 171 HD12 ILE 22 HD2 ILE 22 43.473 57.512 42.280 172 HD13 ILE 22 HD3 ILE 22 42.193 56.692 41.420 173 H LYS 23 H LYS 23 45.103 57.022 45.500 174 HA LYS 23 HA LYS 23 45.803 58.812 43.390 175 HB2 LYS 23 HB2 LYS 23 44.893 59.462 45.690 176 HB3 LYS 23 HB1 LYS 23 46.453 59.052 46.370 177 HG2 LYS 23 HG2 LYS 23 46.173 61.472 46.050 178 HG3 LYS 23 HG1 LYS 23 47.543 60.862 45.170 179 HD2 LYS 23 HD2 LYS 23 44.883 60.942 43.730 180 HD3 LYS 23 HD1 LYS 23 45.663 62.482 44.060 181 HE2 LYS 23 HE2 LYS 23 46.923 60.152 42.530 182 HE3 LYS 23 HE1 LYS 23 46.233 61.592 41.800 183 HZ1 LYS 23 HZ1 LYS 23 48.633 61.722 42.020 184 HZ2 LYS 23 HZ2 LYS 23 47.933 62.892 42.970 185 HZ3 LYS 23 HZ3 LYS 23 48.543 61.492 43.630 186 H SER 24 H SER 24 47.553 56.252 44.620 187 HA SER 24 HA SER 24 50.223 57.412 44.540 188 HB2 SER 24 HB2 SER 24 50.253 54.542 44.470 189 HB3 SER 24 HB1 SER 24 50.643 55.662 45.790 190 HG SER 24 HG SER 24 48.943 54.152 46.270 191 H ILE 25 H ILE 25 51.693 55.612 43.230 192 HA ILE 25 HA ILE 25 50.743 55.772 40.420 193 HB ILE 25 HB ILE 25 53.083 56.082 39.770 194 HG12 ILE 25 2HG1 ILE 25 54.023 55.032 42.000 195 HG13 ILE 25 1HG1 ILE 25 54.923 56.262 41.160 196 HG21 ILE 25 1HG2 ILE 25 53.333 58.442 40.480 197 HG22 ILE 25 2HG2 ILE 25 51.643 58.062 40.040 198 HG23 ILE 25 3HG2 ILE 25 52.093 58.202 41.740 199 HD11 ILE 25 HD1 ILE 25 54.873 56.602 43.620 200 HD12 ILE 25 HD2 ILE 25 54.113 57.962 42.770 201 HD13 ILE 25 HD3 ILE 25 53.113 56.712 43.540 202 H THR 26 H THR 26 51.363 54.102 39.060 203 HA THR 26 HA THR 26 52.153 51.602 40.450 204 HB THR 26 HB THR 26 50.693 51.772 37.790 205 HG1 THR 26 HG1 THR 26 48.803 51.452 39.040 206 HG21 THR 26 1HG2 THR 26 49.933 49.452 38.530 207 HG22 THR 26 2HG2 THR 26 51.683 49.572 38.280 208 HG23 THR 26 3HG2 THR 26 51.123 49.602 39.860 209 H ASP 27 H ASP 27 53.433 50.092 39.230 210 HA ASP 27 HA ASP 27 55.183 49.482 37.970 211 HB2 ASP 27 HB2 ASP 27 53.573 50.532 36.160 212 HB3 ASP 27 HB1 ASP 27 54.843 51.752 36.070 213 H PHE 28 H PHE 28 55.243 51.712 40.000 214 HA PHE 28 HA PHE 28 58.053 52.332 39.750 215 HB2 PHE 28 HB2 PHE 28 55.893 54.382 39.290 216 HB3 PHE 28 HB1 PHE 28 57.263 54.922 40.250 217 HD1 PHE 28 HD1 PHE 28 59.653 54.032 39.270 218 HD2 PHE 28 HD2 PHE 28 56.073 54.862 37.020 219 HE1 PHE 28 HE1 PHE 28 61.033 54.472 37.250 220 HE2 PHE 28 HE2 PHE 28 57.443 55.312 35.000 221 HZ PHE 28 HZ PHE 28 59.923 55.122 35.110 222 H GLY 29 H GLY 29 56.073 50.972 41.570 223 HA2 GLY 29 HA2 GLY 29 56.443 50.552 43.870 224 HA3 GLY 29 HA1 GLY 29 57.143 52.182 44.080 225 H ILE 30 H ILE 30 54.193 50.322 43.740 226 HA ILE 30 HA ILE 30 52.393 52.542 44.120 227 HB ILE 30 HB ILE 30 52.013 49.552 44.510 228 HG12 ILE 30 2HG1 ILE 30 50.983 51.532 42.440 229 HG13 ILE 30 1HG1 ILE 30 52.253 50.312 42.190 230 HG21 ILE 30 1HG2 ILE 30 49.593 50.022 44.840 231 HG22 ILE 30 2HG2 ILE 30 50.493 50.732 46.100 232 HG23 ILE 30 3HG2 ILE 30 49.913 51.772 44.760 233 HD11 ILE 30 HD1 ILE 30 49.923 49.642 41.350 234 HD12 ILE 30 HD2 ILE 30 50.583 48.582 42.600 235 HD13 ILE 30 HD3 ILE 30 49.303 49.782 42.870 236 H PHE 31 H PHE 31 52.243 53.772 45.850 237 HA PHE 31 HA PHE 31 52.733 52.522 48.500 238 HB2 PHE 31 HB2 PHE 31 53.503 54.562 49.330 239 HB3 PHE 31 HB1 PHE 31 54.313 54.332 47.780 240 HD1 PHE 31 HD1 PHE 31 51.873 56.312 49.690 241 HD2 PHE 31 HD2 PHE 31 53.653 55.702 45.810 242 HE1 PHE 31 HE1 PHE 31 51.023 58.512 48.970 243 HE2 PHE 31 HE2 PHE 31 52.773 57.942 45.090 244 HZ PHE 31 HZ PHE 31 51.443 59.312 46.620 245 H ILE 32 H ILE 32 51.123 52.352 49.920 246 HA ILE 32 HA ILE 32 48.683 54.002 49.420 247 HB ILE 32 HB ILE 32 47.463 52.212 50.570 248 HG12 ILE 32 2HG1 ILE 32 49.323 50.032 49.930 249 HG13 ILE 32 1HG1 ILE 32 50.063 51.122 51.080 250 HG21 ILE 32 1HG2 ILE 32 47.393 50.732 48.550 251 HG22 ILE 32 2HG2 ILE 32 47.443 52.442 48.100 252 HG23 ILE 32 3HG2 ILE 32 48.893 51.452 47.970 253 HD11 ILE 32 HD1 ILE 32 48.923 49.412 52.270 254 HD12 ILE 32 HD2 ILE 32 48.133 50.972 52.590 255 HD13 ILE 32 HD3 ILE 32 47.373 49.812 51.470 256 H GLY 33 H GLY 33 48.553 55.622 50.840 257 HA2 GLY 33 HA2 GLY 33 49.163 54.992 53.700 258 HA3 GLY 33 HA1 GLY 33 49.653 56.522 52.970 259 H LEU 34 H LEU 34 47.523 55.172 54.970 260 HA LEU 34 HA LEU 34 45.003 56.142 54.120 261 HB2 LEU 34 HB2 LEU 34 45.433 54.562 56.050 262 HB3 LEU 34 HB1 LEU 34 46.063 55.922 56.970 263 HG LEU 34 HG LEU 34 43.843 57.002 57.010 264 HD11 LEU 34 1HD1 LEU 34 41.873 55.832 56.070 265 HD12 LEU 34 2HD1 LEU 34 43.013 56.232 54.790 266 HD13 LEU 34 3HD1 LEU 34 42.943 54.572 55.400 267 HD21 LEU 34 1HD2 LEU 34 42.643 55.392 58.370 268 HD22 LEU 34 2HD2 LEU 34 43.713 54.112 57.810 269 HD23 LEU 34 3HD2 LEU 34 44.383 55.442 58.780 270 H ASP 35 H ASP 35 43.773 57.982 55.120 271 HA ASP 35 HA ASP 35 44.833 60.452 54.530 272 HB2 ASP 35 HB2 ASP 35 42.633 59.592 56.450 273 HB3 ASP 35 HB1 ASP 35 43.053 61.292 56.250 274 H GLY 36 H GLY 36 45.183 58.662 57.530 275 HA2 GLY 36 HA2 GLY 36 47.333 60.452 58.360 276 HA3 GLY 36 HA1 GLY 36 45.953 60.402 59.470 277 H GLY 37 H GLY 37 46.933 57.572 57.670 278 HA2 GLY 37 HA2 GLY 37 47.703 56.262 60.250 279 HA3 GLY 37 HA1 GLY 37 47.023 55.412 58.840 280 H ILE 38 H ILE 38 48.623 54.052 58.310 281 HA ILE 38 HA ILE 38 51.393 55.112 58.050 282 HB ILE 38 HB ILE 38 50.493 52.202 58.180 283 HG12 ILE 38 2HG1 ILE 38 51.753 52.572 60.530 284 HG13 ILE 38 1HG1 ILE 38 51.153 54.222 60.310 285 HG21 ILE 38 1HG2 ILE 38 52.923 51.812 58.700 286 HG22 ILE 38 2HG2 ILE 38 52.663 52.482 57.090 287 HG23 ILE 38 3HG2 ILE 38 53.173 53.532 58.350 288 HD11 ILE 38 HD1 ILE 38 49.583 52.972 61.650 289 HD12 ILE 38 HD2 ILE 38 48.803 53.372 60.160 290 HD13 ILE 38 HD3 ILE 38 49.363 51.782 60.410 291 H ASP 39 H ASP 39 52.593 54.682 56.220 292 HA ASP 39 HA ASP 39 51.023 54.182 53.800 293 HB2 ASP 39 HB2 ASP 39 53.033 55.062 52.620 294 HB3 ASP 39 HB1 ASP 39 52.183 56.212 53.670 295 H GLY 40 H GLY 40 51.543 52.692 52.280 296 HA2 GLY 40 HA2 GLY 40 53.673 50.752 52.960 297 HA3 GLY 40 HA1 GLY 40 52.053 50.182 52.590 298 H LEU 41 H LEU 41 55.123 50.922 51.420 299 HA LEU 41 HA LEU 41 54.233 51.282 48.660 300 HB2 LEU 41 HB2 LEU 41 56.333 52.012 48.100 301 HB3 LEU 41 HB1 LEU 41 56.063 52.662 49.700 302 HG LEU 41 HG LEU 41 58.293 51.922 49.620 303 HD11 LEU 41 1HD1 LEU 41 58.373 50.282 51.400 304 HD12 LEU 41 2HD1 LEU 41 57.133 51.452 51.720 305 HD13 LEU 41 3HD1 LEU 41 56.723 49.822 51.160 306 HD21 LEU 41 1HD2 LEU 41 59.013 49.632 48.930 307 HD22 LEU 41 2HD2 LEU 41 57.463 49.162 48.600 308 HD23 LEU 41 3HD2 LEU 41 58.163 50.472 47.640 309 H VAL 42 H VAL 42 54.843 49.932 46.950 310 HA VAL 42 HA VAL 42 56.303 47.462 47.540 311 HB VAL 42 HB VAL 42 54.103 46.742 48.240 312 HG11 VAL 42 1HG1 VAL 42 52.143 46.812 46.760 313 HG12 VAL 42 2HG1 VAL 42 52.723 48.432 47.110 314 HG13 VAL 42 3HG1 VAL 42 53.053 47.692 45.540 315 HG21 VAL 42 1HG2 VAL 42 53.703 44.892 46.680 316 HG22 VAL 42 2HG2 VAL 42 54.733 45.662 45.480 317 HG23 VAL 42 3HG2 VAL 42 55.433 45.112 47.010 318 H HIS 43 H HIS 43 57.733 47.312 45.980 319 HA HIS 43 HA HIS 43 57.163 48.432 43.320 320 HB2 HIS 43 HB2 HIS 43 59.553 46.952 44.490 321 HB3 HIS 43 HB1 HIS 43 59.463 47.532 42.820 322 HD2 HIS 43 HD2 HIS 43 61.593 49.212 43.430 323 HE1 HIS 43 HE1 HIS 43 59.283 51.902 45.780 324 HE2 HIS 43 HE2 HIS 43 61.523 51.552 44.640 325 H LEU 44 H LEU 44 56.893 45.352 44.830 326 HA LEU 44 HA LEU 44 57.103 43.692 42.500 327 HB2 LEU 44 HB2 LEU 44 55.603 43.392 45.160 328 HB3 LEU 44 HB1 LEU 44 55.553 42.152 43.920 329 HG LEU 44 HG LEU 44 57.143 41.532 45.590 330 HD11 LEU 44 1HD1 LEU 44 59.153 41.172 44.220 331 HD12 LEU 44 2HD1 LEU 44 57.673 40.902 43.280 332 HD13 LEU 44 3HD1 LEU 44 58.613 42.392 43.060 333 HD21 LEU 44 1HD2 LEU 44 59.173 42.822 46.090 334 HD22 LEU 44 2HD2 LEU 44 58.653 44.112 45.030 335 HD23 LEU 44 3HD2 LEU 44 57.703 43.742 46.490 336 H SER 45 H SER 45 54.693 45.932 43.420 337 HA SER 45 HA SER 45 52.563 44.672 41.850 338 HB2 SER 45 HB2 SER 45 52.393 46.262 43.950 339 HB3 SER 45 HB1 SER 45 52.563 47.542 42.740 340 HG SER 45 HG SER 45 50.383 47.012 42.980 341 H ASP 46 H ASP 46 55.423 46.152 40.970 342 HA ASP 46 HA ASP 46 54.383 47.752 38.790 343 HB2 ASP 46 HB2 ASP 46 57.183 46.822 39.570 344 HB3 ASP 46 HB1 ASP 46 56.863 47.842 38.200 345 H ILE 47 H ILE 47 54.413 44.552 39.250 346 HA ILE 47 HA ILE 47 55.203 43.842 36.460 347 HB ILE 47 HB ILE 47 54.323 41.872 38.600 348 HG12 ILE 47 2HG1 ILE 47 56.113 43.122 39.650 349 HG13 ILE 47 1HG1 ILE 47 56.683 41.522 39.200 350 HG21 ILE 47 1HG2 ILE 47 55.713 40.322 37.270 351 HG22 ILE 47 2HG2 ILE 47 54.443 41.062 36.270 352 HG23 ILE 47 3HG2 ILE 47 56.113 41.632 36.140 353 HD11 ILE 47 HD1 ILE 47 58.343 43.292 38.730 354 HD12 ILE 47 HD2 ILE 47 57.823 42.522 37.210 355 HD13 ILE 47 HD3 ILE 47 57.213 44.122 37.670 356 H SER 48 H SER 48 52.513 43.382 38.690 357 HA SER 48 HA SER 48 50.283 43.092 38.320 358 HB2 SER 48 HB2 SER 48 50.133 44.032 35.550 359 HB3 SER 48 HB1 SER 48 49.363 44.662 37.020 360 HG SER 48 HG SER 48 50.983 46.082 35.880 361 H TRP 49 H TRP 49 48.633 41.782 37.220 362 HA TRP 49 HA TRP 49 49.893 39.372 36.070 363 HB2 TRP 49 HB2 TRP 49 47.173 40.162 37.030 364 HB3 TRP 49 HB1 TRP 49 47.253 38.882 35.820 365 HD1 TRP 49 HD1 TRP 49 48.563 36.622 36.500 366 HE1 TRP 49 HE1 TRP 49 49.013 35.542 38.810 367 HE3 TRP 49 HE3 TRP 49 47.663 40.682 39.460 368 HZ2 TRP 49 HZ2 TRP 49 48.923 36.352 41.540 369 HZ3 TRP 49 HZ3 TRP 49 47.853 40.502 41.930 370 HH2 TRP 49 HH2 TRP 49 48.493 38.342 42.980 371 H ASN 50 H ASN 50 47.573 41.802 34.950 372 HA ASN 50 HA ASN 50 48.553 41.482 32.210 373 HB2 ASN 50 HB2 ASN 50 46.223 40.002 33.060 374 HB3 ASN 50 HB1 ASN 50 45.643 41.332 32.070 375 HD21 ASN 50 1HD2 ASN 50 45.303 40.642 30.040 376 HD22 ASN 50 2HD2 ASN 50 46.383 39.552 29.170 377 H VAL 51 H VAL 51 45.983 42.902 34.230 378 HA VAL 51 HA VAL 51 46.253 45.452 32.710 379 HB VAL 51 HB VAL 51 43.983 46.002 33.630 380 HG11 VAL 51 1HG1 VAL 51 42.763 44.622 31.990 381 HG12 VAL 51 2HG1 VAL 51 44.283 45.242 31.330 382 HG13 VAL 51 3HG1 VAL 51 44.173 43.542 31.840 383 HG21 VAL 51 1HG2 VAL 51 42.563 44.142 34.430 384 HG22 VAL 51 2HG2 VAL 51 43.943 43.032 34.380 385 HG23 VAL 51 3HG2 VAL 51 43.943 44.402 35.520 386 H ALA 52 H ALA 52 45.823 47.402 33.980 387 HA ALA 52 HA ALA 52 47.243 47.212 36.600 388 HB1 ALA 52 HB1 ALA 52 47.633 49.622 36.300 389 HB2 ALA 52 HB2 ALA 52 48.233 48.702 34.920 390 HB3 ALA 52 HB3 ALA 52 46.703 49.612 34.790 391 H GLY 53 H GLY 53 46.573 48.982 38.150 392 HA2 GLY 53 HA2 GLY 53 43.893 48.422 39.000 393 HA3 GLY 53 HA1 GLY 53 44.973 49.662 39.710 394 H GLU 54 H GLU 54 45.013 50.622 36.630 395 HA GLU 54 HA GLU 54 43.383 52.872 36.880 396 HB2 GLU 54 HB2 GLU 54 44.553 51.352 34.530 397 HB3 GLU 54 HB1 GLU 54 43.343 52.592 34.210 398 HG2 GLU 54 HG2 GLU 54 44.953 54.002 35.880 399 HG3 GLU 54 HG1 GLU 54 46.143 52.892 35.190 400 H GLU 55 H GLU 55 42.493 49.612 35.880 401 HA GLU 55 HA GLU 55 39.773 50.482 35.090 402 HB2 GLU 55 HB2 GLU 55 41.083 47.742 35.250 403 HB3 GLU 55 HB1 GLU 55 39.443 48.042 34.680 404 HG2 GLU 55 HG2 GLU 55 41.463 49.722 33.290 405 HG3 GLU 55 HG1 GLU 55 41.763 48.002 33.130 406 H ALA 56 H ALA 56 41.393 48.562 37.680 407 HA ALA 56 HA ALA 56 39.003 47.772 39.020 408 HB1 ALA 56 HB1 ALA 56 40.503 47.432 40.960 409 HB2 ALA 56 HB2 ALA 56 41.253 46.802 39.480 410 HB3 ALA 56 HB3 ALA 56 41.793 48.362 40.160 411 H VAL 57 H VAL 57 40.973 50.692 39.320 412 HA VAL 57 HA VAL 57 39.403 51.792 41.470 413 HB VAL 57 HB VAL 57 41.703 52.502 41.080 414 HG11 VAL 57 1HG1 VAL 57 42.303 54.062 39.270 415 HG12 VAL 57 2HG1 VAL 57 41.723 52.552 38.600 416 HG13 VAL 57 3HG1 VAL 57 40.663 53.912 38.580 417 HG21 VAL 57 1HG2 VAL 57 41.363 54.872 41.340 418 HG22 VAL 57 2HG2 VAL 57 39.753 54.862 40.710 419 HG23 VAL 57 3HG2 VAL 57 40.073 54.052 42.250 420 H ARG 58 H ARG 58 38.983 51.652 38.030 421 HA ARG 58 HA ARG 58 37.573 54.002 37.490 422 HB2 ARG 58 HB2 ARG 58 38.283 52.062 35.910 423 HB3 ARG 58 HB1 ARG 58 36.793 51.262 36.430 424 HG2 ARG 58 HG2 ARG 58 35.963 52.282 34.580 425 HG3 ARG 58 HG1 ARG 58 35.683 53.592 35.730 426 HD2 ARG 58 HD2 ARG 58 38.063 54.402 35.100 427 HD3 ARG 58 HD1 ARG 58 37.923 53.272 33.720 428 HE ARG 58 HE ARG 58 35.593 54.922 33.870 429 HH11 ARG 58 1HH1 ARG 58 39.003 55.092 33.080 430 HH12 ARG 58 2HH1 ARG 58 38.853 56.422 31.970 431 HH21 ARG 58 1HH2 ARG 58 35.373 56.662 32.420 432 HH22 ARG 58 2HH2 ARG 58 36.773 57.312 31.600 433 H GLU 59 H GLU 59 36.553 51.152 39.280 434 HA GLU 59 HA GLU 59 33.763 52.172 39.470 435 HB2 GLU 59 HB2 GLU 59 34.923 49.562 40.520 436 HB3 GLU 59 HB1 GLU 59 33.233 50.022 40.410 437 HG2 GLU 59 HG2 GLU 59 34.303 50.282 37.750 438 HG3 GLU 59 HG1 GLU 59 34.963 48.792 38.420 439 H TYR 60 H TYR 60 36.713 51.652 41.360 440 HA TYR 60 HA TYR 60 35.493 52.052 43.920 441 HB2 TYR 60 HB2 TYR 60 38.373 52.492 43.090 442 HB3 TYR 60 HB1 TYR 60 37.803 52.272 44.720 443 HD1 TYR 60 HD1 TYR 60 35.773 49.982 44.090 444 HD2 TYR 60 HD2 TYR 60 39.943 50.642 43.190 445 HE1 TYR 60 HE1 TYR 60 36.123 47.542 43.930 446 HE2 TYR 60 HE2 TYR 60 40.293 48.202 43.030 447 HH TYR 60 HH TYR 60 39.333 46.172 43.170 448 H LYS 61 H LYS 61 36.823 53.862 45.260 449 HA LYS 61 HA LYS 61 35.963 56.442 44.010 450 HB2 LYS 61 HB2 LYS 61 35.543 55.242 46.670 451 HB3 LYS 61 HB1 LYS 61 36.193 56.862 46.790 452 HG2 LYS 61 HG2 LYS 61 34.333 57.872 45.930 453 HG3 LYS 61 HG1 LYS 61 33.943 56.542 44.840 454 HD2 LYS 61 HD2 LYS 61 32.263 56.682 46.560 455 HD3 LYS 61 HD1 LYS 61 33.163 55.172 46.720 456 HE2 LYS 61 HE2 LYS 61 34.043 55.712 48.750 457 HE3 LYS 61 HE1 LYS 61 34.353 57.392 48.280 458 HZ1 LYS 61 HZ1 LYS 61 32.683 57.252 50.000 459 HZ2 LYS 61 HZ2 LYS 61 32.013 57.862 48.620 460 HZ3 LYS 61 HZ3 LYS 61 31.723 56.302 49.060 461 H LYS 62 H LYS 62 37.053 58.332 45.260 462 HA LYS 62 HA LYS 62 39.823 58.242 44.450 463 HB2 LYS 62 HB2 LYS 62 38.603 60.312 44.310 464 HB3 LYS 62 HB1 LYS 62 38.173 60.262 46.010 465 HG2 LYS 62 HG2 LYS 62 41.123 60.262 45.320 466 HG3 LYS 62 HG1 LYS 62 40.203 61.742 45.050 467 HD2 LYS 62 HD2 LYS 62 39.333 61.172 47.570 468 HD3 LYS 62 HD1 LYS 62 40.913 60.392 47.640 469 HE2 LYS 62 HE2 LYS 62 42.043 62.322 47.670 470 HE3 LYS 62 HE1 LYS 62 41.023 63.062 46.410 471 HZ1 LYS 62 HZ1 LYS 62 40.753 64.182 48.540 472 HZ2 LYS 62 HZ2 LYS 62 39.343 63.462 48.110 473 HZ3 LYS 62 HZ3 LYS 62 40.283 62.782 49.270 474 H GLY 63 H GLY 63 41.293 57.112 45.480 475 HA2 GLY 63 HA2 GLY 63 42.853 56.812 47.270 476 HA3 GLY 63 HA1 GLY 63 41.713 57.612 48.390 477 H ASP 64 H ASP 64 40.123 55.262 46.430 478 HA ASP 64 HA ASP 64 40.153 53.392 48.750 479 HB2 ASP 64 HB2 ASP 64 38.043 54.542 47.130 480 HB3 ASP 64 HB1 ASP 64 38.133 52.832 46.760 481 H GLU 65 H GLU 65 40.293 51.152 48.320 482 HA GLU 65 HA GLU 65 40.653 49.972 45.770 483 HB2 GLU 65 HB2 GLU 65 42.963 51.492 46.500 484 HB3 GLU 65 HB1 GLU 65 43.413 49.832 46.800 485 HG2 GLU 65 HG2 GLU 65 42.683 49.282 44.480 486 HG3 GLU 65 HG1 GLU 65 42.363 51.002 44.220 487 H ILE 66 H ILE 66 42.463 49.742 48.840 488 HA ILE 66 HA ILE 66 41.163 47.102 49.330 489 HB ILE 66 HB ILE 66 43.343 46.142 50.040 490 HG12 ILE 66 2HG1 ILE 66 44.773 48.412 48.670 491 HG13 ILE 66 1HG1 ILE 66 44.383 48.512 50.400 492 HG21 ILE 66 1HG2 ILE 66 44.283 45.752 47.810 493 HG22 ILE 66 2HG2 ILE 66 42.503 45.692 47.790 494 HG23 ILE 66 3HG2 ILE 66 43.353 47.122 47.170 495 HD11 ILE 66 HD1 ILE 66 46.643 47.742 50.090 496 HD12 ILE 66 HD2 ILE 66 45.643 46.482 50.850 497 HD13 ILE 66 HD3 ILE 66 46.073 46.372 49.120 498 H ALA 67 H ALA 67 41.953 46.292 51.630 499 HA ALA 67 HA ALA 67 42.363 48.522 53.500 500 HB1 ALA 67 HB1 ALA 67 40.353 47.952 54.820 501 HB2 ALA 67 HB2 ALA 67 39.923 48.512 53.190 502 HB3 ALA 67 HB3 ALA 67 39.863 46.782 53.570 503 H ALA 68 H ALA 68 43.733 47.902 55.000 504 HA ALA 68 HA ALA 68 43.553 45.292 56.250 505 HB1 ALA 68 HB1 ALA 68 45.843 44.562 55.610 506 HB2 ALA 68 HB2 ALA 68 44.763 44.652 54.190 507 HB3 ALA 68 HB3 ALA 68 45.953 45.942 54.500 508 H VAL 69 H VAL 69 45.493 44.992 57.740 509 HA VAL 69 HA VAL 69 46.093 47.592 59.020 510 HB VAL 69 HB VAL 69 46.433 46.212 61.140 511 HG11 VAL 69 1HG1 VAL 69 44.003 45.982 61.610 512 HG12 VAL 69 2HG1 VAL 69 44.423 47.452 60.810 513 HG13 VAL 69 3HG1 VAL 69 43.653 46.172 59.860 514 HG21 VAL 69 1HG2 VAL 69 45.383 44.002 61.250 515 HG22 VAL 69 2HG2 VAL 69 45.093 44.032 59.500 516 HG23 VAL 69 3HG2 VAL 69 46.753 44.002 60.140 517 H VAL 70 H VAL 70 48.093 48.142 59.620 518 HA VAL 70 HA VAL 70 50.263 46.502 58.400 519 HB VAL 70 HB VAL 70 50.323 48.852 57.870 520 HG11 VAL 70 1HG1 VAL 70 50.723 50.492 59.580 521 HG12 VAL 70 2HG1 VAL 70 49.113 49.742 59.780 522 HG13 VAL 70 3HG1 VAL 70 50.463 49.352 60.890 523 HG21 VAL 70 1HG2 VAL 70 52.573 49.442 58.660 524 HG22 VAL 70 2HG2 VAL 70 52.533 48.192 59.880 525 HG23 VAL 70 3HG2 VAL 70 52.473 47.732 58.160 526 H LEU 71 H LEU 71 51.863 45.582 59.500 527 HA LEU 71 HA LEU 71 51.763 45.652 62.510 528 HB2 LEU 71 HB2 LEU 71 52.833 43.232 62.060 529 HB3 LEU 71 HB1 LEU 71 51.133 43.532 62.350 530 HG LEU 71 HG LEU 71 51.073 43.672 59.620 531 HD11 LEU 71 1HD1 LEU 71 52.533 42.052 58.690 532 HD12 LEU 71 2HD1 LEU 71 53.483 43.352 59.370 533 HD13 LEU 71 3HD1 LEU 71 53.393 41.802 60.230 534 HD21 LEU 71 1HD2 LEU 71 50.493 41.372 59.600 535 HD22 LEU 71 2HD2 LEU 71 51.123 41.132 61.220 536 HD23 LEU 71 3HD2 LEU 71 49.733 42.232 60.970 537 H GLN 72 H GLN 72 53.913 44.962 59.720 538 HA GLN 72 HA GLN 72 56.073 46.232 61.280 539 HB2 GLN 72 HB2 GLN 72 55.873 43.422 60.910 540 HB3 GLN 72 HB1 GLN 72 56.963 43.932 59.640 541 HG2 GLN 72 HG2 GLN 72 58.603 43.862 61.150 542 HG3 GLN 72 HG1 GLN 72 57.963 45.362 61.810 543 HE21 GLN 72 1HE2 GLN 72 57.093 41.852 61.950 544 HE22 GLN 72 2HE2 GLN 72 56.933 41.852 63.710 545 H VAL 73 H VAL 73 57.413 47.522 60.070 546 HA VAL 73 HA VAL 73 57.423 47.232 57.170 547 HB VAL 73 HB VAL 73 56.803 49.572 56.820 548 HG11 VAL 73 1HG1 VAL 73 54.353 49.402 57.230 549 HG12 VAL 73 2HG1 VAL 73 54.983 47.812 56.780 550 HG13 VAL 73 3HG1 VAL 73 54.663 48.162 58.460 551 HG21 VAL 73 1HG2 VAL 73 55.753 50.922 58.510 552 HG22 VAL 73 2HG2 VAL 73 56.183 49.722 59.760 553 HG23 VAL 73 3HG2 VAL 73 57.453 50.562 58.850 554 H ASP 74 H ASP 74 59.073 48.462 56.190 555 HA ASP 74 HA ASP 74 61.063 49.632 58.080 556 HB2 ASP 74 HB2 ASP 74 61.793 47.952 55.700 557 HB3 ASP 74 HB1 ASP 74 62.833 48.512 57.000 558 H ALA 75 H ALA 75 61.753 51.582 57.540 559 HA ALA 75 HA ALA 75 60.853 52.792 55.040 560 HB1 ALA 75 HB1 ALA 75 61.923 54.812 55.950 561 HB2 ALA 75 HB2 ALA 75 60.883 54.052 57.160 562 HB3 ALA 75 HB3 ALA 75 62.653 53.872 57.270 563 H GLU 76 H GLU 76 63.783 51.322 56.180 564 HA GLU 76 HA GLU 76 65.393 52.452 53.960 565 HB2 GLU 76 HB2 GLU 76 66.033 50.482 56.200 566 HB3 GLU 76 HB1 GLU 76 67.193 50.982 54.980 567 HG2 GLU 76 HG2 GLU 76 65.763 53.072 56.650 568 HG3 GLU 76 HG1 GLU 76 67.113 52.162 57.310 569 H ARG 77 H ARG 77 63.863 49.392 54.940 570 HA ARG 77 HA ARG 77 65.003 48.012 52.590 571 HB2 ARG 77 HB2 ARG 77 64.413 47.072 55.070 572 HB3 ARG 77 HB1 ARG 77 62.853 46.862 54.300 573 HG2 ARG 77 HG2 ARG 77 64.043 44.782 54.050 574 HG3 ARG 77 HG1 ARG 77 64.023 45.542 52.450 575 HD2 ARG 77 HD2 ARG 77 66.303 46.462 52.940 576 HD3 ARG 77 HD1 ARG 77 66.263 45.612 54.500 577 HE ARG 77 HE ARG 77 65.743 43.712 52.480 578 HH11 ARG 77 1HH1 ARG 77 68.333 45.852 53.460 579 HH12 ARG 77 2HH1 ARG 77 69.613 44.822 52.870 580 HH21 ARG 77 1HH2 ARG 77 67.403 42.372 51.700 581 HH22 ARG 77 2HH2 ARG 77 69.063 42.842 51.860 582 H GLU 78 H GLU 78 62.113 49.762 53.460 583 HA GLU 78 HA GLU 78 60.293 50.302 52.330 584 HB2 GLU 78 HB2 GLU 78 61.393 49.082 49.790 585 HB3 GLU 78 HB1 GLU 78 60.373 50.522 50.040 586 HG2 GLU 78 HG2 GLU 78 62.493 51.432 51.320 587 HG3 GLU 78 HG1 GLU 78 63.313 50.282 50.250 588 H ARG 79 H ARG 79 60.613 47.632 53.570 589 HA ARG 79 HA ARG 79 58.673 46.032 51.940 590 HB2 ARG 79 HB2 ARG 79 59.433 44.092 53.120 591 HB3 ARG 79 HB1 ARG 79 60.743 44.872 52.250 592 HG2 ARG 79 HG2 ARG 79 61.953 45.002 54.080 593 HG3 ARG 79 HG1 ARG 79 60.773 46.002 54.880 594 HD2 ARG 79 HD2 ARG 79 61.123 43.012 54.870 595 HD3 ARG 79 HD1 ARG 79 61.233 44.102 56.270 596 HE ARG 79 HE ARG 79 58.703 44.522 55.580 597 HH11 ARG 79 1HH1 ARG 79 60.523 41.602 56.060 598 HH12 ARG 79 2HH1 ARG 79 59.153 40.612 56.520 599 HH21 ARG 79 1HH2 ARG 79 56.903 43.262 56.130 600 HH22 ARG 79 2HH2 ARG 79 57.093 41.572 56.520 601 H ILE 80 H ILE 80 56.683 46.442 52.570 602 HA ILE 80 HA ILE 80 56.153 46.702 55.510 603 HB ILE 80 HB ILE 80 54.073 47.802 54.900 604 HG12 ILE 80 2HG1 ILE 80 54.023 48.442 52.290 605 HG13 ILE 80 1HG1 ILE 80 54.753 46.842 52.150 606 HG21 ILE 80 1HG2 ILE 80 55.013 49.832 53.950 607 HG22 ILE 80 2HG2 ILE 80 56.123 49.142 55.050 608 HG23 ILE 80 3HG2 ILE 80 56.433 48.962 53.340 609 HD11 ILE 80 HD1 ILE 80 52.323 46.712 51.970 610 HD12 ILE 80 HD2 ILE 80 52.853 45.902 53.440 611 HD13 ILE 80 HD3 ILE 80 52.133 47.512 53.560 612 H SER 81 H SER 81 54.603 45.512 56.550 613 HA SER 81 HA SER 81 53.343 43.332 54.970 614 HB2 SER 81 HB2 SER 81 53.723 41.922 57.110 615 HB3 SER 81 HB1 SER 81 55.023 42.102 55.960 616 HG SER 81 HG SER 81 55.683 42.482 58.220 617 H LEU 82 H LEU 82 51.373 42.682 55.550 618 HA LEU 82 HA LEU 82 50.043 44.252 57.680 619 HB2 LEU 82 HB2 LEU 82 47.983 43.722 56.010 620 HB3 LEU 82 HB1 LEU 82 48.893 45.222 56.000 621 HG LEU 82 HG LEU 82 49.793 42.932 54.220 622 HD11 LEU 82 1HD1 LEU 82 48.343 43.742 52.440 623 HD12 LEU 82 2HD1 LEU 82 47.393 43.302 53.860 624 HD13 LEU 82 3HD1 LEU 82 47.633 44.962 53.530 625 HD21 LEU 82 1HD2 LEU 82 50.543 44.832 52.810 626 HD22 LEU 82 2HD2 LEU 82 49.823 45.992 53.960 627 HD23 LEU 82 3HD2 LEU 82 51.193 45.002 54.450 628 H GLY 83 H GLY 83 48.273 43.312 58.710 629 HA2 GLY 83 HA2 GLY 83 48.603 40.422 59.110 630 HA3 GLY 83 HA1 GLY 83 47.533 41.502 60.040 631 H VAL 84 H VAL 84 47.053 41.992 56.750 632 HA VAL 84 HA VAL 84 44.433 41.062 56.720 633 HB VAL 84 HB VAL 84 45.523 42.572 55.050 634 HG11 VAL 84 1HG1 VAL 84 46.563 41.582 53.030 635 HG12 VAL 84 2HG1 VAL 84 47.503 41.232 54.510 636 HG13 VAL 84 3HG1 VAL 84 46.483 40.002 53.730 637 HG21 VAL 84 1HG2 VAL 84 44.123 41.902 53.150 638 HG22 VAL 84 2HG2 VAL 84 43.913 40.292 53.870 639 HG23 VAL 84 3HG2 VAL 84 43.253 41.732 54.690 640 H LYS 85 H LYS 85 47.443 39.332 56.080 641 HA LYS 85 HA LYS 85 46.193 37.022 54.880 642 HB2 LYS 85 HB2 LYS 85 48.923 37.242 56.260 643 HB3 LYS 85 HB1 LYS 85 48.403 35.992 55.130 644 HG2 LYS 85 HG2 LYS 85 48.093 38.642 53.910 645 HG3 LYS 85 HG1 LYS 85 49.693 38.492 54.590 646 HD2 LYS 85 HD2 LYS 85 48.553 36.222 52.920 647 HD3 LYS 85 HD1 LYS 85 49.043 37.692 52.100 648 HE2 LYS 85 HE2 LYS 85 50.823 36.052 53.960 649 HE3 LYS 85 HE1 LYS 85 50.853 35.982 52.180 650 HZ1 LYS 85 HZ1 LYS 85 52.563 37.472 53.040 651 HZ2 LYS 85 HZ2 LYS 85 51.453 38.332 52.170 652 HZ3 LYS 85 HZ3 LYS 85 51.433 38.392 53.810 653 H GLN 86 H GLN 86 46.993 38.002 58.150 654 HA GLN 86 HA GLN 86 46.433 35.332 59.290 655 HB2 GLN 86 HB2 GLN 86 48.233 36.632 60.280 656 HB3 GLN 86 HB1 GLN 86 47.183 38.042 60.520 657 HG2 GLN 86 HG2 GLN 86 46.183 37.182 62.380 658 HG3 GLN 86 HG1 GLN 86 46.223 35.522 61.790 659 HE21 GLN 86 1HE2 GLN 86 46.953 34.562 63.600 660 HE22 GLN 86 2HE2 GLN 86 48.603 34.812 64.180 661 H LEU 87 H LEU 87 44.733 38.282 58.500 662 HA LEU 87 HA LEU 87 42.683 38.062 60.460 663 HB2 LEU 87 HB2 LEU 87 43.443 39.932 58.620 664 HB3 LEU 87 HB1 LEU 87 42.103 39.232 57.730 665 HG LEU 87 HG LEU 87 41.733 40.102 60.620 666 HD11 LEU 87 1HD1 LEU 87 41.043 42.322 59.780 667 HD12 LEU 87 2HD1 LEU 87 42.763 42.002 59.450 668 HD13 LEU 87 3HD1 LEU 87 41.563 41.862 58.130 669 HD21 LEU 87 1HD2 LEU 87 39.403 40.462 59.850 670 HD22 LEU 87 2HD2 LEU 87 39.853 39.932 58.210 671 HD23 LEU 87 3HD2 LEU 87 39.913 38.792 59.560 672 H ALA 88 H ALA 88 42.633 37.182 56.960 673 HA ALA 88 HA ALA 88 41.293 34.722 57.450 674 HB1 ALA 88 HB1 ALA 88 39.133 35.322 56.360 675 HB2 ALA 88 HB2 ALA 88 39.363 36.222 57.870 676 HB3 ALA 88 HB3 ALA 88 39.643 37.022 56.300 677 H GLU 89 H GLU 89 40.633 33.692 55.390 678 HA GLU 89 HA GLU 89 42.753 33.792 53.490 679 HB2 GLU 89 HB2 GLU 89 40.453 32.132 54.020 680 HB3 GLU 89 HB1 GLU 89 40.293 32.682 52.360 681 HG2 GLU 89 HG2 GLU 89 42.613 31.882 51.880 682 HG3 GLU 89 HG1 GLU 89 42.733 31.302 53.550 683 H ASP 90 H ASP 90 42.073 33.882 51.020 684 HA ASP 90 HA ASP 90 40.403 36.252 50.550 685 HB2 ASP 90 HB2 ASP 90 43.243 36.082 49.500 686 HB3 ASP 90 HB1 ASP 90 42.143 37.432 49.340 687 HA PRO 91 HA PRO 91 39.253 34.032 46.920 688 HB2 PRO 91 HB1 PRO 91 38.603 36.102 45.190 689 HB3 PRO 91 HB2 PRO 91 37.593 35.642 46.610 690 HG2 PRO 91 HG1 PRO 91 39.633 37.852 46.380 691 HG3 PRO 91 HG2 PRO 91 38.003 37.932 47.090 692 HD2 PRO 91 HD1 PRO 91 40.263 37.642 48.560 693 HD3 PRO 91 HD2 PRO 91 38.743 36.872 49.050 694 H PHE 92 H PHE 92 42.053 35.942 47.020 695 HA PHE 92 HA PHE 92 42.943 34.892 44.380 696 HB2 PHE 92 HB2 PHE 92 43.523 37.592 45.680 697 HB3 PHE 92 HB1 PHE 92 44.433 36.942 44.310 698 HD1 PHE 92 HD1 PHE 92 41.323 38.502 45.370 699 HD2 PHE 92 HD2 PHE 92 43.383 36.642 42.100 700 HE1 PHE 92 HE1 PHE 92 39.613 39.402 43.800 701 HE2 PHE 92 HE2 PHE 92 41.713 37.572 40.510 702 HZ PHE 92 HZ PHE 92 39.823 38.952 41.360 703 H ASN 93 H ASN 93 45.123 34.362 44.240 704 HA ASN 93 HA ASN 93 46.983 34.542 46.350 705 HB2 ASN 93 HB2 ASN 93 45.053 32.642 47.040 706 HB3 ASN 93 HB1 ASN 93 46.223 31.662 46.200 707 HD21 ASN 93 1HD2 ASN 93 47.953 30.962 47.360 708 HD22 ASN 93 2HD2 ASN 93 48.393 31.622 48.940 709 H ASN 94 H ASN 94 49.033 33.792 45.740 710 HA ASN 94 HA ASN 94 49.303 32.082 43.360 711 HB2 ASN 94 HB2 ASN 94 49.493 34.982 43.220 712 HB3 ASN 94 HB1 ASN 94 51.093 34.312 42.970 713 HD21 ASN 94 1HD2 ASN 94 47.813 33.272 42.020 714 HD22 ASN 94 2HD2 ASN 94 48.233 33.142 40.300 Start of MODEL 3 1 H LYS 1 H1 LYS 1 60.620 68.525 48.830 2 HA LYS 1 HA LYS 1 59.730 67.975 50.990 3 HB2 LYS 1 HB2 LYS 1 59.650 65.225 49.730 4 HB3 LYS 1 HB1 LYS 1 60.100 65.375 51.430 5 HG2 LYS 1 HG2 LYS 1 57.780 65.055 51.500 6 HG3 LYS 1 HG1 LYS 1 58.000 66.785 51.780 7 HD2 LYS 1 HD2 LYS 1 57.740 66.645 48.990 8 HD3 LYS 1 HD1 LYS 1 56.720 65.325 49.510 9 HE2 LYS 1 HE2 LYS 1 56.570 68.195 50.560 10 HE3 LYS 1 HE1 LYS 1 55.560 67.555 49.250 11 HZ1 LYS 1 HZ1 LYS 1 54.420 67.455 51.400 12 HZ2 LYS 1 HZ2 LYS 1 54.660 65.935 50.840 13 HZ3 LYS 1 HZ3 LYS 1 55.590 66.515 52.050 14 H ALA 2 H ALA 2 62.360 66.535 49.070 15 HA ALA 2 HA ALA 2 64.570 66.415 49.430 16 HB1 ALA 2 HB1 ALA 2 65.600 68.015 50.980 17 HB2 ALA 2 HB2 ALA 2 64.410 68.835 49.930 18 HB3 ALA 2 HB3 ALA 2 64.040 68.465 51.630 19 H ASN 3 H ASN 3 64.380 64.215 50.020 20 HA ASN 3 HA ASN 3 64.610 62.395 51.370 21 HB2 ASN 3 HB2 ASN 3 66.070 64.165 53.350 22 HB3 ASN 3 HB1 ASN 3 66.360 62.475 52.910 23 HD21 ASN 3 1HD2 ASN 3 67.540 62.025 50.980 24 HD22 ASN 3 2HD2 ASN 3 68.420 63.305 50.150 25 HA PRO 4 HA PRO 4 61.140 63.855 54.150 26 HB2 PRO 4 HB1 PRO 4 59.200 62.095 53.200 27 HB3 PRO 4 HB2 PRO 4 59.530 63.675 52.480 28 HG2 PRO 4 HG1 PRO 4 60.570 60.955 51.620 29 HG3 PRO 4 HG2 PRO 4 59.900 62.265 50.590 30 HD2 PRO 4 HD1 PRO 4 62.570 61.835 50.890 31 HD3 PRO 4 HD2 PRO 4 61.900 63.485 50.700 32 H TRP 5 H TRP 5 62.580 62.905 55.780 33 HA TRP 5 HA TRP 5 62.400 60.025 56.220 34 HB2 TRP 5 HB2 TRP 5 64.180 61.985 56.950 35 HB3 TRP 5 HB1 TRP 5 63.300 61.765 58.460 36 HD1 TRP 5 HD1 TRP 5 63.260 59.095 59.380 37 HE1 TRP 5 HE1 TRP 5 65.130 57.335 59.240 38 HE3 TRP 5 HE3 TRP 5 66.060 61.165 55.630 39 HZ2 TRP 5 HZ2 TRP 5 67.520 56.885 57.720 40 HZ3 TRP 5 HZ3 TRP 5 68.130 60.045 54.850 41 HH2 TRP 5 HH2 TRP 5 68.860 57.905 55.890 42 H GLN 6 H GLN 6 60.730 62.865 57.380 43 HA GLN 6 HA GLN 6 59.530 61.725 59.730 44 HB2 GLN 6 HB2 GLN 6 59.560 64.245 58.470 45 HB3 GLN 6 HB1 GLN 6 57.880 63.725 58.290 46 HG2 GLN 6 HG2 GLN 6 57.750 63.275 60.740 47 HG3 GLN 6 HG1 GLN 6 59.410 63.895 60.900 48 HE21 GLN 6 1HE2 GLN 6 59.490 66.125 59.300 49 HE22 GLN 6 2HE2 GLN 6 58.270 67.275 59.880 50 H GLN 7 H GLN 7 58.170 62.215 56.430 51 HA GLN 7 HA GLN 7 55.770 60.715 56.960 52 HB2 GLN 7 HB2 GLN 7 57.250 61.405 54.400 53 HB3 GLN 7 HB1 GLN 7 55.710 60.565 54.440 54 HG2 GLN 7 HG2 GLN 7 55.780 63.095 56.030 55 HG3 GLN 7 HG1 GLN 7 56.010 63.285 54.290 56 HE21 GLN 7 1HE2 GLN 7 54.340 61.475 53.160 57 HE22 GLN 7 2HE2 GLN 7 52.720 61.795 53.670 58 H PHE 8 H PHE 8 59.080 59.755 56.280 59 HA PHE 8 HA PHE 8 58.240 57.075 55.400 60 HB2 PHE 8 HB2 PHE 8 60.730 58.655 55.540 61 HB3 PHE 8 HB1 PHE 8 60.980 57.045 56.150 62 HD1 PHE 8 HD1 PHE 8 59.400 55.265 54.620 63 HD2 PHE 8 HD2 PHE 8 61.550 58.775 53.340 64 HE1 PHE 8 HE1 PHE 8 59.740 54.285 52.430 65 HE2 PHE 8 HE2 PHE 8 61.720 57.845 51.050 66 HZ PHE 8 HZ PHE 8 60.780 55.605 50.560 67 H ALA 9 H ALA 9 59.200 58.695 58.420 68 HA ALA 9 HA ALA 9 59.650 56.165 59.820 69 HB1 ALA 9 HB1 ALA 9 59.680 57.615 61.810 70 HB2 ALA 9 HB2 ALA 9 60.730 58.285 60.520 71 HB3 ALA 9 HB3 ALA 9 59.110 58.985 60.830 72 H GLU 10 H GLU 10 56.830 57.875 58.780 73 HA GLU 10 HA GLU 10 55.090 57.185 60.920 74 HB2 GLU 10 HB2 GLU 10 54.370 57.385 57.990 75 HB3 GLU 10 HB1 GLU 10 53.290 57.655 59.360 76 HG2 GLU 10 HG2 GLU 10 55.620 59.335 58.440 77 HG3 GLU 10 HG1 GLU 10 53.920 59.785 58.380 78 H THR 11 H THR 11 56.430 55.285 58.320 79 HA THR 11 HA THR 11 54.530 53.065 58.740 80 HB THR 11 HB THR 11 55.410 53.655 56.440 81 HG1 THR 11 HG1 THR 11 55.730 51.485 55.910 82 HG21 THR 11 1HG2 THR 11 57.650 52.785 55.830 83 HG22 THR 11 2HG2 THR 11 57.660 54.005 57.050 84 HG23 THR 11 3HG2 THR 11 57.960 52.355 57.550 85 H HIS 12 H HIS 12 56.930 54.225 60.640 86 HA HIS 12 HA HIS 12 58.590 51.915 60.980 87 HB2 HIS 12 HB2 HIS 12 59.350 52.965 62.950 88 HB3 HIS 12 HB1 HIS 12 59.010 54.265 61.830 89 HD2 HIS 12 HD2 HIS 12 55.700 54.335 62.540 90 HE1 HIS 12 HE1 HIS 12 57.060 55.345 66.420 91 HE2 HIS 12 HE2 HIS 12 55.040 55.305 64.820 92 H ASN 13 H ASN 13 55.320 52.375 61.730 93 HA ASN 13 HA ASN 13 55.050 50.805 64.100 94 HB2 ASN 13 HB2 ASN 13 53.170 51.805 61.940 95 HB3 ASN 13 HB1 ASN 13 52.620 50.565 63.050 96 HD21 ASN 13 1HD2 ASN 13 51.940 51.065 65.080 97 HD22 ASN 13 2HD2 ASN 13 52.070 52.705 65.720 98 H LYS 14 H LYS 14 53.730 48.775 64.100 99 HA LYS 14 HA LYS 14 53.750 46.955 61.950 100 HB2 LYS 14 HB2 LYS 14 55.570 45.415 62.600 101 HB3 LYS 14 HB1 LYS 14 56.120 46.935 61.970 102 HG2 LYS 14 HG2 LYS 14 56.030 47.525 64.690 103 HG3 LYS 14 HG1 LYS 14 56.380 45.805 64.720 104 HD2 LYS 14 HD2 LYS 14 58.500 46.105 64.000 105 HD3 LYS 14 HD1 LYS 14 58.030 47.275 62.750 106 HE2 LYS 14 HE2 LYS 14 57.590 48.885 64.790 107 HE3 LYS 14 HE1 LYS 14 58.690 47.785 65.650 108 HZ1 LYS 14 HZ1 LYS 14 59.840 49.645 64.580 109 HZ2 LYS 14 HZ2 LYS 14 60.310 48.225 63.840 110 HZ3 LYS 14 HZ3 LYS 14 59.200 49.255 63.130 111 H GLY 15 H GLY 15 52.000 45.855 62.530 112 HA2 GLY 15 HA2 GLY 15 51.190 43.955 63.830 113 HA3 GLY 15 HA1 GLY 15 51.830 44.755 65.300 114 H ASP 16 H ASP 16 50.470 47.055 63.270 115 HA ASP 16 HA ASP 16 47.900 46.955 64.760 116 HB2 ASP 16 HB2 ASP 16 49.120 49.445 63.540 117 HB3 ASP 16 HB1 ASP 16 47.880 49.295 64.800 118 H ARG 17 H ARG 17 46.470 48.775 63.390 119 HA ARG 17 HA ARG 17 46.220 47.625 60.650 120 HB2 ARG 17 HB2 ARG 17 43.820 47.765 60.820 121 HB3 ARG 17 HB1 ARG 17 44.500 46.755 62.100 122 HG2 ARG 17 HG2 ARG 17 44.390 49.185 63.400 123 HG3 ARG 17 HG1 ARG 17 43.060 49.365 62.260 124 HD2 ARG 17 HD2 ARG 17 42.900 46.735 63.450 125 HD3 ARG 17 HD1 ARG 17 43.270 47.905 64.730 126 HE ARG 17 HE ARG 17 41.130 48.785 62.980 127 HH11 ARG 17 1HH1 ARG 17 41.910 46.755 65.730 128 HH12 ARG 17 2HH1 ARG 17 40.300 46.775 66.380 129 HH21 ARG 17 1HH2 ARG 17 39.030 48.815 63.830 130 HH22 ARG 17 2HH2 ARG 17 38.660 47.955 65.300 131 H VAL 18 H VAL 18 46.270 48.995 59.060 132 HA VAL 18 HA VAL 18 45.850 51.905 59.630 133 HB VAL 18 HB VAL 18 47.510 52.475 58.020 134 HG11 VAL 18 1HG1 VAL 18 49.500 51.635 59.140 135 HG12 VAL 18 2HG1 VAL 18 48.100 51.815 60.290 136 HG13 VAL 18 3HG1 VAL 18 48.630 50.245 59.810 137 HG21 VAL 18 1HG2 VAL 18 48.880 50.805 56.830 138 HG22 VAL 18 2HG2 VAL 18 47.900 49.485 57.530 139 HG23 VAL 18 3HG2 VAL 18 47.180 50.635 56.370 140 H GLU 19 H GLU 19 45.690 53.015 57.280 141 HA GLU 19 HA GLU 19 43.680 51.485 55.760 142 HB2 GLU 19 HB2 GLU 19 43.410 54.105 57.100 143 HB3 GLU 19 HB1 GLU 19 43.000 54.045 55.340 144 HG2 GLU 19 HG2 GLU 19 41.660 51.845 56.360 145 HG3 GLU 19 HG1 GLU 19 41.480 53.065 57.620 146 H GLY 20 H GLY 20 43.670 51.765 53.610 147 HA2 GLY 20 HA2 GLY 20 46.080 53.115 52.460 148 HA3 GLY 20 HA1 GLY 20 45.340 51.645 51.780 149 H LYS 21 H LYS 21 45.620 53.265 49.920 150 HA LYS 21 HA LYS 21 42.960 54.335 49.380 151 HB2 LYS 21 HB2 LYS 21 43.720 56.585 48.740 152 HB3 LYS 21 HB1 LYS 21 43.930 56.245 50.460 153 HG2 LYS 21 HG2 LYS 21 46.380 55.625 49.890 154 HG3 LYS 21 HG1 LYS 21 46.080 56.315 48.290 155 HD2 LYS 21 HD2 LYS 21 45.140 58.155 50.360 156 HD3 LYS 21 HD1 LYS 21 46.760 57.595 50.750 157 HE2 LYS 21 HE2 LYS 21 47.490 58.185 48.420 158 HE3 LYS 21 HE1 LYS 21 45.860 58.835 48.130 159 HZ1 LYS 21 HZ1 LYS 21 47.420 60.585 48.830 160 HZ2 LYS 21 HZ2 LYS 21 46.240 60.385 49.970 161 HZ3 LYS 21 HZ3 LYS 21 47.730 59.785 50.230 162 H ILE 22 H ILE 22 42.450 54.355 47.260 163 HA ILE 22 HA ILE 22 44.400 53.105 45.400 164 HB ILE 22 HB ILE 22 41.560 54.015 44.810 165 HG12 ILE 22 2HG1 ILE 22 41.470 52.485 46.740 166 HG13 ILE 22 1HG1 ILE 22 40.800 51.755 45.310 167 HG21 ILE 22 1HG2 ILE 22 41.680 52.375 43.120 168 HG22 ILE 22 2HG2 ILE 22 42.910 53.475 42.780 169 HG23 ILE 22 3HG2 ILE 22 43.380 51.945 43.520 170 HD11 ILE 22 HD1 ILE 22 42.190 50.205 46.620 171 HD12 ILE 22 HD2 ILE 22 42.900 50.465 45.010 172 HD13 ILE 22 HD3 ILE 22 43.600 51.255 46.430 173 H LYS 23 H LYS 23 43.590 56.265 46.280 174 HA LYS 23 HA LYS 23 43.650 57.605 43.800 175 HB2 LYS 23 HB2 LYS 23 43.340 58.445 46.330 176 HB3 LYS 23 HB1 LYS 23 45.090 58.655 46.260 177 HG2 LYS 23 HG2 LYS 23 44.010 59.865 43.870 178 HG3 LYS 23 HG1 LYS 23 42.950 60.315 45.200 179 HD2 LYS 23 HD2 LYS 23 44.660 61.995 44.980 180 HD3 LYS 23 HD1 LYS 23 44.940 61.105 46.490 181 HE2 LYS 23 HE2 LYS 23 46.670 59.715 45.330 182 HE3 LYS 23 HE1 LYS 23 46.350 60.565 43.830 183 HZ1 LYS 23 HZ1 LYS 23 48.280 61.455 44.960 184 HZ2 LYS 23 HZ2 LYS 23 47.100 62.605 44.880 185 HZ3 LYS 23 HZ3 LYS 23 47.390 61.825 46.300 186 H SER 24 H SER 24 46.170 55.855 45.340 187 HA SER 24 HA SER 24 48.450 57.235 44.210 188 HB2 SER 24 HB2 SER 24 49.710 55.375 45.030 189 HB3 SER 24 HB1 SER 24 48.540 55.855 46.270 190 HG SER 24 HG SER 24 48.510 53.595 46.030 191 H ILE 25 H ILE 25 49.970 55.295 43.100 192 HA ILE 25 HA ILE 25 48.450 54.615 40.630 193 HB ILE 25 HB ILE 25 51.440 55.175 40.680 194 HG12 ILE 25 2HG1 ILE 25 49.240 57.235 40.180 195 HG13 ILE 25 1HG1 ILE 25 50.320 57.225 41.580 196 HG21 ILE 25 1HG2 ILE 25 51.020 55.615 38.250 197 HG22 ILE 25 2HG2 ILE 25 50.500 54.035 38.660 198 HG23 ILE 25 3HG2 ILE 25 49.280 55.315 38.510 199 HD11 ILE 25 HD1 ILE 25 51.090 58.855 40.020 200 HD12 ILE 25 HD2 ILE 25 52.280 57.525 40.180 201 HD13 ILE 25 HD3 ILE 25 51.240 57.655 38.740 202 H THR 26 H THR 26 49.470 52.825 39.420 203 HA THR 26 HA THR 26 50.590 50.775 41.240 204 HB THR 26 HB THR 26 48.850 50.145 38.840 205 HG1 THR 26 HG1 THR 26 47.140 50.005 40.370 206 HG21 THR 26 1HG2 THR 26 48.610 47.995 40.230 207 HG22 THR 26 2HG2 THR 26 50.260 48.325 39.850 208 HG23 THR 26 3HG2 THR 26 49.550 48.745 41.440 209 H ASP 27 H ASP 27 52.060 49.315 40.340 210 HA ASP 27 HA ASP 27 53.800 48.665 39.100 211 HB2 ASP 27 HB2 ASP 27 51.710 49.115 37.230 212 HB3 ASP 27 HB1 ASP 27 53.120 49.885 36.520 213 H PHE 28 H PHE 28 53.490 51.515 40.170 214 HA PHE 28 HA PHE 28 56.060 52.535 39.250 215 HB2 PHE 28 HB2 PHE 28 53.450 53.945 38.670 216 HB3 PHE 28 HB1 PHE 28 54.970 54.835 38.810 217 HD1 PHE 28 HD1 PHE 28 56.980 54.125 37.400 218 HD2 PHE 28 HD2 PHE 28 52.920 52.925 36.600 219 HE1 PHE 28 HE1 PHE 28 57.580 53.685 35.030 220 HE2 PHE 28 HE2 PHE 28 53.510 52.465 34.240 221 HZ PHE 28 HZ PHE 28 55.840 52.855 33.440 222 H GLY 29 H GLY 29 55.060 51.535 41.730 223 HA2 GLY 29 HA2 GLY 29 55.750 52.205 43.900 224 HA3 GLY 29 HA1 GLY 29 55.640 53.895 43.430 225 H ILE 30 H ILE 30 53.820 51.035 44.350 226 HA ILE 30 HA ILE 30 51.250 52.375 44.480 227 HB ILE 30 HB ILE 30 52.240 49.805 45.760 228 HG12 ILE 30 2HG1 ILE 30 50.330 50.385 43.450 229 HG13 ILE 30 1HG1 ILE 30 51.990 49.775 43.300 230 HG21 ILE 30 1HG2 ILE 30 49.880 49.365 46.410 231 HG22 ILE 30 2HG2 ILE 30 50.480 50.765 47.220 232 HG23 ILE 30 3HG2 ILE 30 49.420 50.985 45.800 233 HD11 ILE 30 HD1 ILE 30 50.400 47.925 43.070 234 HD12 ILE 30 HD2 ILE 30 51.320 47.725 44.540 235 HD13 ILE 30 HD3 ILE 30 49.640 48.315 44.590 236 H PHE 31 H PHE 31 50.580 53.825 45.840 237 HA PHE 31 HA PHE 31 51.870 53.965 48.510 238 HB2 PHE 31 HB2 PHE 31 52.360 55.935 47.230 239 HB3 PHE 31 HB1 PHE 31 50.670 56.155 46.810 240 HD1 PHE 31 HD1 PHE 31 53.200 56.665 49.380 241 HD2 PHE 31 HD2 PHE 31 48.990 56.845 48.520 242 HE1 PHE 31 HE1 PHE 31 52.870 58.095 51.350 243 HE2 PHE 31 HE2 PHE 31 48.680 58.255 50.580 244 HZ PHE 31 HZ PHE 31 50.590 58.875 51.980 245 H ILE 32 H ILE 32 50.700 53.685 50.300 246 HA ILE 32 HA ILE 32 47.740 53.995 50.140 247 HB ILE 32 HB ILE 32 47.530 51.895 51.480 248 HG12 ILE 32 2HG1 ILE 32 49.910 50.615 50.350 249 HG13 ILE 32 1HG1 ILE 32 50.350 51.885 51.460 250 HG21 ILE 32 1HG2 ILE 32 47.520 50.415 49.520 251 HG22 ILE 32 2HG2 ILE 32 46.840 52.015 49.130 252 HG23 ILE 32 3HG2 ILE 32 48.500 51.595 48.630 253 HD11 ILE 32 HD1 ILE 32 50.170 49.825 52.670 254 HD12 ILE 32 HD2 ILE 32 48.910 50.935 53.220 255 HD13 ILE 32 HD3 ILE 32 48.490 49.595 52.120 256 H GLY 33 H GLY 33 47.250 55.505 51.580 257 HA2 GLY 33 HA2 GLY 33 47.970 55.065 54.320 258 HA3 GLY 33 HA1 GLY 33 48.820 56.455 53.650 259 H LEU 34 H LEU 34 47.410 57.135 55.630 260 HA LEU 34 HA LEU 34 44.820 58.175 54.570 261 HB2 LEU 34 HB2 LEU 34 45.290 56.715 56.920 262 HB3 LEU 34 HB1 LEU 34 45.310 58.375 57.490 263 HG LEU 34 HG LEU 34 43.040 58.765 56.540 264 HD11 LEU 34 1HD1 LEU 34 41.770 56.755 55.720 265 HD12 LEU 34 2HD1 LEU 34 43.090 57.165 54.620 266 HD13 LEU 34 3HD1 LEU 34 43.340 55.905 55.800 267 HD21 LEU 34 1HD2 LEU 34 41.850 57.235 58.120 268 HD22 LEU 34 2HD2 LEU 34 43.330 56.275 58.300 269 HD23 LEU 34 3HD2 LEU 34 43.290 57.955 58.860 270 H ASP 35 H ASP 35 44.220 60.175 56.190 271 HA ASP 35 HA ASP 35 45.940 62.275 55.180 272 HB2 ASP 35 HB2 ASP 35 43.720 62.465 57.250 273 HB3 ASP 35 HB1 ASP 35 44.410 63.785 56.290 274 H GLY 36 H GLY 36 45.500 60.705 58.300 275 HA2 GLY 36 HA2 GLY 36 47.950 62.095 59.310 276 HA3 GLY 36 HA1 GLY 36 46.490 61.985 60.320 277 H GLY 37 H GLY 37 46.690 59.195 58.510 278 HA2 GLY 37 HA2 GLY 37 47.570 57.655 60.860 279 HA3 GLY 37 HA1 GLY 37 46.850 57.005 59.360 280 H ILE 38 H ILE 38 48.320 55.605 58.610 281 HA ILE 38 HA ILE 38 51.200 56.415 58.550 282 HB ILE 38 HB ILE 38 49.950 53.645 58.510 283 HG12 ILE 38 2HG1 ILE 38 51.480 53.605 60.710 284 HG13 ILE 38 1HG1 ILE 38 51.280 55.365 60.660 285 HG21 ILE 38 1HG2 ILE 38 52.310 52.855 58.670 286 HG22 ILE 38 2HG2 ILE 38 51.990 53.695 57.150 287 HG23 ILE 38 3HG2 ILE 38 52.830 54.545 58.430 288 HD11 ILE 38 HD1 ILE 38 49.630 54.285 62.160 289 HD12 ILE 38 HD2 ILE 38 48.750 54.965 60.770 290 HD13 ILE 38 HD3 ILE 38 49.170 53.285 60.850 291 H ASP 39 H ASP 39 52.280 56.405 56.670 292 HA ASP 39 HA ASP 39 50.700 56.005 54.210 293 HB2 ASP 39 HB2 ASP 39 52.670 57.225 53.210 294 HB3 ASP 39 HB1 ASP 39 51.580 58.175 54.240 295 H GLY 40 H GLY 40 51.360 54.715 52.610 296 HA2 GLY 40 HA2 GLY 40 53.650 52.865 53.180 297 HA3 GLY 40 HA1 GLY 40 52.120 52.365 52.450 298 H LEU 41 H LEU 41 54.730 51.945 51.390 299 HA LEU 41 HA LEU 41 54.300 53.095 48.750 300 HB2 LEU 41 HB2 LEU 41 56.520 54.015 48.520 301 HB3 LEU 41 HB1 LEU 41 55.580 54.885 49.730 302 HG LEU 41 HG LEU 41 57.290 52.695 50.870 303 HD11 LEU 41 1HD1 LEU 41 59.370 53.835 50.530 304 HD12 LEU 41 2HD1 LEU 41 58.650 53.495 49.000 305 HD13 LEU 41 3HD1 LEU 41 58.560 55.145 49.620 306 HD21 LEU 41 1HD2 LEU 41 57.680 54.375 52.560 307 HD22 LEU 41 2HD2 LEU 41 56.920 55.625 51.550 308 HD23 LEU 41 3HD2 LEU 41 55.980 54.285 52.250 309 H VAL 42 H VAL 42 55.090 51.855 47.150 310 HA VAL 42 HA VAL 42 57.020 49.705 47.780 311 HB VAL 42 HB VAL 42 54.380 49.025 46.450 312 HG11 VAL 42 1HG1 VAL 42 55.130 46.715 46.870 313 HG12 VAL 42 2HG1 VAL 42 56.330 47.585 45.900 314 HG13 VAL 42 3HG1 VAL 42 56.640 47.295 47.600 315 HG21 VAL 42 1HG2 VAL 42 53.750 47.855 48.510 316 HG22 VAL 42 2HG2 VAL 42 55.210 48.505 49.290 317 HG23 VAL 42 3HG2 VAL 42 53.890 49.595 48.780 318 H HIS 43 H HIS 43 58.520 50.665 46.480 319 HA HIS 43 HA HIS 43 57.880 51.255 43.680 320 HB2 HIS 43 HB2 HIS 43 60.370 51.375 45.410 321 HB3 HIS 43 HB1 HIS 43 60.480 51.505 43.650 322 HD2 HIS 43 HD2 HIS 43 61.180 54.085 43.660 323 HE1 HIS 43 HE1 HIS 43 57.590 55.605 45.360 324 HE2 HIS 43 HE2 HIS 43 59.790 56.235 44.220 325 H LEU 44 H LEU 44 59.010 48.545 45.460 326 HA LEU 44 HA LEU 44 60.270 47.185 43.220 327 HB2 LEU 44 HB2 LEU 44 59.120 45.735 45.610 328 HB3 LEU 44 HB1 LEU 44 60.560 45.365 44.650 329 HG LEU 44 HG LEU 44 60.240 47.595 46.710 330 HD11 LEU 44 1HD1 LEU 44 61.960 46.305 47.910 331 HD12 LEU 44 2HD1 LEU 44 60.490 45.345 47.640 332 HD13 LEU 44 3HD1 LEU 44 61.950 45.075 46.650 333 HD21 LEU 44 1HD2 LEU 44 62.630 48.085 46.310 334 HD22 LEU 44 2HD2 LEU 44 62.660 46.895 44.980 335 HD23 LEU 44 3HD2 LEU 44 61.690 48.385 44.850 336 H SER 45 H SER 45 57.040 47.735 44.090 337 HA SER 45 HA SER 45 55.960 45.345 42.750 338 HB2 SER 45 HB2 SER 45 54.810 47.575 44.410 339 HB3 SER 45 HB1 SER 45 53.750 46.785 43.260 340 HG SER 45 HG SER 45 53.720 45.765 45.280 341 H ASP 46 H ASP 46 57.550 47.715 41.440 342 HA ASP 46 HA ASP 46 55.710 48.935 39.660 343 HB2 ASP 46 HB2 ASP 46 58.680 48.705 39.920 344 HB3 ASP 46 HB1 ASP 46 58.070 49.075 38.320 345 H ILE 47 H ILE 47 56.910 45.805 39.820 346 HA ILE 47 HA ILE 47 56.520 45.285 36.910 347 HB ILE 47 HB ILE 47 57.320 43.175 38.940 348 HG12 ILE 47 2HG1 ILE 47 58.860 44.985 39.460 349 HG13 ILE 47 1HG1 ILE 47 59.700 43.705 38.610 350 HG21 ILE 47 1HG2 ILE 47 58.550 42.255 37.000 351 HG22 ILE 47 2HG2 ILE 47 56.830 42.455 36.630 352 HG23 ILE 47 3HG2 ILE 47 57.990 43.615 36.000 353 HD11 ILE 47 HD1 ILE 47 60.370 45.955 37.800 354 HD12 ILE 47 HD2 ILE 47 59.610 45.025 36.500 355 HD13 ILE 47 HD3 ILE 47 58.710 46.315 37.320 356 H SER 48 H SER 48 54.920 44.935 39.890 357 HA SER 48 HA SER 48 52.910 44.015 40.480 358 HB2 SER 48 HB2 SER 48 51.570 44.985 38.970 359 HB3 SER 48 HB1 SER 48 52.630 44.635 37.610 360 HG SER 48 HG SER 48 50.700 43.605 37.400 361 H TRP 49 H TRP 49 51.420 42.035 40.070 362 HA TRP 49 HA TRP 49 53.110 39.635 40.200 363 HB2 TRP 49 HB2 TRP 49 50.240 40.335 40.760 364 HB3 TRP 49 HB1 TRP 49 50.570 38.675 40.250 365 HD1 TRP 49 HD1 TRP 49 51.210 37.075 42.100 366 HE1 TRP 49 HE1 TRP 49 52.070 37.255 44.510 367 HE3 TRP 49 HE3 TRP 49 51.870 42.135 42.330 368 HZ2 TRP 49 HZ2 TRP 49 52.940 39.335 46.300 369 HZ3 TRP 49 HZ3 TRP 49 52.740 43.195 44.380 370 HH2 TRP 49 HH2 TRP 49 53.270 41.815 46.380 371 H ASN 50 H ASN 50 50.670 41.015 38.020 372 HA ASN 50 HA ASN 50 51.780 39.485 35.810 373 HB2 ASN 50 HB2 ASN 50 49.560 38.305 37.250 374 HB3 ASN 50 HB1 ASN 50 48.920 38.905 35.740 375 HD21 ASN 50 1HD2 ASN 50 48.710 37.175 34.430 376 HD22 ASN 50 2HD2 ASN 50 49.990 35.985 34.160 377 H VAL 51 H VAL 51 48.910 41.335 36.860 378 HA VAL 51 HA VAL 51 49.100 42.935 34.340 379 HB VAL 51 HB VAL 51 46.660 43.375 34.630 380 HG11 VAL 51 1HG1 VAL 51 45.910 41.205 33.760 381 HG12 VAL 51 2HG1 VAL 51 47.450 41.695 33.040 382 HG13 VAL 51 3HG1 VAL 51 47.420 40.435 34.300 383 HG21 VAL 51 1HG2 VAL 51 45.380 41.845 36.090 384 HG22 VAL 51 2HG2 VAL 51 46.840 41.145 36.740 385 HG23 VAL 51 3HG2 VAL 51 46.460 42.865 37.040 386 H ALA 52 H ALA 52 48.250 45.135 34.510 387 HA ALA 52 HA ALA 52 49.550 46.495 36.670 388 HB1 ALA 52 HB1 ALA 52 48.520 48.525 35.680 389 HB2 ALA 52 HB2 ALA 52 49.260 47.495 34.440 390 HB3 ALA 52 HB3 ALA 52 47.480 47.505 34.650 391 H GLY 53 H GLY 53 48.270 48.285 37.860 392 HA2 GLY 53 HA2 GLY 53 46.550 47.015 39.750 393 HA3 GLY 53 HA1 GLY 53 46.740 48.775 39.570 394 H GLU 54 H GLU 54 45.800 48.195 36.640 395 HA GLU 54 HA GLU 54 43.220 49.195 36.940 396 HB2 GLU 54 HB2 GLU 54 44.910 48.435 34.820 397 HB3 GLU 54 HB1 GLU 54 43.580 47.315 34.660 398 HG2 GLU 54 HG2 GLU 54 42.670 50.105 35.150 399 HG3 GLU 54 HG1 GLU 54 43.730 49.975 33.750 400 H GLU 55 H GLU 55 44.380 45.875 37.220 401 HA GLU 55 HA GLU 55 41.640 44.775 37.260 402 HB2 GLU 55 HB2 GLU 55 44.440 43.665 37.430 403 HB3 GLU 55 HB1 GLU 55 43.080 42.715 38.020 404 HG2 GLU 55 HG2 GLU 55 42.240 43.665 35.470 405 HG3 GLU 55 HG1 GLU 55 43.920 43.235 35.250 406 H ALA 56 H ALA 56 44.390 45.195 39.550 407 HA ALA 56 HA ALA 56 43.030 44.075 41.790 408 HB1 ALA 56 HB1 ALA 56 44.680 45.365 43.130 409 HB2 ALA 56 HB2 ALA 56 45.470 44.565 41.750 410 HB3 ALA 56 HB3 ALA 56 45.130 46.315 41.710 411 H VAL 57 H VAL 57 42.970 47.335 40.460 412 HA VAL 57 HA VAL 57 41.380 48.425 42.650 413 HB VAL 57 HB VAL 57 41.870 49.585 39.870 414 HG11 VAL 57 1HG1 VAL 57 41.300 51.745 41.030 415 HG12 VAL 57 2HG1 VAL 57 39.930 50.675 40.950 416 HG13 VAL 57 3HG1 VAL 57 40.810 50.735 42.460 417 HG21 VAL 57 1HG2 VAL 57 43.610 50.955 41.010 418 HG22 VAL 57 2HG2 VAL 57 43.330 50.035 42.520 419 HG23 VAL 57 3HG2 VAL 57 44.010 49.255 41.140 420 H ARG 58 H ARG 58 40.710 46.535 39.820 421 HA ARG 58 HA ARG 58 38.170 47.525 39.090 422 HB2 ARG 58 HB2 ARG 58 39.700 45.695 38.040 423 HB3 ARG 58 HB1 ARG 58 38.920 44.585 39.160 424 HG2 ARG 58 HG2 ARG 58 37.170 44.375 37.810 425 HG3 ARG 58 HG1 ARG 58 36.860 46.125 37.870 426 HD2 ARG 58 HD2 ARG 58 38.740 46.355 36.120 427 HD3 ARG 58 HD1 ARG 58 38.610 44.605 35.920 428 HE ARG 58 HE ARG 58 36.720 46.665 35.060 429 HH11 ARG 58 1HH1 ARG 58 37.040 43.305 35.880 430 HH12 ARG 58 2HH1 ARG 58 35.680 42.765 34.960 431 HH21 ARG 58 1HH2 ARG 58 34.950 46.015 33.880 432 HH22 ARG 58 2HH2 ARG 58 34.480 44.355 33.820 433 H GLU 59 H GLU 59 39.180 45.805 41.950 434 HA GLU 59 HA GLU 59 36.450 44.985 42.650 435 HB2 GLU 59 HB2 GLU 59 38.970 44.915 44.350 436 HB3 GLU 59 HB1 GLU 59 37.440 44.055 44.620 437 HG2 GLU 59 HG2 GLU 59 37.910 42.965 42.290 438 HG3 GLU 59 HG1 GLU 59 39.570 43.555 42.510 439 H TYR 60 H TYR 60 38.650 47.615 43.300 440 HA TYR 60 HA TYR 60 36.830 48.695 45.390 441 HB2 TYR 60 HB2 TYR 60 39.440 50.005 44.880 442 HB3 TYR 60 HB1 TYR 60 38.590 49.695 46.390 443 HD1 TYR 60 HD1 TYR 60 38.340 46.925 46.770 444 HD2 TYR 60 HD2 TYR 60 41.460 48.975 44.650 445 HE1 TYR 60 HE1 TYR 60 39.880 44.995 47.170 446 HE2 TYR 60 HE2 TYR 60 43.020 47.105 45.090 447 HH TYR 60 HH TYR 60 43.250 45.075 45.950 448 H LYS 61 H LYS 61 37.390 51.305 45.330 449 HA LYS 61 HA LYS 61 36.360 52.165 42.640 450 HB2 LYS 61 HB2 LYS 61 35.860 53.205 45.440 451 HB3 LYS 61 HB1 LYS 61 35.670 54.245 44.030 452 HG2 LYS 61 HG2 LYS 61 34.120 52.405 43.120 453 HG3 LYS 61 HG1 LYS 61 34.180 51.695 44.750 454 HD2 LYS 61 HD2 LYS 61 33.600 54.655 44.550 455 HD3 LYS 61 HD1 LYS 61 32.350 53.565 43.960 456 HE2 LYS 61 HE2 LYS 61 33.580 52.865 46.610 457 HE3 LYS 61 HE1 LYS 61 32.650 54.365 46.570 458 HZ1 LYS 61 HZ1 LYS 61 31.260 52.465 47.110 459 HZ2 LYS 61 HZ2 LYS 61 30.770 53.115 45.670 460 HZ3 LYS 61 HZ3 LYS 61 31.650 51.715 45.700 461 H LYS 62 H LYS 62 36.880 54.395 42.040 462 HA LYS 62 HA LYS 62 39.750 54.715 41.980 463 HB2 LYS 62 HB2 LYS 62 39.280 56.745 40.660 464 HB3 LYS 62 HB1 LYS 62 38.490 55.305 40.030 465 HG2 LYS 62 HG2 LYS 62 36.540 56.455 40.010 466 HG3 LYS 62 HG1 LYS 62 36.550 56.415 41.770 467 HD2 LYS 62 HD2 LYS 62 38.060 58.515 41.670 468 HD3 LYS 62 HD1 LYS 62 37.610 58.615 39.960 469 HE2 LYS 62 HE2 LYS 62 35.410 59.155 40.430 470 HE3 LYS 62 HE1 LYS 62 35.380 58.215 41.930 471 HZ1 LYS 62 HZ1 LYS 62 35.320 60.575 42.400 472 HZ2 LYS 62 HZ2 LYS 62 36.690 59.905 43.000 473 HZ3 LYS 62 HZ3 LYS 62 36.760 60.805 41.620 474 H GLY 63 H GLY 63 40.900 55.435 43.630 475 HA2 GLY 63 HA2 GLY 63 41.660 57.075 45.150 476 HA3 GLY 63 HA1 GLY 63 40.210 58.045 44.830 477 H ASP 64 H ASP 64 39.390 54.785 45.530 478 HA ASP 64 HA ASP 64 38.150 55.615 48.000 479 HB2 ASP 64 HB2 ASP 64 37.760 53.605 46.140 480 HB3 ASP 64 HB1 ASP 64 38.430 52.695 47.470 481 H GLU 65 H GLU 65 38.440 54.445 50.070 482 HA GLU 65 HA GLU 65 41.320 54.045 50.550 483 HB2 GLU 65 HB2 GLU 65 39.110 54.735 52.500 484 HB3 GLU 65 HB1 GLU 65 40.850 54.525 52.880 485 HG2 GLU 65 HG2 GLU 65 41.440 56.405 51.410 486 HG3 GLU 65 HG1 GLU 65 39.720 56.665 51.060 487 H ILE 66 H ILE 66 42.040 52.335 51.790 488 HA ILE 66 HA ILE 66 40.110 50.055 52.020 489 HB ILE 66 HB ILE 66 41.880 48.465 51.440 490 HG12 ILE 66 2HG1 ILE 66 43.630 50.875 50.890 491 HG13 ILE 66 1HG1 ILE 66 43.810 49.825 52.320 492 HG21 ILE 66 1HG2 ILE 66 42.110 48.975 49.040 493 HG22 ILE 66 2HG2 ILE 66 40.490 49.345 49.630 494 HG23 ILE 66 3HG2 ILE 66 41.660 50.665 49.340 495 HD11 ILE 66 HD1 ILE 66 45.470 49.275 50.660 496 HD12 ILE 66 HD2 ILE 66 44.320 47.925 50.860 497 HD13 ILE 66 HD3 ILE 66 44.230 48.995 49.430 498 H ALA 67 H ALA 67 41.150 48.235 53.470 499 HA ALA 67 HA ALA 67 42.580 49.525 55.750 500 HB1 ALA 67 HB1 ALA 67 41.090 48.365 57.310 501 HB2 ALA 67 HB2 ALA 67 40.200 49.515 56.280 502 HB3 ALA 67 HB3 ALA 67 40.110 47.765 55.940 503 H ALA 68 H ALA 68 44.180 48.395 56.580 504 HA ALA 68 HA ALA 68 44.220 45.505 56.420 505 HB1 ALA 68 HB1 ALA 68 46.320 45.385 55.090 506 HB2 ALA 68 HB2 ALA 68 44.990 46.115 54.150 507 HB3 ALA 68 HB3 ALA 68 46.270 47.135 54.820 508 H VAL 69 H VAL 69 46.360 44.655 57.230 509 HA VAL 69 HA VAL 69 47.250 46.345 59.510 510 HB VAL 69 HB VAL 69 47.980 44.155 60.560 511 HG11 VAL 69 1HG1 VAL 69 45.710 43.565 61.320 512 HG12 VAL 69 2HG1 VAL 69 45.950 45.315 61.280 513 HG13 VAL 69 3HG1 VAL 69 45.000 44.525 60.000 514 HG21 VAL 69 1HG2 VAL 69 46.920 42.085 59.730 515 HG22 VAL 69 2HG2 VAL 69 46.210 42.965 58.350 516 HG23 VAL 69 3HG2 VAL 69 47.940 42.825 58.500 517 H VAL 70 H VAL 70 49.360 46.455 60.120 518 HA VAL 70 HA VAL 70 51.260 45.965 57.870 519 HB VAL 70 HB VAL 70 51.270 48.235 58.610 520 HG11 VAL 70 1HG1 VAL 70 51.840 48.895 60.930 521 HG12 VAL 70 2HG1 VAL 70 50.310 47.985 60.860 522 HG13 VAL 70 3HG1 VAL 70 51.780 47.205 61.420 523 HG21 VAL 70 1HG2 VAL 70 53.640 48.485 59.270 524 HG22 VAL 70 2HG2 VAL 70 53.740 46.765 59.690 525 HG23 VAL 70 3HG2 VAL 70 53.380 47.235 58.020 526 H LEU 71 H LEU 71 52.700 44.405 57.920 527 HA LEU 71 HA LEU 71 53.360 43.145 60.580 528 HB2 LEU 71 HB2 LEU 71 53.860 41.355 58.370 529 HB3 LEU 71 HB1 LEU 71 52.860 41.125 59.790 530 HG LEU 71 HG LEU 71 51.860 42.565 57.310 531 HD11 LEU 71 1HD1 LEU 71 50.870 40.435 56.670 532 HD12 LEU 71 2HD1 LEU 71 52.590 40.315 56.700 533 HD13 LEU 71 3HD1 LEU 71 51.600 39.635 58.040 534 HD21 LEU 71 1HD2 LEU 71 49.730 42.045 58.340 535 HD22 LEU 71 2HD2 LEU 71 50.440 41.245 59.700 536 HD23 LEU 71 3HD2 LEU 71 50.580 42.995 59.440 537 H GLN 72 H GLN 72 54.580 43.845 57.290 538 HA GLN 72 HA GLN 72 57.270 44.055 58.520 539 HB2 GLN 72 HB2 GLN 72 56.480 41.895 56.850 540 HB3 GLN 72 HB1 GLN 72 57.330 43.025 55.780 541 HG2 GLN 72 HG2 GLN 72 59.100 41.825 56.430 542 HG3 GLN 72 HG1 GLN 72 59.150 43.115 57.630 543 HE21 GLN 72 1HE2 GLN 72 59.650 42.255 59.590 544 HE22 GLN 72 2HE2 GLN 72 59.050 40.705 60.190 545 H VAL 73 H VAL 73 58.350 45.865 57.900 546 HA VAL 73 HA VAL 73 57.700 47.165 55.380 547 HB VAL 73 HB VAL 73 57.260 49.325 56.420 548 HG11 VAL 73 1HG1 VAL 73 54.970 48.885 57.230 549 HG12 VAL 73 2HG1 VAL 73 55.270 47.745 55.910 550 HG13 VAL 73 3HG1 VAL 73 55.400 47.185 57.530 551 HG21 VAL 73 1HG2 VAL 73 56.650 49.325 58.800 552 HG22 VAL 73 2HG2 VAL 73 57.300 47.755 59.050 553 HG23 VAL 73 3HG2 VAL 73 58.380 49.115 58.570 554 H ASP 74 H ASP 74 59.440 48.095 54.540 555 HA ASP 74 HA ASP 74 61.770 48.585 56.370 556 HB2 ASP 74 HB2 ASP 74 61.990 47.665 53.540 557 HB3 ASP 74 HB1 ASP 74 63.270 47.745 54.740 558 H ALA 75 H ALA 75 62.760 50.515 56.190 559 HA ALA 75 HA ALA 75 61.540 52.535 54.470 560 HB1 ALA 75 HB1 ALA 75 63.150 54.035 55.570 561 HB2 ALA 75 HB2 ALA 75 62.280 53.065 56.770 562 HB3 ALA 75 HB3 ALA 75 63.970 52.665 56.330 563 H GLU 76 H GLU 76 64.440 50.575 54.380 564 HA GLU 76 HA GLU 76 65.560 52.115 52.120 565 HB2 GLU 76 HB2 GLU 76 66.500 49.625 53.630 566 HB3 GLU 76 HB1 GLU 76 67.360 50.305 52.250 567 HG2 GLU 76 HG2 GLU 76 66.830 51.665 54.920 568 HG3 GLU 76 HG1 GLU 76 68.370 51.035 54.320 569 H ARG 77 H ARG 77 64.010 48.985 52.750 570 HA ARG 77 HA ARG 77 64.350 48.185 49.940 571 HB2 ARG 77 HB2 ARG 77 64.170 46.735 52.220 572 HB3 ARG 77 HB1 ARG 77 62.470 46.785 51.760 573 HG2 ARG 77 HG2 ARG 77 62.770 45.585 49.800 574 HG3 ARG 77 HG1 ARG 77 64.510 45.965 49.700 575 HD2 ARG 77 HD2 ARG 77 65.040 44.505 51.490 576 HD3 ARG 77 HD1 ARG 77 63.340 44.305 51.960 577 HE ARG 77 HE ARG 77 63.620 43.435 49.280 578 HH11 ARG 77 1HH1 ARG 77 64.680 42.525 52.490 579 HH12 ARG 77 2HH1 ARG 77 64.820 40.825 52.140 580 HH21 ARG 77 1HH2 ARG 77 63.770 41.215 48.810 581 HH22 ARG 77 2HH2 ARG 77 64.290 40.085 50.020 582 H GLU 78 H GLU 78 62.040 49.955 51.840 583 HA GLU 78 HA GLU 78 60.030 50.865 51.390 584 HB2 GLU 78 HB2 GLU 78 60.600 50.385 48.440 585 HB3 GLU 78 HB1 GLU 78 59.610 51.615 49.210 586 HG2 GLU 78 HG2 GLU 78 61.790 52.505 50.280 587 HG3 GLU 78 HG1 GLU 78 62.650 51.365 49.230 588 H ARG 79 H ARG 79 60.280 47.925 51.700 589 HA ARG 79 HA ARG 79 57.970 46.965 50.060 590 HB2 ARG 79 HB2 ARG 79 58.660 44.725 50.630 591 HB3 ARG 79 HB1 ARG 79 59.950 45.625 49.820 592 HG2 ARG 79 HG2 ARG 79 61.310 44.995 51.470 593 HG3 ARG 79 HG1 ARG 79 60.470 46.105 52.530 594 HD2 ARG 79 HD2 ARG 79 60.100 44.285 53.800 595 HD3 ARG 79 HD1 ARG 79 58.800 43.955 52.660 596 HE ARG 79 HE ARG 79 61.400 42.935 51.820 597 HH11 ARG 79 1HH1 ARG 79 58.600 42.305 53.780 598 HH12 ARG 79 2HH1 ARG 79 58.780 40.565 53.800 599 HH21 ARG 79 1HH2 ARG 79 61.650 40.665 51.790 600 HH22 ARG 79 2HH2 ARG 79 60.530 39.645 52.650 601 H ILE 80 H ILE 80 56.120 47.355 51.040 602 HA ILE 80 HA ILE 80 55.910 46.785 53.980 603 HB ILE 80 HB ILE 80 53.880 48.205 53.890 604 HG12 ILE 80 2HG1 ILE 80 54.770 49.705 51.520 605 HG13 ILE 80 1HG1 ILE 80 54.250 48.085 51.100 606 HG21 ILE 80 1HG2 ILE 80 55.090 50.355 53.910 607 HG22 ILE 80 2HG2 ILE 80 56.060 49.135 54.690 608 HG23 ILE 80 3HG2 ILE 80 56.500 49.585 53.100 609 HD11 ILE 80 HD1 ILE 80 52.430 49.625 50.910 610 HD12 ILE 80 HD2 ILE 80 52.110 48.425 52.180 611 HD13 ILE 80 HD3 ILE 80 52.600 50.095 52.620 612 H SER 81 H SER 81 55.250 44.785 54.270 613 HA SER 81 HA SER 81 53.160 43.685 52.460 614 HB2 SER 81 HB2 SER 81 53.740 41.615 54.080 615 HB3 SER 81 HB1 SER 81 54.610 41.975 52.570 616 HG SER 81 HG SER 81 55.950 41.575 54.430 617 H LEU 82 H LEU 82 51.200 43.095 53.130 618 HA LEU 82 HA LEU 82 50.450 43.755 55.910 619 HB2 LEU 82 HB2 LEU 82 48.130 44.095 54.840 620 HB3 LEU 82 HB1 LEU 82 49.320 45.365 54.730 621 HG LEU 82 HG LEU 82 49.880 44.715 52.420 622 HD11 LEU 82 1HD1 LEU 82 48.460 43.105 51.170 623 HD12 LEU 82 2HD1 LEU 82 49.420 42.335 52.400 624 HD13 LEU 82 3HD1 LEU 82 47.710 42.575 52.680 625 HD21 LEU 82 1HD2 LEU 82 47.800 45.445 51.350 626 HD22 LEU 82 2HD2 LEU 82 46.930 45.195 52.850 627 HD23 LEU 82 3HD2 LEU 82 48.190 46.415 52.790 628 H GLY 83 H GLY 83 48.890 42.565 56.910 629 HA2 GLY 83 HA2 GLY 83 48.840 39.715 56.060 630 HA3 GLY 83 HA1 GLY 83 48.450 40.345 57.680 631 H VAL 84 H VAL 84 46.910 42.315 55.610 632 HA VAL 84 HA VAL 84 44.320 41.405 56.290 633 HB VAL 84 HB VAL 84 44.780 43.685 55.600 634 HG11 VAL 84 1HG1 VAL 84 45.040 44.265 53.180 635 HG12 VAL 84 2HG1 VAL 84 46.360 43.365 53.930 636 HG13 VAL 84 3HG1 VAL 84 45.230 42.585 52.790 637 HG21 VAL 84 1HG2 VAL 84 42.830 44.055 54.110 638 HG22 VAL 84 2HG2 VAL 84 42.780 42.335 53.730 639 HG23 VAL 84 3HG2 VAL 84 42.470 42.885 55.410 640 H LYS 85 H LYS 85 46.410 40.745 53.470 641 HA LYS 85 HA LYS 85 44.350 39.395 51.940 642 HB2 LYS 85 HB2 LYS 85 47.420 39.435 51.840 643 HB3 LYS 85 HB1 LYS 85 46.430 38.465 50.750 644 HG2 LYS 85 HG2 LYS 85 45.320 41.095 50.640 645 HG3 LYS 85 HG1 LYS 85 47.080 41.295 50.640 646 HD2 LYS 85 HD2 LYS 85 47.160 39.515 48.800 647 HD3 LYS 85 HD1 LYS 85 45.400 39.625 48.730 648 HE2 LYS 85 HE2 LYS 85 46.590 42.295 48.670 649 HE3 LYS 85 HE1 LYS 85 47.370 41.275 47.460 650 HZ1 LYS 85 HZ1 LYS 85 45.400 42.375 46.550 651 HZ2 LYS 85 HZ2 LYS 85 45.160 40.755 46.560 652 HZ3 LYS 85 HZ3 LYS 85 44.430 41.685 47.680 653 H GLN 86 H GLN 86 46.640 38.395 54.410 654 HA GLN 86 HA GLN 86 46.080 35.525 53.970 655 HB2 GLN 86 HB2 GLN 86 48.350 36.155 54.620 656 HB3 GLN 86 HB1 GLN 86 47.760 37.065 56.010 657 HG2 GLN 86 HG2 GLN 86 48.680 34.905 56.710 658 HG3 GLN 86 HG1 GLN 86 46.980 35.005 57.110 659 HE21 GLN 86 1HE2 GLN 86 48.820 34.145 54.110 660 HE22 GLN 86 2HE2 GLN 86 47.960 32.605 53.910 661 H LEU 87 H LEU 87 44.800 38.195 55.830 662 HA LEU 87 HA LEU 87 43.750 36.655 57.980 663 HB2 LEU 87 HB2 LEU 87 43.970 39.355 57.400 664 HB3 LEU 87 HB1 LEU 87 42.290 39.105 56.980 665 HG LEU 87 HG LEU 87 42.020 38.025 59.320 666 HD11 LEU 87 1HD1 LEU 87 43.690 38.825 60.990 667 HD12 LEU 87 2HD1 LEU 87 44.440 37.745 59.810 668 HD13 LEU 87 3HD1 LEU 87 44.680 39.495 59.680 669 HD21 LEU 87 1HD2 LEU 87 41.770 40.265 60.350 670 HD22 LEU 87 2HD2 LEU 87 42.700 40.985 59.010 671 HD23 LEU 87 3HD2 LEU 87 41.120 40.225 58.700 672 H ALA 88 H ALA 88 42.100 37.955 55.050 673 HA ALA 88 HA ALA 88 40.520 35.545 54.840 674 HB1 ALA 88 HB1 ALA 88 38.350 36.745 54.990 675 HB2 ALA 88 HB2 ALA 88 39.230 36.825 56.530 676 HB3 ALA 88 HB3 ALA 88 39.200 38.235 55.440 677 H GLU 89 H GLU 89 39.280 35.465 52.900 678 HA GLU 89 HA GLU 89 40.640 36.845 50.710 679 HB2 GLU 89 HB2 GLU 89 39.530 34.295 50.990 680 HB3 GLU 89 HB1 GLU 89 38.290 35.135 50.080 681 HG2 GLU 89 HG2 GLU 89 40.270 35.925 48.550 682 HG3 GLU 89 HG1 GLU 89 41.180 34.645 49.350 683 H ASP 90 H ASP 90 38.820 37.215 48.800 684 HA ASP 90 HA ASP 90 36.810 39.045 49.960 685 HB2 ASP 90 HB2 ASP 90 38.450 39.655 47.480 686 HB3 ASP 90 HB1 ASP 90 37.340 40.715 48.310 687 HA PRO 91 HA PRO 91 33.960 37.075 47.250 688 HB2 PRO 91 HB1 PRO 91 32.180 39.145 46.720 689 HB3 PRO 91 HB2 PRO 91 32.280 38.305 48.300 690 HG2 PRO 91 HG1 PRO 91 33.530 40.935 47.450 691 HG3 PRO 91 HG2 PRO 91 32.650 40.545 48.980 692 HD2 PRO 91 HD1 PRO 91 35.350 40.585 48.800 693 HD3 PRO 91 HD2 PRO 91 34.520 39.435 49.870 694 H PHE 92 H PHE 92 36.010 39.565 46.170 695 HA PHE 92 HA PHE 92 36.750 40.215 44.170 696 HB2 PHE 92 HB2 PHE 92 35.800 37.455 43.730 697 HB3 PHE 92 HB1 PHE 92 35.650 38.425 42.280 698 HD1 PHE 92 HD1 PHE 92 38.040 37.445 45.000 699 HD2 PHE 92 HD2 PHE 92 37.540 38.815 40.940 700 HE1 PHE 92 HE1 PHE 92 40.450 37.085 44.580 701 HE2 PHE 92 HE2 PHE 92 39.950 38.455 40.510 702 HZ PHE 92 HZ PHE 92 41.420 37.595 42.330 703 H ASN 93 H ASN 93 36.120 41.045 42.000 704 HA ASN 93 HA ASN 93 33.320 41.365 41.420 705 HB2 ASN 93 HB2 ASN 93 33.730 42.995 43.400 706 HB3 ASN 93 HB1 ASN 93 34.750 43.885 42.290 707 HD21 ASN 93 1HD2 ASN 93 33.750 45.525 41.270 708 HD22 ASN 93 2HD2 ASN 93 32.020 45.615 40.970 709 H ASN 94 H ASN 94 32.930 42.425 39.460 710 HA ASN 94 HA ASN 94 35.270 42.505 37.670 711 HB2 ASN 94 HB2 ASN 94 32.370 41.905 37.360 712 HB3 ASN 94 HB1 ASN 94 32.970 42.945 36.110 713 HD21 ASN 94 1HD2 ASN 94 33.720 42.015 34.370 714 HD22 ASN 94 2HD2 ASN 94 34.400 40.375 34.330 Start of MODEL 4 1 H LYS 1 H1 LYS 1 59.315 69.585 51.330 2 HA LYS 1 HA LYS 1 57.325 68.895 50.150 3 HB2 LYS 1 HB2 LYS 1 58.995 69.855 47.820 4 HB3 LYS 1 HB1 LYS 1 57.935 68.465 47.560 5 HG2 LYS 1 HG2 LYS 1 55.975 69.655 48.060 6 HG3 LYS 1 HG1 LYS 1 56.855 71.005 48.800 7 HD2 LYS 1 HD2 LYS 1 57.745 71.705 46.640 8 HD3 LYS 1 HD1 LYS 1 57.115 70.245 45.860 9 HE2 LYS 1 HE2 LYS 1 55.675 72.125 45.330 10 HE3 LYS 1 HE1 LYS 1 54.805 70.945 46.310 11 HZ1 LYS 1 HZ1 LYS 1 54.415 73.205 47.080 12 HZ2 LYS 1 HZ2 LYS 1 55.195 72.365 48.250 13 HZ3 LYS 1 HZ3 LYS 1 56.015 73.465 47.320 14 H ALA 2 H ALA 2 60.795 68.175 49.770 15 HA ALA 2 HA ALA 2 60.145 65.295 49.530 16 HB1 ALA 2 HB1 ALA 2 62.505 65.115 48.850 17 HB2 ALA 2 HB2 ALA 2 61.645 66.255 47.810 18 HB3 ALA 2 HB3 ALA 2 62.745 66.855 49.090 19 H ASN 3 H ASN 3 62.195 64.135 50.630 20 HA ASN 3 HA ASN 3 63.025 63.345 52.580 21 HB2 ASN 3 HB2 ASN 3 63.175 66.175 53.620 22 HB3 ASN 3 HB1 ASN 3 64.255 64.795 53.900 23 HD21 ASN 3 1HD2 ASN 3 65.065 63.895 51.570 24 HD22 ASN 3 2HD2 ASN 3 65.765 65.165 50.580 25 HA PRO 4 HA PRO 4 58.835 63.855 54.540 26 HB2 PRO 4 HB1 PRO 4 58.105 61.195 54.350 27 HB3 PRO 4 HB2 PRO 4 57.815 62.385 53.060 28 HG2 PRO 4 HG1 PRO 4 60.045 60.355 53.380 29 HG3 PRO 4 HG2 PRO 4 59.085 60.735 51.910 30 HD2 PRO 4 HD1 PRO 4 61.565 61.745 52.350 31 HD3 PRO 4 HD2 PRO 4 60.285 62.695 51.520 32 H TRP 5 H TRP 5 60.375 64.315 56.360 33 HA TRP 5 HA TRP 5 61.265 62.035 57.950 34 HB2 TRP 5 HB2 TRP 5 61.125 65.015 58.590 35 HB3 TRP 5 HB1 TRP 5 61.965 63.785 59.540 36 HD1 TRP 5 HD1 TRP 5 62.635 66.235 56.910 37 HE1 TRP 5 HE1 TRP 5 64.915 65.795 55.810 38 HE3 TRP 5 HE3 TRP 5 63.505 61.515 58.690 39 HZ2 TRP 5 HZ2 TRP 5 66.845 63.665 55.670 40 HZ3 TRP 5 HZ3 TRP 5 65.565 60.305 58.050 41 HH2 TRP 5 HH2 TRP 5 67.235 61.355 56.550 42 H GLN 6 H GLN 6 58.445 64.025 57.810 43 HA GLN 6 HA GLN 6 57.505 63.475 60.510 44 HB2 GLN 6 HB2 GLN 6 55.815 64.265 58.090 45 HB3 GLN 6 HB1 GLN 6 55.445 64.515 59.800 46 HG2 GLN 6 HG2 GLN 6 57.755 65.875 58.310 47 HG3 GLN 6 HG1 GLN 6 56.165 66.575 58.560 48 HE21 GLN 6 1HE2 GLN 6 55.585 67.345 60.640 49 HE22 GLN 6 2HE2 GLN 6 56.785 67.475 61.920 50 H GLN 7 H GLN 7 57.325 61.805 57.400 51 HA GLN 7 HA GLN 7 55.095 60.075 58.140 52 HB2 GLN 7 HB2 GLN 7 57.285 59.765 56.040 53 HB3 GLN 7 HB1 GLN 7 55.825 58.805 56.140 54 HG2 GLN 7 HG2 GLN 7 55.365 61.775 56.020 55 HG3 GLN 7 HG1 GLN 7 56.105 61.065 54.590 56 HE21 GLN 7 1HE2 GLN 7 54.915 59.775 53.220 57 HE22 GLN 7 2HE2 GLN 7 53.195 59.505 53.560 58 H PHE 8 H PHE 8 58.585 60.105 58.680 59 HA PHE 8 HA PHE 8 58.995 57.345 59.120 60 HB2 PHE 8 HB2 PHE 8 60.375 59.835 60.050 61 HB3 PHE 8 HB1 PHE 8 60.805 58.295 60.750 62 HD1 PHE 8 HD1 PHE 8 62.845 57.625 59.910 63 HD2 PHE 8 HD2 PHE 8 59.915 59.215 57.210 64 HE1 PHE 8 HE1 PHE 8 64.345 57.165 57.990 65 HE2 PHE 8 HE2 PHE 8 61.405 58.795 55.300 66 HZ PHE 8 HZ PHE 8 63.635 57.765 55.680 67 H ALA 9 H ALA 9 57.515 59.835 61.100 68 HA ALA 9 HA ALA 9 57.575 58.165 63.540 69 HB1 ALA 9 HB1 ALA 9 56.335 60.055 64.510 70 HB2 ALA 9 HB2 ALA 9 57.815 60.635 63.700 71 HB3 ALA 9 HB3 ALA 9 56.215 60.835 62.920 72 H GLU 10 H GLU 10 55.565 58.525 60.750 73 HA GLU 10 HA GLU 10 53.195 57.465 62.160 74 HB2 GLU 10 HB2 GLU 10 53.525 58.135 59.210 75 HB3 GLU 10 HB1 GLU 10 52.045 57.905 60.160 76 HG2 GLU 10 HG2 GLU 10 54.015 60.185 60.420 77 HG3 GLU 10 HG1 GLU 10 52.455 60.285 59.650 78 H THR 11 H THR 11 55.825 56.455 60.130 79 HA THR 11 HA THR 11 54.575 53.975 59.420 80 HB THR 11 HB THR 11 56.145 55.035 57.840 81 HG1 THR 11 HG1 THR 11 57.365 53.145 57.430 82 HG21 THR 11 1HG2 THR 11 58.575 54.945 58.350 83 HG22 THR 11 2HG2 THR 11 57.655 55.905 59.520 84 HG23 THR 11 3HG2 THR 11 58.225 54.315 59.980 85 H HIS 12 H HIS 12 55.495 54.945 62.290 86 HA HIS 12 HA HIS 12 57.195 52.685 63.090 87 HB2 HIS 12 HB2 HIS 12 57.235 53.705 65.230 88 HB3 HIS 12 HB1 HIS 12 57.305 55.045 64.070 89 HD2 HIS 12 HD2 HIS 12 56.095 55.265 67.170 90 HE1 HIS 12 HE1 HIS 12 52.405 55.925 65.130 91 HE2 HIS 12 HE2 HIS 12 53.625 56.195 67.350 92 H ASN 13 H ASN 13 53.925 53.065 62.440 93 HA ASN 13 HA ASN 13 52.725 51.615 64.590 94 HB2 ASN 13 HB2 ASN 13 51.865 52.035 61.700 95 HB3 ASN 13 HB1 ASN 13 50.845 51.285 62.930 96 HD21 ASN 13 1HD2 ASN 13 50.695 53.885 61.350 97 HD22 ASN 13 2HD2 ASN 13 50.375 55.085 62.580 98 H LYS 14 H LYS 14 51.655 49.505 64.330 99 HA LYS 14 HA LYS 14 52.485 47.545 62.500 100 HB2 LYS 14 HB2 LYS 14 54.065 46.205 63.920 101 HB3 LYS 14 HB1 LYS 14 54.745 47.655 63.260 102 HG2 LYS 14 HG2 LYS 14 53.615 48.365 65.830 103 HG3 LYS 14 HG1 LYS 14 54.495 46.855 66.040 104 HD2 LYS 14 HD2 LYS 14 56.535 47.835 65.310 105 HD3 LYS 14 HD1 LYS 14 55.705 49.195 64.550 106 HE2 LYS 14 HE2 LYS 14 54.955 50.025 66.750 107 HE3 LYS 14 HE1 LYS 14 55.775 48.665 67.560 108 HZ1 LYS 14 HZ1 LYS 14 57.125 50.685 67.550 109 HZ2 LYS 14 HZ2 LYS 14 57.865 49.535 66.620 110 HZ3 LYS 14 HZ3 LYS 14 57.035 50.775 65.910 111 H GLY 15 H GLY 15 50.685 46.405 62.610 112 HA2 GLY 15 HA2 GLY 15 49.615 44.495 63.760 113 HA3 GLY 15 HA1 GLY 15 49.725 45.425 65.280 114 H ASP 16 H ASP 16 48.945 47.495 62.740 115 HA ASP 16 HA ASP 16 46.065 47.365 63.440 116 HB2 ASP 16 HB2 ASP 16 47.375 49.785 62.220 117 HB3 ASP 16 HB1 ASP 16 45.945 49.655 63.250 118 H ARG 17 H ARG 17 44.815 48.605 61.600 119 HA ARG 17 HA ARG 17 45.475 47.295 59.000 120 HB2 ARG 17 HB2 ARG 17 43.015 47.345 58.570 121 HB3 ARG 17 HB1 ARG 17 43.505 46.215 59.800 122 HG2 ARG 17 HG2 ARG 17 42.695 48.935 60.790 123 HG3 ARG 17 HG1 ARG 17 41.445 47.895 60.110 124 HD2 ARG 17 HD2 ARG 17 42.615 46.085 61.710 125 HD3 ARG 17 HD1 ARG 17 43.165 47.545 62.550 126 HE ARG 17 HE ARG 17 40.385 47.775 62.040 127 HH11 ARG 17 1HH1 ARG 17 42.605 45.855 63.960 128 HH12 ARG 17 2HH1 ARG 17 41.455 45.505 65.210 129 HH21 ARG 17 1HH2 ARG 17 38.875 47.325 63.670 130 HH22 ARG 17 2HH2 ARG 17 39.325 46.345 65.040 131 H VAL 18 H VAL 18 45.805 48.465 57.320 132 HA VAL 18 HA VAL 18 44.905 51.315 57.400 133 HB VAL 18 HB VAL 18 46.885 51.935 56.130 134 HG11 VAL 18 1HG1 VAL 18 48.515 51.655 57.850 135 HG12 VAL 18 2HG1 VAL 18 46.965 52.095 58.570 136 HG13 VAL 18 3HG1 VAL 18 47.585 50.415 58.680 137 HG21 VAL 18 1HG2 VAL 18 48.765 50.355 55.800 138 HG22 VAL 18 2HG2 VAL 18 47.795 49.035 56.490 139 HG23 VAL 18 3HG2 VAL 18 47.315 49.795 54.950 140 H GLU 19 H GLU 19 45.285 52.165 54.950 141 HA GLU 19 HA GLU 19 44.245 50.215 53.030 142 HB2 GLU 19 HB2 GLU 19 42.655 52.405 54.280 143 HB3 GLU 19 HB1 GLU 19 42.705 52.485 52.510 144 HG2 GLU 19 HG2 GLU 19 42.055 49.995 52.540 145 HG3 GLU 19 HG1 GLU 19 41.735 50.195 54.260 146 H GLY 20 H GLY 20 44.795 50.655 51.000 147 HA2 GLY 20 HA2 GLY 20 47.075 52.275 50.540 148 HA3 GLY 20 HA1 GLY 20 46.085 51.505 49.290 149 H LYS 21 H LYS 21 46.995 53.735 48.420 150 HA LYS 21 HA LYS 21 44.695 55.575 48.620 151 HB2 LYS 21 HB2 LYS 21 46.205 57.535 48.680 152 HB3 LYS 21 HB1 LYS 21 46.225 56.585 50.170 153 HG2 LYS 21 HG2 LYS 21 48.405 56.085 50.020 154 HG3 LYS 21 HG1 LYS 21 48.315 55.665 48.320 155 HD2 LYS 21 HD2 LYS 21 48.825 57.695 47.550 156 HD3 LYS 21 HD1 LYS 21 48.135 58.565 48.950 157 HE2 LYS 21 HE2 LYS 21 49.975 58.325 50.260 158 HE3 LYS 21 HE1 LYS 21 50.485 56.815 49.500 159 HZ1 LYS 21 HZ1 LYS 21 51.945 58.595 48.920 160 HZ2 LYS 21 HZ2 LYS 21 51.185 58.035 47.570 161 HZ3 LYS 21 HZ3 LYS 21 50.675 59.455 48.250 162 H ILE 22 H ILE 22 44.165 56.645 46.790 163 HA ILE 22 HA ILE 22 45.495 55.715 44.370 164 HB ILE 22 HB ILE 22 42.925 56.165 44.740 165 HG12 ILE 22 2HG1 ILE 22 42.655 56.725 42.340 166 HG13 ILE 22 1HG1 ILE 22 44.375 57.005 42.190 167 HG21 ILE 22 1HG2 ILE 22 42.195 58.425 44.010 168 HG22 ILE 22 2HG2 ILE 22 43.185 58.525 45.480 169 HG23 ILE 22 3HG2 ILE 22 43.835 58.965 43.890 170 HD11 ILE 22 HD1 ILE 22 43.795 54.765 41.410 171 HD12 ILE 22 HD2 ILE 22 44.815 54.615 42.840 172 HD13 ILE 22 HD3 ILE 22 43.065 54.365 43.000 173 H LYS 23 H LYS 23 45.985 58.325 46.440 174 HA LYS 23 HA LYS 23 46.575 60.425 44.650 175 HB2 LYS 23 HB2 LYS 23 46.555 60.345 47.290 176 HB3 LYS 23 HB1 LYS 23 48.215 59.785 47.120 177 HG2 LYS 23 HG2 LYS 23 48.065 62.115 45.500 178 HG3 LYS 23 HG1 LYS 23 47.125 62.475 46.940 179 HD2 LYS 23 HD2 LYS 23 49.355 63.155 47.410 180 HD3 LYS 23 HD1 LYS 23 49.095 61.665 48.330 181 HE2 LYS 23 HE2 LYS 23 50.215 60.385 46.450 182 HE3 LYS 23 HE1 LYS 23 50.505 61.895 45.620 183 HZ1 LYS 23 HZ1 LYS 23 52.445 61.225 46.890 184 HZ2 LYS 23 HZ2 LYS 23 51.855 62.635 47.480 185 HZ3 LYS 23 HZ3 LYS 23 51.595 61.265 48.310 186 H SER 24 H SER 24 48.195 57.445 45.040 187 HA SER 24 HA SER 24 50.795 58.375 43.970 188 HB2 SER 24 HB2 SER 24 50.145 56.365 45.750 189 HB3 SER 24 HB1 SER 24 50.295 55.465 44.230 190 HG SER 24 HG SER 24 52.355 55.715 45.090 191 H ILE 25 H ILE 25 51.505 56.305 42.380 192 HA ILE 25 HA ILE 25 49.605 56.555 40.090 193 HB ILE 25 HB ILE 25 51.595 56.395 38.640 194 HG12 ILE 25 2HG1 ILE 25 53.045 55.325 40.570 195 HG13 ILE 25 1HG1 ILE 25 53.785 56.315 39.330 196 HG21 ILE 25 1HG2 ILE 25 52.405 58.705 38.970 197 HG22 ILE 25 2HG2 ILE 25 50.635 58.605 39.150 198 HG23 ILE 25 3HG2 ILE 25 51.655 58.755 40.580 199 HD11 ILE 25 HD1 ILE 25 54.665 56.815 41.570 200 HD12 ILE 25 HD2 ILE 25 53.885 58.235 40.850 201 HD13 ILE 25 HD3 ILE 25 53.065 57.305 42.120 202 H THR 26 H THR 26 49.595 54.795 38.610 203 HA THR 26 HA THR 26 50.115 52.185 39.940 204 HB THR 26 HB THR 26 48.295 52.815 37.580 205 HG1 THR 26 HG1 THR 26 46.685 52.475 39.230 206 HG21 THR 26 1HG2 THR 26 47.355 50.575 38.070 207 HG22 THR 26 2HG2 THR 26 49.065 50.455 37.670 208 HG23 THR 26 3HG2 THR 26 48.545 50.365 39.340 209 H ASP 27 H ASP 27 51.175 50.555 38.860 210 HA ASP 27 HA ASP 27 52.675 49.585 37.490 211 HB2 ASP 27 HB2 ASP 27 50.765 50.715 35.790 212 HB3 ASP 27 HB1 ASP 27 52.285 51.285 35.110 213 H PHE 28 H PHE 28 53.185 52.215 38.910 214 HA PHE 28 HA PHE 28 55.935 52.585 38.010 215 HB2 PHE 28 HB2 PHE 28 53.815 54.735 37.740 216 HB3 PHE 28 HB1 PHE 28 55.525 55.165 37.880 217 HD1 PHE 28 HD1 PHE 28 57.095 53.555 36.300 218 HD2 PHE 28 HD2 PHE 28 53.045 54.805 35.560 219 HE1 PHE 28 HE1 PHE 28 57.455 53.265 33.870 220 HE2 PHE 28 HE2 PHE 28 53.405 54.535 33.120 221 HZ PHE 28 HZ PHE 28 55.615 53.755 32.270 222 H GLY 29 H GLY 29 54.685 51.585 40.380 223 HA2 GLY 29 HA2 GLY 29 55.675 51.725 42.570 224 HA3 GLY 29 HA1 GLY 29 55.975 53.465 42.320 225 H ILE 30 H ILE 30 53.535 51.015 42.980 226 HA ILE 30 HA ILE 30 51.505 53.015 43.590 227 HB ILE 30 HB ILE 30 51.605 50.005 43.940 228 HG12 ILE 30 2HG1 ILE 30 49.965 51.905 42.190 229 HG13 ILE 30 1HG1 ILE 30 51.335 50.925 41.670 230 HG21 ILE 30 1HG2 ILE 30 49.295 50.145 44.690 231 HG22 ILE 30 2HG2 ILE 30 50.285 50.955 45.830 232 HG23 ILE 30 3HG2 ILE 30 49.335 51.925 44.660 233 HD11 ILE 30 HD1 ILE 30 49.235 49.835 41.080 234 HD12 ILE 30 HD2 ILE 30 50.045 48.845 42.280 235 HD13 ILE 30 HD3 ILE 30 48.635 49.885 42.700 236 H PHE 31 H PHE 31 51.195 54.005 45.430 237 HA PHE 31 HA PHE 31 52.725 53.105 47.810 238 HB2 PHE 31 HB2 PHE 31 51.655 55.825 47.100 239 HB3 PHE 31 HB1 PHE 31 52.115 55.425 48.710 240 HD1 PHE 31 HD1 PHE 31 54.165 56.255 49.350 241 HD2 PHE 31 HD2 PHE 31 53.725 54.795 45.330 242 HE1 PHE 31 HE1 PHE 31 56.545 56.785 48.860 243 HE2 PHE 31 HE2 PHE 31 56.035 55.345 44.830 244 HZ PHE 31 HZ PHE 31 57.475 56.365 46.590 245 H ILE 32 H ILE 32 51.785 52.785 49.760 246 HA ILE 32 HA ILE 32 48.815 52.965 49.890 247 HB ILE 32 HB ILE 32 48.835 50.785 51.120 248 HG12 ILE 32 2HG1 ILE 32 51.235 49.695 49.830 249 HG13 ILE 32 1HG1 ILE 32 51.695 50.995 50.900 250 HG21 ILE 32 1HG2 ILE 32 49.015 49.425 49.090 251 HG22 ILE 32 2HG2 ILE 32 48.085 50.925 48.800 252 HG23 ILE 32 3HG2 ILE 32 49.735 50.745 48.200 253 HD11 ILE 32 HD1 ILE 32 51.745 48.925 52.100 254 HD12 ILE 32 HD2 ILE 32 50.465 49.955 52.770 255 HD13 ILE 32 HD3 ILE 32 50.045 48.585 51.700 256 H GLY 33 H GLY 33 48.325 54.345 51.460 257 HA2 GLY 33 HA2 GLY 33 49.245 53.815 54.120 258 HA3 GLY 33 HA1 GLY 33 50.025 55.265 53.470 259 H LEU 34 H LEU 34 48.755 55.875 55.530 260 HA LEU 34 HA LEU 34 46.025 56.725 54.700 261 HB2 LEU 34 HB2 LEU 34 46.265 55.275 56.770 262 HB3 LEU 34 HB1 LEU 34 47.145 56.605 57.510 263 HG LEU 34 HG LEU 34 45.165 58.035 57.470 264 HD11 LEU 34 1HD1 LEU 34 42.995 57.185 56.640 265 HD12 LEU 34 2HD1 LEU 34 44.155 57.275 55.330 266 HD13 LEU 34 3HD1 LEU 34 43.795 55.705 56.060 267 HD21 LEU 34 1HD2 LEU 34 43.715 56.785 58.970 268 HD22 LEU 34 2HD2 LEU 34 44.535 55.275 58.520 269 HD23 LEU 34 3HD2 LEU 34 45.435 56.555 59.360 270 H ASP 35 H ASP 35 45.305 58.875 55.590 271 HA ASP 35 HA ASP 35 46.735 60.985 54.630 272 HB2 ASP 35 HB2 ASP 35 44.805 60.845 56.990 273 HB3 ASP 35 HB1 ASP 35 45.455 62.365 56.380 274 H GLY 36 H GLY 36 46.895 59.755 57.950 275 HA2 GLY 36 HA2 GLY 36 49.535 61.125 58.260 276 HA3 GLY 36 HA1 GLY 36 48.315 61.175 59.570 277 H GLY 37 H GLY 37 48.035 58.185 58.100 278 HA2 GLY 37 HA2 GLY 37 49.405 56.915 60.400 279 HA3 GLY 37 HA1 GLY 37 48.395 56.095 59.170 280 H ILE 38 H ILE 38 50.005 54.495 59.040 281 HA ILE 38 HA ILE 38 52.715 55.175 58.230 282 HB ILE 38 HB ILE 38 52.305 53.125 59.470 283 HG12 ILE 38 2HG1 ILE 38 52.955 52.075 56.720 284 HG13 ILE 38 1HG1 ILE 38 54.005 53.365 57.360 285 HG21 ILE 38 1HG2 ILE 38 51.125 51.255 58.330 286 HG22 ILE 38 2HG2 ILE 38 50.065 52.615 58.770 287 HG23 ILE 38 3HG2 ILE 38 50.595 52.295 57.080 288 HD11 ILE 38 HD1 ILE 38 54.675 51.125 57.720 289 HD12 ILE 38 HD2 ILE 38 54.585 52.045 59.260 290 HD13 ILE 38 HD3 ILE 38 53.365 51.035 59.000 291 H ASP 39 H ASP 39 53.665 54.975 56.250 292 HA ASP 39 HA ASP 39 51.885 54.675 53.920 293 HB2 ASP 39 HB2 ASP 39 54.395 56.275 53.720 294 HB3 ASP 39 HB1 ASP 39 52.855 56.465 52.890 295 H GLY 40 H GLY 40 52.585 53.545 52.200 296 HA2 GLY 40 HA2 GLY 40 55.275 52.265 52.300 297 HA3 GLY 40 HA1 GLY 40 53.805 51.295 52.160 298 H LEU 41 H LEU 41 55.655 50.965 50.270 299 HA LEU 41 HA LEU 41 54.275 51.835 47.890 300 HB2 LEU 41 HB2 LEU 41 56.155 52.865 46.810 301 HB3 LEU 41 HB1 LEU 41 55.725 53.755 48.270 302 HG LEU 41 HG LEU 41 57.965 51.715 48.460 303 HD11 LEU 41 1HD1 LEU 41 59.585 53.345 47.770 304 HD12 LEU 41 2HD1 LEU 41 58.485 52.955 46.440 305 HD13 LEU 41 3HD1 LEU 41 58.315 54.485 47.340 306 HD21 LEU 41 1HD2 LEU 41 58.805 53.275 50.120 307 HD22 LEU 41 2HD2 LEU 41 57.465 54.405 49.780 308 HD23 LEU 41 3HD2 LEU 41 57.155 52.825 50.520 309 H VAL 42 H VAL 42 54.495 50.485 46.200 310 HA VAL 42 HA VAL 42 56.765 48.605 46.100 311 HB VAL 42 HB VAL 42 55.075 46.655 45.920 312 HG11 VAL 42 1HG1 VAL 42 55.175 46.135 48.300 313 HG12 VAL 42 2HG1 VAL 42 56.715 46.825 47.720 314 HG13 VAL 42 3HG1 VAL 42 55.565 47.785 48.690 315 HG21 VAL 42 1HG2 VAL 42 53.025 46.875 47.320 316 HG22 VAL 42 2HG2 VAL 42 53.375 48.595 47.600 317 HG23 VAL 42 3HG2 VAL 42 52.985 48.045 45.990 318 H HIS 43 H HIS 43 57.375 48.625 44.090 319 HA HIS 43 HA HIS 43 55.485 49.315 41.930 320 HB2 HIS 43 HB2 HIS 43 58.425 48.495 41.800 321 HB3 HIS 43 HB1 HIS 43 57.455 49.225 40.520 322 HD2 HIS 43 HD2 HIS 43 58.455 50.325 44.190 323 HE1 HIS 43 HE1 HIS 43 58.615 53.705 41.600 324 HE2 HIS 43 HE2 HIS 43 58.975 52.885 44.000 325 H LEU 44 H LEU 44 57.195 46.465 43.130 326 HA LEU 44 HA LEU 44 56.505 44.775 40.880 327 HB2 LEU 44 HB2 LEU 44 57.005 43.735 43.680 328 HB3 LEU 44 HB1 LEU 44 57.405 42.995 42.120 329 HG LEU 44 HG LEU 44 58.805 45.375 43.430 330 HD11 LEU 44 1HD1 LEU 44 60.715 43.835 43.570 331 HD12 LEU 44 2HD1 LEU 44 59.305 43.205 44.460 332 HD13 LEU 44 3HD1 LEU 44 59.725 42.525 42.860 333 HD21 LEU 44 1HD2 LEU 44 60.405 45.245 41.550 334 HD22 LEU 44 2HD2 LEU 44 59.395 43.995 40.770 335 HD23 LEU 44 3HD2 LEU 44 58.785 45.655 40.960 336 H SER 45 H SER 45 54.635 46.045 43.400 337 HA SER 45 HA SER 45 52.705 43.805 43.500 338 HB2 SER 45 HB2 SER 45 53.375 45.245 45.500 339 HB3 SER 45 HB1 SER 45 52.415 46.535 44.720 340 HG SER 45 HG SER 45 51.075 45.455 46.120 341 H ASP 46 H ASP 46 53.395 45.705 41.040 342 HA ASP 46 HA ASP 46 50.765 46.885 40.540 343 HB2 ASP 46 HB2 ASP 46 53.415 46.715 39.050 344 HB3 ASP 46 HB1 ASP 46 51.945 47.285 38.260 345 H ILE 47 H ILE 47 51.975 43.815 40.400 346 HA ILE 47 HA ILE 47 50.435 43.025 37.980 347 HB ILE 47 HB ILE 47 51.915 41.025 39.680 348 HG12 ILE 47 2HG1 ILE 47 53.555 42.805 39.570 349 HG13 ILE 47 1HG1 ILE 47 54.045 41.485 38.530 350 HG21 ILE 47 1HG2 ILE 47 52.385 40.025 37.460 351 HG22 ILE 47 2HG2 ILE 47 50.645 40.275 37.700 352 HG23 ILE 47 3HG2 ILE 47 51.535 41.385 36.670 353 HD11 ILE 47 HD1 ILE 47 54.435 43.695 37.480 354 HD12 ILE 47 HD2 ILE 47 53.255 42.765 36.540 355 HD13 ILE 47 HD3 ILE 47 52.725 44.085 37.570 356 H SER 48 H SER 48 50.055 43.195 41.330 357 HA SER 48 HA SER 48 48.415 42.495 42.760 358 HB2 SER 48 HB2 SER 48 46.575 43.155 41.680 359 HB3 SER 48 HB1 SER 48 47.085 42.515 40.140 360 HG SER 48 HG SER 48 45.405 41.365 40.600 361 H TRP 49 H TRP 49 47.005 40.495 43.330 362 HA TRP 49 HA TRP 49 48.785 38.185 43.470 363 HB2 TRP 49 HB2 TRP 49 46.075 38.955 44.540 364 HB3 TRP 49 HB1 TRP 49 46.405 37.235 44.370 365 HD1 TRP 49 HD1 TRP 49 47.645 36.135 46.280 366 HE1 TRP 49 HE1 TRP 49 48.955 36.925 48.330 367 HE3 TRP 49 HE3 TRP 49 47.735 41.145 45.280 368 HZ2 TRP 49 HZ2 TRP 49 49.975 39.415 49.380 369 HZ3 TRP 49 HZ3 TRP 49 48.895 42.705 46.800 370 HH2 TRP 49 HH2 TRP 49 50.015 41.865 48.850 371 H ASN 50 H ASN 50 45.795 38.985 41.730 372 HA ASN 50 HA ASN 50 46.415 37.015 39.670 373 HB2 ASN 50 HB2 ASN 50 43.955 36.025 40.050 374 HB3 ASN 50 HB1 ASN 50 45.375 35.335 40.840 375 HD21 ASN 50 1HD2 ASN 50 45.175 34.995 42.980 376 HD22 ASN 50 2HD2 ASN 50 44.075 35.865 44.050 377 H VAL 51 H VAL 51 43.775 38.985 41.040 378 HA VAL 51 HA VAL 51 42.435 39.485 38.610 379 HB VAL 51 HB VAL 51 41.525 41.555 39.740 380 HG11 VAL 51 1HG1 VAL 51 40.335 40.315 41.500 381 HG12 VAL 51 2HG1 VAL 51 40.465 39.365 40.000 382 HG13 VAL 51 3HG1 VAL 51 41.505 38.985 41.390 383 HG21 VAL 51 1HG2 VAL 51 42.115 41.945 42.120 384 HG22 VAL 51 2HG2 VAL 51 43.365 40.695 42.040 385 HG23 VAL 51 3HG2 VAL 51 43.515 42.175 41.060 386 H ALA 52 H ALA 52 42.255 41.595 37.420 387 HA ALA 52 HA ALA 52 44.995 42.675 36.950 388 HB1 ALA 52 HB1 ALA 52 44.085 43.405 34.800 389 HB2 ALA 52 HB2 ALA 52 43.935 41.645 35.030 390 HB3 ALA 52 HB3 ALA 52 42.515 42.665 35.240 391 H GLY 53 H GLY 53 45.515 44.605 37.640 392 HA2 GLY 53 HA2 GLY 53 43.605 46.305 39.000 393 HA3 GLY 53 HA1 GLY 53 45.305 46.715 38.610 394 H GLU 54 H GLU 54 44.315 45.865 35.650 395 HA GLU 54 HA GLU 54 43.955 48.535 34.730 396 HB2 GLU 54 HB2 GLU 54 43.655 45.755 33.560 397 HB3 GLU 54 HB1 GLU 54 43.035 47.135 32.650 398 HG2 GLU 54 HG2 GLU 54 45.055 47.615 31.890 399 HG3 GLU 54 HG1 GLU 54 45.655 47.895 33.520 400 H GLU 55 H GLU 55 41.665 46.225 35.960 401 HA GLU 55 HA GLU 55 39.365 47.725 34.900 402 HB2 GLU 55 HB2 GLU 55 39.695 45.165 36.520 403 HB3 GLU 55 HB1 GLU 55 38.125 45.925 36.270 404 HG2 GLU 55 HG2 GLU 55 38.405 44.215 34.620 405 HG3 GLU 55 HG1 GLU 55 38.385 45.795 33.840 406 H ALA 56 H ALA 56 40.715 46.815 38.110 407 HA ALA 56 HA ALA 56 38.795 48.365 39.590 408 HB1 ALA 56 HB1 ALA 56 40.375 48.055 41.480 409 HB2 ALA 56 HB2 ALA 56 40.115 46.525 40.600 410 HB3 ALA 56 HB3 ALA 56 41.615 47.455 40.360 411 H VAL 57 H VAL 57 41.955 49.145 38.200 412 HA VAL 57 HA VAL 57 41.985 51.815 39.410 413 HB VAL 57 HB VAL 57 43.785 50.655 37.230 414 HG11 VAL 57 1HG1 VAL 57 45.375 52.405 37.910 415 HG12 VAL 57 2HG1 VAL 57 43.925 53.085 37.240 416 HG13 VAL 57 3HG1 VAL 57 44.135 53.095 39.010 417 HG21 VAL 57 1HG2 VAL 57 45.395 50.265 39.090 418 HG22 VAL 57 2HG2 VAL 57 44.205 50.855 40.270 419 HG23 VAL 57 3HG2 VAL 57 43.935 49.355 39.410 420 H ARG 58 H ARG 58 40.605 50.345 36.590 421 HA ARG 58 HA ARG 58 40.795 52.305 34.650 422 HB2 ARG 58 HB2 ARG 58 39.555 50.045 34.600 423 HB3 ARG 58 HB1 ARG 58 38.205 50.845 35.370 424 HG2 ARG 58 HG2 ARG 58 39.275 52.215 32.940 425 HG3 ARG 58 HG1 ARG 58 38.625 50.595 32.640 426 HD2 ARG 58 HD2 ARG 58 37.135 52.755 34.150 427 HD3 ARG 58 HD1 ARG 58 36.975 52.495 32.410 428 HE ARG 58 HE ARG 58 36.535 50.035 33.800 429 HH11 ARG 58 1HH1 ARG 58 35.015 53.165 33.350 430 HH12 ARG 58 2HH1 ARG 58 33.415 52.585 33.560 431 HH21 ARG 58 1HH2 ARG 58 34.415 49.265 34.060 432 HH22 ARG 58 2HH2 ARG 58 33.065 50.355 33.940 433 H GLU 59 H GLU 59 38.645 52.235 37.460 434 HA GLU 59 HA GLU 59 37.845 55.065 36.860 435 HB2 GLU 59 HB2 GLU 59 36.265 52.955 38.400 436 HB3 GLU 59 HB1 GLU 59 35.815 54.655 38.170 437 HG2 GLU 59 HG2 GLU 59 36.175 53.975 35.590 438 HG3 GLU 59 HG1 GLU 59 35.765 52.375 36.230 439 H TYR 60 H TYR 60 38.985 52.755 39.310 440 HA TYR 60 HA TYR 60 39.635 53.015 41.440 441 HB2 TYR 60 HB2 TYR 60 41.315 54.695 41.780 442 HB3 TYR 60 HB1 TYR 60 41.525 53.955 40.210 443 HD1 TYR 60 HD1 TYR 60 40.415 57.065 41.970 444 HD2 TYR 60 HD2 TYR 60 41.345 55.285 38.200 445 HE1 TYR 60 HE1 TYR 60 40.275 59.285 40.900 446 HE2 TYR 60 HE2 TYR 60 41.235 57.465 37.100 447 HH TYR 60 HH TYR 60 40.895 59.655 37.390 448 H LYS 61 H LYS 61 40.015 55.045 43.190 449 HA LYS 61 HA LYS 61 37.745 56.865 43.170 450 HB2 LYS 61 HB2 LYS 61 37.655 54.325 44.660 451 HB3 LYS 61 HB1 LYS 61 37.425 55.715 45.710 452 HG2 LYS 61 HG2 LYS 61 35.625 56.465 44.050 453 HG3 LYS 61 HG1 LYS 61 35.785 54.865 43.300 454 HD2 LYS 61 HD2 LYS 61 35.475 54.885 46.270 455 HD3 LYS 61 HD1 LYS 61 34.075 55.385 45.320 456 HE2 LYS 61 HE2 LYS 61 33.605 53.285 44.720 457 HE3 LYS 61 HE1 LYS 61 35.245 53.035 44.090 458 HZ1 LYS 61 HZ1 LYS 61 34.765 51.495 45.870 459 HZ2 LYS 61 HZ2 LYS 61 35.995 52.475 46.310 460 HZ3 LYS 61 HZ3 LYS 61 34.485 52.725 46.940 461 H LYS 62 H LYS 62 37.635 58.035 45.390 462 HA LYS 62 HA LYS 62 40.195 59.345 45.710 463 HB2 LYS 62 HB2 LYS 62 37.435 59.585 46.870 464 HB3 LYS 62 HB1 LYS 62 38.735 60.045 47.960 465 HG2 LYS 62 HG2 LYS 62 39.665 61.535 46.100 466 HG3 LYS 62 HG1 LYS 62 38.135 61.225 45.240 467 HD2 LYS 62 HD2 LYS 62 37.005 61.965 47.490 468 HD3 LYS 62 HD1 LYS 62 38.615 62.605 47.920 469 HE2 LYS 62 HE2 LYS 62 38.595 63.965 45.820 470 HE3 LYS 62 HE1 LYS 62 36.995 63.325 45.430 471 HZ1 LYS 62 HZ1 LYS 62 36.845 65.485 46.500 472 HZ2 LYS 62 HZ2 LYS 62 36.165 64.335 47.470 473 HZ3 LYS 62 HZ3 LYS 62 37.645 64.935 47.830 474 H GLY 63 H GLY 63 41.875 58.395 46.570 475 HA2 GLY 63 HA2 GLY 63 43.225 57.485 48.260 476 HA3 GLY 63 HA1 GLY 63 41.815 57.495 49.350 477 H ASP 64 H ASP 64 41.045 55.925 46.380 478 HA ASP 64 HA ASP 64 40.925 53.375 47.810 479 HB2 ASP 64 HB2 ASP 64 39.765 54.595 45.450 480 HB3 ASP 64 HB1 ASP 64 40.375 53.025 45.030 481 H GLU 65 H GLU 65 41.985 51.495 47.170 482 HA GLU 65 HA GLU 65 43.825 51.195 45.070 483 HB2 GLU 65 HB2 GLU 65 45.255 52.875 46.110 484 HB3 GLU 65 HB1 GLU 65 44.985 52.155 47.680 485 HG2 GLU 65 HG2 GLU 65 47.255 51.745 46.730 486 HG3 GLU 65 HG1 GLU 65 46.395 50.275 47.110 487 H ILE 66 H ILE 66 44.265 50.395 48.540 488 HA ILE 66 HA ILE 66 43.325 47.655 48.090 489 HB ILE 66 HB ILE 66 45.425 46.595 48.860 490 HG12 ILE 66 2HG1 ILE 66 47.415 48.415 48.430 491 HG13 ILE 66 1HG1 ILE 66 46.255 49.415 49.300 492 HG21 ILE 66 1HG2 ILE 66 46.785 46.885 46.850 493 HG22 ILE 66 2HG2 ILE 66 45.045 46.765 46.460 494 HG23 ILE 66 3HG2 ILE 66 45.855 48.305 46.440 495 HD11 ILE 66 HD1 ILE 66 47.805 48.435 50.870 496 HD12 ILE 66 HD2 ILE 66 46.205 47.755 51.150 497 HD13 ILE 66 HD3 ILE 66 47.435 46.805 50.280 498 H ALA 67 H ALA 67 43.835 46.335 50.230 499 HA ALA 67 HA ALA 67 43.725 48.075 52.610 500 HB1 ALA 67 HB1 ALA 67 41.675 46.965 53.420 501 HB2 ALA 67 HB2 ALA 67 41.375 47.855 51.910 502 HB3 ALA 67 HB3 ALA 67 41.535 46.085 51.870 503 H ALA 68 H ALA 68 45.005 47.295 54.100 504 HA ALA 68 HA ALA 68 45.055 44.505 54.770 505 HB1 ALA 68 HB1 ALA 68 47.445 44.075 54.210 506 HB2 ALA 68 HB2 ALA 68 46.485 44.395 52.760 507 HB3 ALA 68 HB3 ALA 68 47.535 45.655 53.410 508 H VAL 69 H VAL 69 47.015 44.135 56.280 509 HA VAL 69 HA VAL 69 47.075 46.395 58.210 510 HB VAL 69 HB VAL 69 47.725 44.605 59.910 511 HG11 VAL 69 1HG1 VAL 69 45.405 43.765 60.200 512 HG12 VAL 69 2HG1 VAL 69 45.465 45.455 59.830 513 HG13 VAL 69 3HG1 VAL 69 45.005 44.335 58.540 514 HG21 VAL 69 1HG2 VAL 69 47.175 42.285 59.410 515 HG22 VAL 69 2HG2 VAL 69 46.795 42.705 57.710 516 HG23 VAL 69 3HG2 VAL 69 48.405 42.905 58.300 517 H VAL 70 H VAL 70 48.905 47.125 59.110 518 HA VAL 70 HA VAL 70 51.385 46.345 57.650 519 HB VAL 70 HB VAL 70 50.925 48.685 57.620 520 HG11 VAL 70 1HG1 VAL 70 50.815 50.015 59.800 521 HG12 VAL 70 2HG1 VAL 70 49.465 48.915 59.610 522 HG13 VAL 70 3HG1 VAL 70 50.845 48.595 60.700 523 HG21 VAL 70 1HG2 VAL 70 52.925 49.355 58.470 524 HG22 VAL 70 2HG2 VAL 70 53.195 48.055 59.590 525 HG23 VAL 70 3HG2 VAL 70 53.275 47.865 57.780 526 H LEU 71 H LEU 71 52.905 45.155 58.560 527 HA LEU 71 HA LEU 71 52.925 44.905 61.570 528 HB2 LEU 71 HB2 LEU 71 54.175 42.655 60.300 529 HB3 LEU 71 HB1 LEU 71 52.825 42.695 61.420 530 HG LEU 71 HG LEU 71 52.485 43.095 58.430 531 HD11 LEU 71 1HD1 LEU 71 51.955 40.725 58.340 532 HD12 LEU 71 2HD1 LEU 71 53.575 40.955 58.830 533 HD13 LEU 71 3HD1 LEU 71 52.295 40.535 60.030 534 HD21 LEU 71 1HD2 LEU 71 50.195 42.515 59.000 535 HD22 LEU 71 2HD2 LEU 71 50.545 42.315 60.680 536 HD23 LEU 71 3HD2 LEU 71 50.585 43.895 59.890 537 H GLN 72 H GLN 72 54.895 44.845 58.590 538 HA GLN 72 HA GLN 72 57.125 45.855 60.240 539 HB2 GLN 72 HB2 GLN 72 56.995 43.235 58.950 540 HB3 GLN 72 HB1 GLN 72 58.195 44.245 58.130 541 HG2 GLN 72 HG2 GLN 72 59.545 43.375 59.660 542 HG3 GLN 72 HG1 GLN 72 59.025 44.795 60.560 543 HE21 GLN 72 1HE2 GLN 72 59.985 43.065 62.190 544 HE22 GLN 72 2HE2 GLN 72 58.735 42.055 62.940 545 H VAL 73 H VAL 73 58.575 47.225 59.160 546 HA VAL 73 HA VAL 73 58.405 47.775 56.380 547 HB VAL 73 HB VAL 73 56.365 48.905 56.880 548 HG11 VAL 73 1HG1 VAL 73 56.185 50.495 58.750 549 HG12 VAL 73 2HG1 VAL 73 56.435 48.885 59.280 550 HG13 VAL 73 3HG1 VAL 73 57.745 50.125 59.270 551 HG21 VAL 73 1HG2 VAL 73 56.785 51.215 56.340 552 HG22 VAL 73 2HG2 VAL 73 58.455 51.105 56.930 553 HG23 VAL 73 3HG2 VAL 73 57.995 50.245 55.500 554 H ASP 74 H ASP 74 59.995 49.175 55.720 555 HA ASP 74 HA ASP 74 61.725 50.355 57.840 556 HB2 ASP 74 HB2 ASP 74 62.775 48.945 55.400 557 HB3 ASP 74 HB1 ASP 74 63.695 49.545 56.770 558 H ALA 75 H ALA 75 62.395 52.365 57.460 559 HA ALA 75 HA ALA 75 61.405 53.735 55.070 560 HB1 ALA 75 HB1 ALA 75 62.365 55.675 56.110 561 HB2 ALA 75 HB2 ALA 75 61.385 54.815 57.300 562 HB3 ALA 75 HB3 ALA 75 63.175 54.705 57.370 563 H GLU 76 H GLU 76 64.465 52.405 56.100 564 HA GLU 76 HA GLU 76 65.965 53.755 53.920 565 HB2 GLU 76 HB2 GLU 76 66.705 51.805 56.140 566 HB3 GLU 76 HB1 GLU 76 67.815 52.215 54.840 567 HG2 GLU 76 HG2 GLU 76 66.585 54.595 56.140 568 HG3 GLU 76 HG1 GLU 76 67.525 53.585 57.240 569 H ARG 77 H ARG 77 64.695 50.535 54.770 570 HA ARG 77 HA ARG 77 65.885 49.375 52.340 571 HB2 ARG 77 HB2 ARG 77 65.365 48.275 54.770 572 HB3 ARG 77 HB1 ARG 77 63.845 47.935 53.960 573 HG2 ARG 77 HG2 ARG 77 65.265 46.035 53.690 574 HG3 ARG 77 HG1 ARG 77 65.125 46.805 52.100 575 HD2 ARG 77 HD2 ARG 77 67.305 47.445 52.080 576 HD3 ARG 77 HD1 ARG 77 67.365 47.755 53.840 577 HE ARG 77 HE ARG 77 67.115 45.005 53.630 578 HH11 ARG 77 1HH1 ARG 77 69.375 47.435 52.520 579 HH12 ARG 77 2HH1 ARG 77 70.755 46.385 52.560 580 HH21 ARG 77 1HH2 ARG 77 68.925 43.615 53.690 581 HH22 ARG 77 2HH2 ARG 77 70.485 44.215 53.230 582 H GLU 78 H GLU 78 62.905 50.895 53.290 583 HA GLU 78 HA GLU 78 60.975 51.315 52.250 584 HB2 GLU 78 HB2 GLU 78 62.275 50.475 49.650 585 HB3 GLU 78 HB1 GLU 78 60.965 51.625 49.920 586 HG2 GLU 78 HG2 GLU 78 63.005 52.755 51.430 587 HG3 GLU 78 HG1 GLU 78 63.915 51.965 50.140 588 H ARG 79 H ARG 79 61.645 48.535 53.160 589 HA ARG 79 HA ARG 79 59.935 46.905 51.350 590 HB2 ARG 79 HB2 ARG 79 60.855 44.965 52.420 591 HB3 ARG 79 HB1 ARG 79 62.125 45.985 51.740 592 HG2 ARG 79 HG2 ARG 79 63.155 45.905 53.680 593 HG3 ARG 79 HG1 ARG 79 61.935 46.895 54.390 594 HD2 ARG 79 HD2 ARG 79 60.865 45.075 55.420 595 HD3 ARG 79 HD1 ARG 79 61.415 43.925 54.200 596 HE ARG 79 HE ARG 79 62.775 44.715 56.610 597 HH11 ARG 79 1HH1 ARG 79 63.355 43.755 53.310 598 HH12 ARG 79 2HH1 ARG 79 64.895 42.995 53.590 599 HH21 ARG 79 1HH2 ARG 79 64.785 43.705 57.040 600 HH22 ARG 79 2HH2 ARG 79 65.715 42.965 55.760 601 H ILE 80 H ILE 80 57.865 46.965 51.900 602 HA ILE 80 HA ILE 80 57.165 46.955 54.820 603 HB ILE 80 HB ILE 80 55.325 47.715 52.510 604 HG12 ILE 80 2HG1 ILE 80 55.895 50.105 53.710 605 HG13 ILE 80 1HG1 ILE 80 57.445 49.265 53.900 606 HG21 ILE 80 1HG2 ILE 80 54.055 48.805 54.360 607 HG22 ILE 80 2HG2 ILE 80 54.205 47.055 54.620 608 HG23 ILE 80 3HG2 ILE 80 55.205 48.165 55.510 609 HD11 ILE 80 HD1 ILE 80 57.455 50.615 51.900 610 HD12 ILE 80 HD2 ILE 80 57.645 48.905 51.520 611 HD13 ILE 80 HD3 ILE 80 56.075 49.655 51.270 612 H SER 81 H SER 81 55.935 45.415 55.660 613 HA SER 81 HA SER 81 54.875 43.315 53.840 614 HB2 SER 81 HB2 SER 81 55.405 41.815 55.970 615 HB3 SER 81 HB1 SER 81 56.605 42.085 54.680 616 HG SER 81 HG SER 81 57.435 42.415 56.820 617 H LEU 82 H LEU 82 52.995 42.435 54.340 618 HA LEU 82 HA LEU 82 51.465 43.575 56.580 619 HB2 LEU 82 HB2 LEU 82 49.475 43.215 55.010 620 HB3 LEU 82 HB1 LEU 82 50.485 44.595 54.730 621 HG LEU 82 HG LEU 82 49.685 43.345 52.690 622 HD11 LEU 82 1HD1 LEU 82 51.805 43.575 51.470 623 HD12 LEU 82 2HD1 LEU 82 51.545 44.945 52.590 624 HD13 LEU 82 3HD1 LEU 82 52.715 43.675 52.940 625 HD21 LEU 82 1HD2 LEU 82 50.885 41.305 51.990 626 HD22 LEU 82 2HD2 LEU 82 51.795 41.285 53.480 627 HD23 LEU 82 3HD2 LEU 82 50.065 40.995 53.530 628 H GLY 83 H GLY 83 49.745 42.325 57.330 629 HA2 GLY 83 HA2 GLY 83 50.395 39.425 57.390 630 HA3 GLY 83 HA1 GLY 83 49.485 40.325 58.620 631 H VAL 84 H VAL 84 48.315 41.375 55.790 632 HA VAL 84 HA VAL 84 45.815 40.125 56.050 633 HB VAL 84 HB VAL 84 46.145 42.235 54.840 634 HG11 VAL 84 1HG1 VAL 84 47.015 42.265 52.500 635 HG12 VAL 84 2HG1 VAL 84 48.195 41.815 53.720 636 HG13 VAL 84 3HG1 VAL 84 47.475 40.585 52.650 637 HG21 VAL 84 1HG2 VAL 84 44.625 41.795 52.930 638 HG22 VAL 84 2HG2 VAL 84 44.935 40.055 53.080 639 HG23 VAL 84 3HG2 VAL 84 44.115 40.925 54.400 640 H LYS 85 H LYS 85 48.695 39.255 54.130 641 HA LYS 85 HA LYS 85 47.375 37.185 52.630 642 HB2 LYS 85 HB2 LYS 85 49.525 38.385 52.030 643 HB3 LYS 85 HB1 LYS 85 50.345 37.515 53.330 644 HG2 LYS 85 HG2 LYS 85 48.825 35.795 51.380 645 HG3 LYS 85 HG1 LYS 85 50.175 36.705 50.700 646 HD2 LYS 85 HD2 LYS 85 51.545 35.785 52.730 647 HD3 LYS 85 HD1 LYS 85 50.225 34.615 52.900 648 HE2 LYS 85 HE2 LYS 85 51.085 33.365 51.260 649 HE3 LYS 85 HE1 LYS 85 50.905 34.705 50.120 650 HZ1 LYS 85 HZ1 LYS 85 53.205 33.985 50.270 651 HZ2 LYS 85 HZ2 LYS 85 53.075 35.515 50.830 652 HZ3 LYS 85 HZ3 LYS 85 53.235 34.265 51.890 653 H GLN 86 H GLN 86 48.945 37.305 55.760 654 HA GLN 86 HA GLN 86 48.955 34.365 56.080 655 HB2 GLN 86 HB2 GLN 86 50.835 35.565 57.020 656 HB3 GLN 86 HB1 GLN 86 49.775 36.685 57.890 657 HG2 GLN 86 HG2 GLN 86 49.165 35.115 59.490 658 HG3 GLN 86 HG1 GLN 86 49.525 33.725 58.470 659 HE21 GLN 86 1HE2 GLN 86 50.695 35.615 61.020 660 HE22 GLN 86 2HE2 GLN 86 52.345 34.995 60.970 661 H LEU 87 H LEU 87 46.835 37.065 56.690 662 HA LEU 87 HA LEU 87 45.425 35.945 58.880 663 HB2 LEU 87 HB2 LEU 87 45.435 38.375 57.570 664 HB3 LEU 87 HB1 LEU 87 44.015 37.685 56.860 665 HG LEU 87 HG LEU 87 43.645 37.155 59.600 666 HD11 LEU 87 1HD1 LEU 87 44.035 39.355 60.680 667 HD12 LEU 87 2HD1 LEU 87 45.565 38.625 60.130 668 HD13 LEU 87 3HD1 LEU 87 44.825 39.945 59.200 669 HD21 LEU 87 1HD2 LEU 87 41.925 38.915 59.440 670 HD22 LEU 87 2HD2 LEU 87 42.635 39.485 57.910 671 HD23 LEU 87 3HD2 LEU 87 41.915 37.865 58.020 672 H ALA 88 H ALA 88 44.495 36.095 55.400 673 HA ALA 88 HA ALA 88 43.675 33.415 55.240 674 HB1 ALA 88 HB1 ALA 88 41.205 33.755 55.150 675 HB2 ALA 88 HB2 ALA 88 41.825 34.115 56.760 676 HB3 ALA 88 HB3 ALA 88 41.425 35.445 55.650 677 H GLU 89 H GLU 89 42.285 33.085 53.240 678 HA GLU 89 HA GLU 89 43.565 34.295 51.010 679 HB2 GLU 89 HB2 GLU 89 41.945 32.045 51.460 680 HB3 GLU 89 HB1 GLU 89 40.905 33.065 50.480 681 HG2 GLU 89 HG2 GLU 89 42.645 33.225 48.740 682 HG3 GLU 89 HG1 GLU 89 43.765 32.295 49.740 683 H ASP 90 H ASP 90 41.785 34.945 49.140 684 HA ASP 90 HA ASP 90 40.455 37.335 50.270 685 HB2 ASP 90 HB2 ASP 90 41.575 37.055 47.480 686 HB3 ASP 90 HB1 ASP 90 40.985 38.515 48.250 687 HA PRO 91 HA PRO 91 36.645 35.895 48.610 688 HB2 PRO 91 HB1 PRO 91 35.375 38.285 47.990 689 HB3 PRO 91 HB2 PRO 91 35.635 37.705 49.670 690 HG2 PRO 91 HG1 PRO 91 37.275 39.695 48.080 691 HG3 PRO 91 HG2 PRO 91 36.705 39.815 49.780 692 HD2 PRO 91 HD1 PRO 91 39.205 39.045 49.120 693 HD3 PRO 91 HD2 PRO 91 38.375 38.355 50.530 694 H PHE 92 H PHE 92 38.945 37.505 46.690 695 HA PHE 92 HA PHE 92 39.365 37.585 44.490 696 HB2 PHE 92 HB2 PHE 92 38.095 35.125 44.900 697 HB3 PHE 92 HB1 PHE 92 37.155 35.825 43.590 698 HD1 PHE 92 HD1 PHE 92 40.315 34.345 44.630 699 HD2 PHE 92 HD2 PHE 92 38.325 36.455 41.430 700 HE1 PHE 92 HE1 PHE 92 42.085 33.635 43.050 701 HE2 PHE 92 HE2 PHE 92 40.105 35.775 39.870 702 HZ PHE 92 HZ PHE 92 41.995 34.355 40.660 703 H ASN 93 H ASN 93 38.425 38.225 42.320 704 HA ASN 93 HA ASN 93 35.745 39.305 42.300 705 HB2 ASN 93 HB2 ASN 93 37.865 41.005 43.280 706 HB3 ASN 93 HB1 ASN 93 37.455 41.555 41.670 707 HD21 ASN 93 1HD2 ASN 93 36.265 43.345 42.010 708 HD22 ASN 93 2HD2 ASN 93 34.845 43.415 43.060 709 H ASN 94 H ASN 94 35.185 40.255 40.240 710 HA ASN 94 HA ASN 94 36.605 38.915 38.010 711 HB2 ASN 94 HB2 ASN 94 34.595 39.725 36.710 712 HB3 ASN 94 HB1 ASN 94 34.235 38.595 38.010 713 HD21 ASN 94 1HD2 ASN 94 32.115 39.255 38.220 714 HD22 ASN 94 2HD2 ASN 94 31.715 40.845 38.910 Start of MODEL 5 1 H LYS 1 H1 LYS 1 62.322 70.861 50.200 2 HA LYS 1 HA LYS 1 59.962 71.291 50.080 3 HB2 LYS 1 HB2 LYS 1 59.912 68.261 49.850 4 HB3 LYS 1 HB1 LYS 1 58.552 69.131 50.540 5 HG2 LYS 1 HG2 LYS 1 59.402 70.401 48.040 6 HG3 LYS 1 HG1 LYS 1 59.092 68.661 47.800 7 HD2 LYS 1 HD2 LYS 1 56.842 68.821 48.500 8 HD3 LYS 1 HD1 LYS 1 57.092 70.371 49.310 9 HE2 LYS 1 HE2 LYS 1 55.852 70.721 47.260 10 HE3 LYS 1 HE1 LYS 1 57.432 71.511 47.190 11 HZ1 LYS 1 HZ1 LYS 1 56.942 70.331 45.140 12 HZ2 LYS 1 HZ2 LYS 1 58.242 69.631 45.860 13 HZ3 LYS 1 HZ3 LYS 1 56.772 68.901 45.940 14 H ALA 2 H ALA 2 61.192 68.431 51.960 15 HA ALA 2 HA ALA 2 61.542 69.911 54.320 16 HB1 ALA 2 HB1 ALA 2 59.622 69.001 55.620 17 HB2 ALA 2 HB2 ALA 2 59.062 70.071 54.340 18 HB3 ALA 2 HB3 ALA 2 58.942 68.311 54.130 19 H ASN 3 H ASN 3 62.162 68.561 56.090 20 HA ASN 3 HA ASN 3 62.922 65.801 55.240 21 HB2 ASN 3 HB2 ASN 3 64.552 67.361 57.220 22 HB3 ASN 3 HB1 ASN 3 64.992 65.991 56.200 23 HD21 ASN 3 1HD2 ASN 3 64.322 69.451 56.330 24 HD22 ASN 3 2HD2 ASN 3 65.172 69.851 54.840 25 HA PRO 4 HA PRO 4 60.242 65.631 59.030 26 HB2 PRO 4 HB1 PRO 4 58.512 63.731 58.090 27 HB3 PRO 4 HB2 PRO 4 58.282 65.461 57.790 28 HG2 PRO 4 HG1 PRO 4 59.502 63.341 56.000 29 HG3 PRO 4 HG2 PRO 4 58.322 64.621 55.570 30 HD2 PRO 4 HD1 PRO 4 60.982 64.851 55.090 31 HD3 PRO 4 HD2 PRO 4 59.962 66.251 55.550 32 H TRP 5 H TRP 5 62.182 64.761 59.980 33 HA TRP 5 HA TRP 5 62.822 61.951 59.560 34 HB2 TRP 5 HB2 TRP 5 63.892 64.271 61.070 35 HB3 TRP 5 HB1 TRP 5 63.962 62.761 61.980 36 HD1 TRP 5 HD1 TRP 5 64.882 63.771 58.340 37 HE1 TRP 5 HE1 TRP 5 67.112 62.631 57.750 38 HE3 TRP 5 HE3 TRP 5 65.672 61.251 62.710 39 HZ2 TRP 5 HZ2 TRP 5 68.992 60.901 59.010 40 HZ3 TRP 5 HZ3 TRP 5 67.702 59.861 62.990 41 HH2 TRP 5 HH2 TRP 5 69.362 59.681 61.150 42 H GLN 6 H GLN 6 60.682 63.701 61.660 43 HA GLN 6 HA GLN 6 60.422 61.611 63.670 44 HB2 GLN 6 HB2 GLN 6 58.512 63.881 62.940 45 HB3 GLN 6 HB1 GLN 6 58.472 62.911 64.420 46 HG2 GLN 6 HG2 GLN 6 61.032 64.421 63.800 47 HG3 GLN 6 HG1 GLN 6 59.612 65.321 64.290 48 HE21 GLN 6 1HE2 GLN 6 60.112 65.921 66.350 49 HE22 GLN 6 2HE2 GLN 6 60.542 64.751 67.610 50 H GLN 7 H GLN 7 59.032 62.221 60.500 51 HA GLN 7 HA GLN 7 56.712 60.511 60.880 52 HB2 GLN 7 HB2 GLN 7 58.122 61.721 58.490 53 HB3 GLN 7 HB1 GLN 7 56.832 60.561 58.290 54 HG2 GLN 7 HG2 GLN 7 56.102 62.711 60.200 55 HG3 GLN 7 HG1 GLN 7 56.492 63.321 58.590 56 HE21 GLN 7 1HE2 GLN 7 55.542 61.531 56.810 57 HE22 GLN 7 2HE2 GLN 7 53.832 61.321 57.070 58 H PHE 8 H PHE 8 60.092 60.011 60.070 59 HA PHE 8 HA PHE 8 59.852 57.541 58.700 60 HB2 PHE 8 HB2 PHE 8 62.002 58.881 60.350 61 HB3 PHE 8 HB1 PHE 8 62.202 57.211 59.910 62 HD1 PHE 8 HD1 PHE 8 60.782 60.111 57.960 63 HD2 PHE 8 HD2 PHE 8 63.822 57.071 58.270 64 HE1 PHE 8 HE1 PHE 8 61.642 60.761 55.760 65 HE2 PHE 8 HE2 PHE 8 64.672 57.711 56.030 66 HZ PHE 8 HZ PHE 8 63.592 59.551 54.770 67 H ALA 9 H ALA 9 59.412 58.341 62.060 68 HA ALA 9 HA ALA 9 59.722 55.561 62.960 69 HB1 ALA 9 HB1 ALA 9 59.042 56.491 65.140 70 HB2 ALA 9 HB2 ALA 9 60.382 57.441 64.440 71 HB3 ALA 9 HB3 ALA 9 58.702 58.061 64.390 72 H GLU 10 H GLU 10 57.172 57.671 61.810 73 HA GLU 10 HA GLU 10 54.982 56.241 62.980 74 HB2 GLU 10 HB2 GLU 10 54.962 57.881 60.410 75 HB3 GLU 10 HB1 GLU 10 53.602 57.511 61.460 76 HG2 GLU 10 HG2 GLU 10 56.002 59.211 62.240 77 HG3 GLU 10 HG1 GLU 10 54.452 59.841 61.710 78 H THR 11 H THR 11 57.062 55.731 60.240 79 HA THR 11 HA THR 11 55.262 53.731 59.220 80 HB THR 11 HB THR 11 56.172 55.331 57.570 81 HG1 THR 11 HG1 THR 11 56.782 53.751 56.070 82 HG21 THR 11 1HG2 THR 11 58.562 55.081 56.910 83 HG22 THR 11 2HG2 THR 11 58.382 55.591 58.600 84 HG23 THR 11 3HG2 THR 11 58.812 53.901 58.230 85 H HIS 12 H HIS 12 57.342 53.721 61.590 86 HA HIS 12 HA HIS 12 58.802 51.251 60.820 87 HB2 HIS 12 HB2 HIS 12 59.992 53.261 61.830 88 HB3 HIS 12 HB1 HIS 12 59.152 52.881 63.350 89 HD2 HIS 12 HD2 HIS 12 61.312 52.021 64.710 90 HE1 HIS 12 HE1 HIS 12 62.452 48.881 62.060 91 HE2 HIS 12 HE2 HIS 12 62.902 49.951 64.340 92 H ASN 13 H ASN 13 55.942 51.281 61.340 93 HA ASN 13 HA ASN 13 55.762 49.801 63.900 94 HB2 ASN 13 HB2 ASN 13 54.032 51.611 62.610 95 HB3 ASN 13 HB1 ASN 13 53.262 50.011 62.530 96 HD21 ASN 13 1HD2 ASN 13 52.272 52.251 63.950 97 HD22 ASN 13 2HD2 ASN 13 52.262 51.821 65.640 98 H LYS 14 H LYS 14 53.842 48.061 63.650 99 HA LYS 14 HA LYS 14 53.792 46.471 61.330 100 HB2 LYS 14 HB2 LYS 14 55.202 44.541 62.030 101 HB3 LYS 14 HB1 LYS 14 56.122 45.961 61.650 102 HG2 LYS 14 HG2 LYS 14 55.582 46.191 64.450 103 HG3 LYS 14 HG1 LYS 14 55.952 44.491 64.170 104 HD2 LYS 14 HD2 LYS 14 58.112 44.961 63.460 105 HD3 LYS 14 HD1 LYS 14 57.742 46.621 62.950 106 HE2 LYS 14 HE2 LYS 14 57.592 45.781 65.860 107 HE3 LYS 14 HE1 LYS 14 59.112 46.321 65.100 108 HZ1 LYS 14 HZ1 LYS 14 57.952 48.171 66.140 109 HZ2 LYS 14 HZ2 LYS 14 58.012 48.421 64.520 110 HZ3 LYS 14 HZ3 LYS 14 56.622 47.921 65.220 111 H GLY 15 H GLY 15 51.852 45.621 61.560 112 HA2 GLY 15 HA2 GLY 15 50.562 43.791 62.600 113 HA3 GLY 15 HA1 GLY 15 51.092 44.401 64.190 114 H ASP 16 H ASP 16 50.452 47.011 62.190 115 HA ASP 16 HA ASP 16 47.802 47.381 63.460 116 HB2 ASP 16 HB2 ASP 16 49.522 49.441 62.030 117 HB3 ASP 16 HB1 ASP 16 48.132 49.711 63.080 118 H ARG 17 H ARG 17 46.672 49.221 61.840 119 HA ARG 17 HA ARG 17 46.452 47.971 59.160 120 HB2 ARG 17 HB2 ARG 17 44.042 48.041 59.240 121 HB3 ARG 17 HB1 ARG 17 44.682 47.001 60.510 122 HG2 ARG 17 HG2 ARG 17 43.502 48.101 62.040 123 HG3 ARG 17 HG1 ARG 17 44.452 49.551 61.770 124 HD2 ARG 17 HD2 ARG 17 42.932 50.451 60.190 125 HD3 ARG 17 HD1 ARG 17 42.172 48.871 59.920 126 HE ARG 17 HE ARG 17 41.912 49.841 62.650 127 HH11 ARG 17 1HH1 ARG 17 40.522 49.861 59.420 128 HH12 ARG 17 2HH1 ARG 17 38.922 50.231 59.940 129 HH21 ARG 17 1HH2 ARG 17 39.802 50.321 63.340 130 HH22 ARG 17 2HH2 ARG 17 38.512 50.491 62.180 131 H VAL 18 H VAL 18 46.472 49.351 57.580 132 HA VAL 18 HA VAL 18 45.852 52.231 58.150 133 HB VAL 18 HB VAL 18 47.552 52.761 56.340 134 HG11 VAL 18 1HG1 VAL 18 49.442 52.631 57.860 135 HG12 VAL 18 2HG1 VAL 18 47.992 53.171 58.700 136 HG13 VAL 18 3HG1 VAL 18 48.582 51.501 58.900 137 HG21 VAL 18 1HG2 VAL 18 49.302 51.081 55.940 138 HG22 VAL 18 2HG2 VAL 18 48.442 49.871 56.890 139 HG23 VAL 18 3HG2 VAL 18 47.692 50.481 55.410 140 H GLU 19 H GLU 19 45.732 53.391 55.840 141 HA GLU 19 HA GLU 19 43.942 51.771 54.170 142 HB2 GLU 19 HB2 GLU 19 43.352 54.211 55.650 143 HB3 GLU 19 HB1 GLU 19 43.162 54.481 53.930 144 HG2 GLU 19 HG2 GLU 19 41.902 51.951 54.680 145 HG3 GLU 19 HG1 GLU 19 41.402 53.191 55.800 146 H GLY 20 H GLY 20 43.952 52.171 51.990 147 HA2 GLY 20 HA2 GLY 20 46.372 53.651 51.020 148 HA3 GLY 20 HA1 GLY 20 45.672 52.261 50.200 149 H LYS 21 H LYS 21 46.172 54.381 48.750 150 HA LYS 21 HA LYS 21 43.452 55.491 48.200 151 HB2 LYS 21 HB2 LYS 21 44.442 57.681 47.670 152 HB3 LYS 21 HB1 LYS 21 44.572 57.231 49.370 153 HG2 LYS 21 HG2 LYS 21 46.972 56.421 48.780 154 HG3 LYS 21 HG1 LYS 21 46.782 57.231 47.260 155 HD2 LYS 21 HD2 LYS 21 47.942 58.701 48.770 156 HD3 LYS 21 HD1 LYS 21 46.312 59.361 48.580 157 HE2 LYS 21 HE2 LYS 21 46.642 57.441 50.800 158 HE3 LYS 21 HE1 LYS 21 47.512 58.981 50.970 159 HZ1 LYS 21 HZ1 LYS 21 45.272 59.081 51.900 160 HZ2 LYS 21 HZ2 LYS 21 45.382 60.121 50.630 161 HZ3 LYS 21 HZ3 LYS 21 44.592 58.691 50.470 162 H ILE 22 H ILE 22 42.862 55.681 46.140 163 HA ILE 22 HA ILE 22 44.682 54.421 44.150 164 HB ILE 22 HB ILE 22 41.882 55.521 43.780 165 HG12 ILE 22 2HG1 ILE 22 41.772 53.791 45.470 166 HG13 ILE 22 1HG1 ILE 22 41.162 53.191 43.930 167 HG21 ILE 22 1HG2 ILE 22 41.902 53.881 41.850 168 HG22 ILE 22 2HG2 ILE 22 43.022 55.161 41.610 169 HG23 ILE 22 3HG2 ILE 22 43.572 53.561 42.130 170 HD11 ILE 22 HD1 ILE 22 42.532 51.551 45.170 171 HD12 ILE 22 HD2 ILE 22 43.282 51.971 43.600 172 HD13 ILE 22 HD3 ILE 22 43.912 52.631 45.120 173 H LYS 23 H LYS 23 44.152 57.551 45.240 174 HA LYS 23 HA LYS 23 44.222 59.071 42.870 175 HB2 LYS 23 HB2 LYS 23 45.332 60.801 44.210 176 HB3 LYS 23 HB1 LYS 23 43.982 60.081 45.090 177 HG2 LYS 23 HG2 LYS 23 45.262 59.501 46.760 178 HG3 LYS 23 HG1 LYS 23 46.372 58.601 45.750 179 HD2 LYS 23 HD2 LYS 23 46.652 61.591 45.760 180 HD3 LYS 23 HD1 LYS 23 47.152 60.711 47.200 181 HE2 LYS 23 HE2 LYS 23 48.392 59.131 45.460 182 HE3 LYS 23 HE1 LYS 23 48.252 60.531 44.400 183 HZ1 LYS 23 HZ1 LYS 23 50.322 60.541 45.660 184 HZ2 LYS 23 HZ2 LYS 23 49.392 61.831 46.120 185 HZ3 LYS 23 HZ3 LYS 23 49.512 60.501 47.090 186 H SER 24 H SER 24 46.662 57.001 44.120 187 HA SER 24 HA SER 24 48.832 58.241 42.520 188 HB2 SER 24 HB2 SER 24 48.892 57.041 45.020 189 HB3 SER 24 HB1 SER 24 49.362 55.691 43.970 190 HG SER 24 HG SER 24 51.192 56.861 44.530 191 H ILE 25 H ILE 25 50.252 55.951 41.900 192 HA ILE 25 HA ILE 25 48.612 54.951 39.630 193 HB ILE 25 HB ILE 25 50.822 54.131 38.770 194 HG12 ILE 25 2HG1 ILE 25 51.782 54.281 41.290 195 HG13 ILE 25 1HG1 ILE 25 52.792 54.341 39.860 196 HG21 ILE 25 1HG2 ILE 25 51.632 56.351 38.110 197 HG22 ILE 25 2HG2 ILE 25 49.852 56.261 38.010 198 HG23 ILE 25 3HG2 ILE 25 50.622 57.121 39.360 199 HD11 ILE 25 HD1 ILE 25 53.412 56.061 41.510 200 HD12 ILE 25 HD2 ILE 25 52.882 56.801 39.990 201 HD13 ILE 25 HD3 ILE 25 51.792 56.781 41.400 202 H THR 26 H THR 26 48.942 52.661 38.970 203 HA THR 26 HA THR 26 49.172 50.881 41.320 204 HB THR 26 HB THR 26 47.532 49.401 40.090 205 HG1 THR 26 HG1 THR 26 46.242 50.461 38.590 206 HG21 THR 26 1HG2 THR 26 45.562 50.651 40.870 207 HG22 THR 26 2HG2 THR 26 46.852 50.721 42.050 208 HG23 THR 26 3HG2 THR 26 46.542 52.131 41.020 209 H ASP 27 H ASP 27 49.822 48.721 40.910 210 HA ASP 27 HA ASP 27 51.342 47.221 40.090 211 HB2 ASP 27 HB2 ASP 27 49.672 48.031 37.910 212 HB3 ASP 27 HB1 ASP 27 51.292 47.931 37.270 213 H PHE 28 H PHE 28 52.122 50.121 40.630 214 HA PHE 28 HA PHE 28 54.912 49.811 39.760 215 HB2 PHE 28 HB2 PHE 28 53.142 51.351 38.190 216 HB3 PHE 28 HB1 PHE 28 53.982 52.541 39.160 217 HD1 PHE 28 HD1 PHE 28 56.522 52.621 39.130 218 HD2 PHE 28 HD2 PHE 28 54.222 50.181 36.430 219 HE1 PHE 28 HE1 PHE 28 58.482 52.451 37.620 220 HE2 PHE 28 HE2 PHE 28 56.162 50.021 34.920 221 HZ PHE 28 HZ PHE 28 58.302 51.161 35.500 222 H GLY 29 H GLY 29 53.112 50.041 42.210 223 HA2 GLY 29 HA2 GLY 29 53.902 50.681 44.400 224 HA3 GLY 29 HA1 GLY 29 54.912 51.891 43.600 225 H ILE 30 H ILE 30 51.682 51.011 44.610 226 HA ILE 30 HA ILE 30 50.532 53.581 44.050 227 HB ILE 30 HB ILE 30 49.312 51.581 45.990 228 HG12 ILE 30 2HG1 ILE 30 48.182 51.001 43.570 229 HG13 ILE 30 1HG1 ILE 30 49.902 51.111 43.180 230 HG21 ILE 30 1HG2 ILE 30 47.202 52.471 45.120 231 HG22 ILE 30 2HG2 ILE 30 48.172 53.801 45.720 232 HG23 ILE 30 3HG2 ILE 30 48.072 53.531 43.990 233 HD11 ILE 30 HD1 ILE 30 49.332 48.861 43.740 234 HD12 ILE 30 HD2 ILE 30 50.442 49.541 44.950 235 HD13 ILE 30 HD3 ILE 30 48.712 49.381 45.330 236 H PHE 31 H PHE 31 49.332 52.991 47.050 237 HA PHE 31 HA PHE 31 51.342 54.151 48.700 238 HB2 PHE 31 HB2 PHE 31 50.562 56.151 47.390 239 HB3 PHE 31 HB1 PHE 31 48.922 55.821 47.920 240 HD1 PHE 31 HD1 PHE 31 48.342 56.041 50.380 241 HD2 PHE 31 HD2 PHE 31 52.192 57.171 48.800 242 HE1 PHE 31 HE1 PHE 31 48.782 57.381 52.420 243 HE2 PHE 31 HE2 PHE 31 52.632 58.501 50.850 244 HZ PHE 31 HZ PHE 31 50.932 58.611 52.650 245 H ILE 32 H ILE 32 50.882 53.791 50.820 246 HA ILE 32 HA ILE 32 48.142 53.191 51.690 247 HB ILE 32 HB ILE 32 50.432 51.211 52.000 248 HG12 ILE 32 2HG1 ILE 32 47.852 51.061 50.370 249 HG13 ILE 32 1HG1 ILE 32 49.522 51.131 49.720 250 HG21 ILE 32 1HG2 ILE 32 48.742 49.821 53.140 251 HG22 ILE 32 2HG2 ILE 32 48.992 51.361 53.900 252 HG23 ILE 32 3HG2 ILE 32 47.532 51.131 52.930 253 HD11 ILE 32 HD1 ILE 32 48.692 48.891 49.570 254 HD12 ILE 32 HD2 ILE 32 50.082 49.081 50.680 255 HD13 ILE 32 HD3 ILE 32 48.412 48.831 51.310 256 H GLY 33 H GLY 33 47.872 54.521 53.340 257 HA2 GLY 33 HA2 GLY 33 49.432 54.281 55.670 258 HA3 GLY 33 HA1 GLY 33 49.952 55.731 54.830 259 H LEU 34 H LEU 34 49.162 56.441 57.090 260 HA LEU 34 HA LEU 34 46.412 57.491 56.650 261 HB2 LEU 34 HB2 LEU 34 47.022 55.441 58.540 262 HB3 LEU 34 HB1 LEU 34 47.002 56.911 59.490 263 HG LEU 34 HG LEU 34 44.702 57.411 58.710 264 HD11 LEU 34 1HD1 LEU 34 43.442 55.681 57.460 265 HD12 LEU 34 2HD1 LEU 34 44.742 56.331 56.490 266 HD13 LEU 34 3HD1 LEU 34 44.952 54.751 57.260 267 HD21 LEU 34 1HD2 LEU 34 43.602 55.541 59.910 268 HD22 LEU 34 2HD2 LEU 34 45.102 54.591 59.810 269 HD23 LEU 34 3HD2 LEU 34 45.052 56.101 60.760 270 H ASP 35 H ASP 35 46.042 58.971 58.850 271 HA ASP 35 HA ASP 35 47.562 61.291 58.240 272 HB2 ASP 35 HB2 ASP 35 45.792 60.451 60.570 273 HB3 ASP 35 HB1 ASP 35 46.652 61.991 60.600 274 H GLY 36 H GLY 36 47.992 58.841 60.750 275 HA2 GLY 36 HA2 GLY 36 50.772 59.841 61.150 276 HA3 GLY 36 HA1 GLY 36 49.732 59.581 62.560 277 H GLY 37 H GLY 37 48.952 57.321 60.230 278 HA2 GLY 37 HA2 GLY 37 50.232 55.191 61.800 279 HA3 GLY 37 HA1 GLY 37 49.132 54.981 60.400 280 H ILE 38 H ILE 38 50.592 53.371 59.680 281 HA ILE 38 HA ILE 38 53.282 54.171 58.910 282 HB ILE 38 HB ILE 38 51.852 51.531 58.350 283 HG12 ILE 38 2HG1 ILE 38 53.532 50.871 60.300 284 HG13 ILE 38 1HG1 ILE 38 53.332 52.541 60.750 285 HG21 ILE 38 1HG2 ILE 38 54.192 50.731 58.000 286 HG22 ILE 38 2HG2 ILE 38 53.792 51.981 56.870 287 HG23 ILE 38 3HG2 ILE 38 54.802 52.211 58.280 288 HD11 ILE 38 HD1 ILE 38 51.672 51.141 61.970 289 HD12 ILE 38 HD2 ILE 38 50.862 52.281 60.970 290 HD13 ILE 38 HD3 ILE 38 50.942 50.671 60.430 291 H ASP 39 H ASP 39 53.492 55.431 57.210 292 HA ASP 39 HA ASP 39 51.772 54.961 54.880 293 HB2 ASP 39 HB2 ASP 39 52.812 57.091 54.060 294 HB3 ASP 39 HB1 ASP 39 51.792 57.231 55.480 295 H GLY 40 H GLY 40 52.402 54.181 53.000 296 HA2 GLY 40 HA2 GLY 40 55.032 54.321 51.930 297 HA3 GLY 40 HA1 GLY 40 54.862 52.801 52.810 298 H LEU 41 H LEU 41 55.352 53.071 50.030 299 HA LEU 41 HA LEU 41 52.802 52.081 48.850 300 HB2 LEU 41 HB2 LEU 41 53.532 52.771 46.750 301 HB3 LEU 41 HB1 LEU 41 53.712 54.161 47.840 302 HG LEU 41 HG LEU 41 56.052 52.361 47.160 303 HD11 LEU 41 1HD1 LEU 41 56.612 53.941 45.340 304 HD12 LEU 41 2HD1 LEU 41 55.142 53.051 45.100 305 HD13 LEU 41 3HD1 LEU 41 55.062 54.751 45.560 306 HD21 LEU 41 1HD2 LEU 41 57.352 54.391 47.640 307 HD22 LEU 41 2HD2 LEU 41 55.842 55.291 47.950 308 HD23 LEU 41 3HD2 LEU 41 56.362 53.971 49.030 309 H VAL 42 H VAL 42 52.822 50.281 47.550 310 HA VAL 42 HA VAL 42 55.062 48.421 48.080 311 HB VAL 42 HB VAL 42 52.992 47.531 48.820 312 HG11 VAL 42 1HG1 VAL 42 51.052 47.191 47.340 313 HG12 VAL 42 2HG1 VAL 42 51.432 48.911 47.520 314 HG13 VAL 42 3HG1 VAL 42 51.842 48.041 46.040 315 HG21 VAL 42 1HG2 VAL 42 52.842 45.471 47.460 316 HG22 VAL 42 2HG2 VAL 42 53.782 46.221 46.170 317 HG23 VAL 42 3HG2 VAL 42 54.532 45.961 47.750 318 H HIS 43 H HIS 43 56.602 48.741 46.580 319 HA HIS 43 HA HIS 43 55.922 49.201 43.770 320 HB2 HIS 43 HB2 HIS 43 58.572 48.371 45.040 321 HB3 HIS 43 HB1 HIS 43 58.312 48.991 43.400 322 HD2 HIS 43 HD2 HIS 43 57.882 50.321 47.090 323 HE1 HIS 43 HE1 HIS 43 58.722 53.581 44.500 324 HE2 HIS 43 HE2 HIS 43 58.372 52.871 46.920 325 H LEU 44 H LEU 44 56.192 46.411 45.740 326 HA LEU 44 HA LEU 44 57.042 44.481 43.800 327 HB2 LEU 44 HB2 LEU 44 55.072 44.001 46.070 328 HB3 LEU 44 HB1 LEU 44 56.152 42.831 45.320 329 HG LEU 44 HG LEU 44 57.332 45.211 46.800 330 HD11 LEU 44 1HD1 LEU 44 57.332 43.911 48.860 331 HD12 LEU 44 2HD1 LEU 44 55.682 44.251 48.330 332 HD13 LEU 44 3HD1 LEU 44 56.352 42.631 48.080 333 HD21 LEU 44 1HD2 LEU 44 59.152 43.611 47.200 334 HD22 LEU 44 2HD2 LEU 44 58.242 42.331 46.360 335 HD23 LEU 44 3HD2 LEU 44 58.812 43.761 45.460 336 H SER 45 H SER 45 54.152 46.291 44.050 337 HA SER 45 HA SER 45 52.282 44.421 42.880 338 HB2 SER 45 HB2 SER 45 51.742 46.611 44.080 339 HB3 SER 45 HB1 SER 45 52.252 47.451 42.600 340 HG SER 45 HG SER 45 50.002 47.081 42.540 341 H ASP 46 H ASP 46 55.052 46.021 41.560 342 HA ASP 46 HA ASP 46 54.032 46.131 38.850 343 HB2 ASP 46 HB2 ASP 46 56.162 47.281 40.220 344 HB3 ASP 46 HB1 ASP 46 56.982 46.001 39.320 345 H ILE 47 H ILE 47 54.722 43.601 40.780 346 HA ILE 47 HA ILE 47 55.892 41.921 38.600 347 HB ILE 47 HB ILE 47 55.392 41.021 41.470 348 HG12 ILE 47 2HG1 ILE 47 56.792 43.031 41.640 349 HG13 ILE 47 1HG1 ILE 47 57.702 41.581 42.020 350 HG21 ILE 47 1HG2 ILE 47 57.172 39.411 40.930 351 HG22 ILE 47 2HG2 ILE 47 55.822 39.271 39.790 352 HG23 ILE 47 3HG2 ILE 47 57.302 40.081 39.290 353 HD11 ILE 47 HD1 ILE 47 58.972 43.181 40.630 354 HD12 ILE 47 HD2 ILE 47 58.732 41.661 39.750 355 HD13 ILE 47 HD3 ILE 47 57.752 43.101 39.360 356 H SER 48 H SER 48 53.242 41.881 40.930 357 HA SER 48 HA SER 48 51.182 40.901 40.850 358 HB2 SER 48 HB2 SER 48 51.062 40.321 37.980 359 HB3 SER 48 HB1 SER 48 50.032 41.361 38.990 360 HG SER 48 HG SER 48 51.252 42.561 37.340 361 H TRP 49 H TRP 49 50.072 38.861 40.760 362 HA TRP 49 HA TRP 49 51.972 36.611 40.720 363 HB2 TRP 49 HB2 TRP 49 49.122 37.041 41.550 364 HB3 TRP 49 HB1 TRP 49 49.602 35.401 41.120 365 HD1 TRP 49 HD1 TRP 49 51.312 34.131 42.700 366 HE1 TRP 49 HE1 TRP 49 52.052 34.541 45.130 367 HE3 TRP 49 HE3 TRP 49 49.632 38.921 43.230 368 HZ2 TRP 49 HZ2 TRP 49 51.942 36.671 47.040 369 HZ3 TRP 49 HZ3 TRP 49 49.962 40.131 45.370 370 HH2 TRP 49 HH2 TRP 49 51.112 39.011 47.280 371 H ASN 50 H ASN 50 49.022 37.481 38.950 372 HA ASN 50 HA ASN 50 50.082 36.191 36.570 373 HB2 ASN 50 HB2 ASN 50 48.322 34.691 38.310 374 HB3 ASN 50 HB1 ASN 50 47.382 35.131 36.890 375 HD21 ASN 50 1HD2 ASN 50 49.272 35.081 34.850 376 HD22 ASN 50 2HD2 ASN 50 49.852 33.431 34.700 377 H VAL 51 H VAL 51 47.172 37.591 38.060 378 HA VAL 51 HA VAL 51 46.312 38.711 35.500 379 HB VAL 51 HB VAL 51 44.442 39.701 36.830 380 HG11 VAL 51 1HG1 VAL 51 43.332 37.561 37.310 381 HG12 VAL 51 2HG1 VAL 51 44.202 37.511 35.770 382 HG13 VAL 51 3HG1 VAL 51 44.892 36.711 37.200 383 HG21 VAL 51 1HG2 VAL 51 44.142 38.981 39.180 384 HG22 VAL 51 2HG2 VAL 51 45.732 38.191 39.160 385 HG23 VAL 51 3HG2 VAL 51 45.612 39.961 39.000 386 H ALA 52 H ALA 52 45.732 41.041 35.370 387 HA ALA 52 HA ALA 52 47.942 42.671 36.520 388 HB1 ALA 52 HB1 ALA 52 47.422 44.251 34.710 389 HB2 ALA 52 HB2 ALA 52 47.762 42.641 34.070 390 HB3 ALA 52 HB3 ALA 52 46.082 43.211 34.160 391 H GLY 53 H GLY 53 47.332 45.031 36.810 392 HA2 GLY 53 HA2 GLY 53 45.422 45.171 38.920 393 HA3 GLY 53 HA1 GLY 53 46.212 46.571 38.120 394 H GLU 54 H GLU 54 44.872 45.131 35.560 395 HA GLU 54 HA GLU 54 42.772 46.941 35.160 396 HB2 GLU 54 HB2 GLU 54 43.722 44.391 33.930 397 HB3 GLU 54 HB1 GLU 54 41.992 44.701 33.710 398 HG2 GLU 54 HG2 GLU 54 42.552 47.001 32.860 399 HG3 GLU 54 HG1 GLU 54 44.262 46.521 32.870 400 H GLU 55 H GLU 55 42.762 43.871 36.890 401 HA GLU 55 HA GLU 55 39.822 43.901 37.140 402 HB2 GLU 55 HB2 GLU 55 41.972 42.051 38.260 403 HB3 GLU 55 HB1 GLU 55 40.232 41.841 38.500 404 HG2 GLU 55 HG2 GLU 55 41.582 41.921 35.770 405 HG3 GLU 55 HG1 GLU 55 41.252 40.441 36.670 406 H ALA 56 H ALA 56 42.732 44.291 39.200 407 HA ALA 56 HA ALA 56 41.342 44.621 41.660 408 HB1 ALA 56 HB1 ALA 56 43.452 45.681 42.320 409 HB2 ALA 56 HB2 ALA 56 43.782 44.201 41.470 410 HB3 ALA 56 HB3 ALA 56 44.002 45.831 40.690 411 H VAL 57 H VAL 57 42.162 46.941 39.130 412 HA VAL 57 HA VAL 57 41.272 49.231 40.630 413 HB VAL 57 HB VAL 57 42.862 49.431 38.750 414 HG11 VAL 57 1HG1 VAL 57 42.062 49.321 36.410 415 HG12 VAL 57 2HG1 VAL 57 41.822 47.781 37.210 416 HG13 VAL 57 3HG1 VAL 57 40.442 48.791 36.970 417 HG21 VAL 57 1HG2 VAL 57 41.892 51.431 37.670 418 HG22 VAL 57 2HG2 VAL 57 40.302 51.021 38.260 419 HG23 VAL 57 3HG2 VAL 57 41.592 51.421 39.420 420 H ARG 58 H ARG 58 39.622 46.701 38.950 421 HA ARG 58 HA ARG 58 37.372 48.111 37.960 422 HB2 ARG 58 HB2 ARG 58 38.062 45.681 37.520 423 HB3 ARG 58 HB1 ARG 58 37.392 45.291 39.120 424 HG2 ARG 58 HG2 ARG 58 35.742 44.741 37.530 425 HG3 ARG 58 HG1 ARG 58 35.172 46.201 38.360 426 HD2 ARG 58 HD2 ARG 58 35.742 47.591 36.520 427 HD3 ARG 58 HD1 ARG 58 36.712 46.321 35.750 428 HE ARG 58 HE ARG 58 34.132 45.291 35.960 429 HH11 ARG 58 1HH1 ARG 58 35.772 47.921 34.360 430 HH12 ARG 58 2HH1 ARG 58 34.682 47.991 33.000 431 HH21 ARG 58 1HH2 ARG 58 32.702 45.361 34.200 432 HH22 ARG 58 2HH2 ARG 58 32.932 46.521 32.910 433 H GLU 59 H GLU 59 38.202 46.941 41.200 434 HA GLU 59 HA GLU 59 35.522 47.571 42.260 435 HB2 GLU 59 HB2 GLU 59 38.102 46.491 43.440 436 HB3 GLU 59 HB1 GLU 59 36.782 47.051 44.460 437 HG2 GLU 59 HG2 GLU 59 35.532 45.351 42.570 438 HG3 GLU 59 HG1 GLU 59 37.062 44.551 42.970 439 H TYR 60 H TYR 60 38.852 48.861 42.440 440 HA TYR 60 HA TYR 60 37.682 51.381 43.560 441 HB2 TYR 60 HB2 TYR 60 40.012 51.601 44.590 442 HB3 TYR 60 HB1 TYR 60 38.862 50.521 45.330 443 HD1 TYR 60 HD1 TYR 60 41.772 50.581 42.950 444 HD2 TYR 60 HD2 TYR 60 39.422 48.311 45.750 445 HE1 TYR 60 HE1 TYR 60 43.422 48.761 42.800 446 HE2 TYR 60 HE2 TYR 60 41.072 46.471 45.620 447 HH TYR 60 HH TYR 60 42.952 45.771 44.710 448 H LYS 61 H LYS 61 38.192 53.221 42.610 449 HA LYS 61 HA LYS 61 40.352 53.231 40.550 450 HB2 LYS 61 HB2 LYS 61 38.982 54.401 38.960 451 HB3 LYS 61 HB1 LYS 61 38.272 52.841 39.340 452 HG2 LYS 61 HG2 LYS 61 37.332 55.151 41.040 453 HG3 LYS 61 HG1 LYS 61 36.912 55.241 39.330 454 HD2 LYS 61 HD2 LYS 61 35.882 53.001 39.440 455 HD3 LYS 61 HD1 LYS 61 36.362 52.841 41.130 456 HE2 LYS 61 HE2 LYS 61 34.372 53.681 41.660 457 HE3 LYS 61 HE1 LYS 61 35.072 55.251 41.230 458 HZ1 LYS 61 HZ1 LYS 61 32.972 54.851 40.090 459 HZ2 LYS 61 HZ2 LYS 61 34.202 54.921 38.980 460 HZ3 LYS 61 HZ3 LYS 61 33.552 53.461 39.420 461 H LYS 62 H LYS 62 40.472 55.641 39.660 462 HA LYS 62 HA LYS 62 41.702 57.201 41.530 463 HB2 LYS 62 HB2 LYS 62 41.042 59.201 40.120 464 HB3 LYS 62 HB1 LYS 62 41.832 57.861 39.270 465 HG2 LYS 62 HG2 LYS 62 39.582 57.061 38.490 466 HG3 LYS 62 HG1 LYS 62 38.822 58.451 39.260 467 HD2 LYS 62 HD2 LYS 62 41.032 58.811 37.240 468 HD3 LYS 62 HD1 LYS 62 39.342 58.531 36.770 469 HE2 LYS 62 HE2 LYS 62 38.822 60.471 38.490 470 HE3 LYS 62 HE1 LYS 62 40.532 60.871 38.280 471 HZ1 LYS 62 HZ1 LYS 62 39.132 62.071 36.720 472 HZ2 LYS 62 HZ2 LYS 62 40.112 61.041 35.890 473 HZ3 LYS 62 HZ3 LYS 62 38.532 60.661 36.110 474 H GLY 63 H GLY 63 41.082 57.851 43.480 475 HA2 GLY 63 HA2 GLY 63 39.802 59.461 44.800 476 HA3 GLY 63 HA1 GLY 63 38.382 59.111 43.770 477 H ASP 64 H ASP 64 39.992 56.221 44.460 478 HA ASP 64 HA ASP 64 38.082 55.671 46.660 479 HB2 ASP 64 HB2 ASP 64 38.232 54.361 44.320 480 HB3 ASP 64 HB1 ASP 64 39.502 53.521 45.200 481 H GLU 65 H GLU 65 38.862 53.951 48.200 482 HA GLU 65 HA GLU 65 41.732 54.131 48.740 483 HB2 GLU 65 HB2 GLU 65 39.492 54.991 50.610 484 HB3 GLU 65 HB1 GLU 65 41.042 54.431 51.210 485 HG2 GLU 65 HG2 GLU 65 41.682 56.561 51.140 486 HG3 GLU 65 HG1 GLU 65 41.952 56.261 49.440 487 H ILE 66 H ILE 66 42.562 52.511 50.000 488 HA ILE 66 HA ILE 66 40.762 50.121 50.210 489 HB ILE 66 HB ILE 66 42.712 48.671 49.810 490 HG12 ILE 66 2HG1 ILE 66 44.262 51.191 49.180 491 HG13 ILE 66 1HG1 ILE 66 44.422 50.321 50.720 492 HG21 ILE 66 1HG2 ILE 66 43.012 49.141 47.400 493 HG22 ILE 66 2HG2 ILE 66 41.332 49.351 47.900 494 HG23 ILE 66 3HG2 ILE 66 42.362 50.771 47.630 495 HD11 ILE 66 HD1 ILE 66 46.232 49.751 49.240 496 HD12 ILE 66 HD2 ILE 66 45.202 48.331 49.530 497 HD13 ILE 66 HD3 ILE 66 45.102 49.221 47.980 498 H ALA 67 H ALA 67 41.862 48.381 51.740 499 HA ALA 67 HA ALA 67 43.082 49.761 54.070 500 HB1 ALA 67 HB1 ALA 67 41.532 48.581 55.580 501 HB2 ALA 67 HB2 ALA 67 40.672 49.691 54.480 502 HB3 ALA 67 HB3 ALA 67 40.652 47.941 54.170 503 H ALA 68 H ALA 68 44.762 48.721 54.850 504 HA ALA 68 HA ALA 68 44.852 45.811 54.750 505 HB1 ALA 68 HB1 ALA 68 47.072 45.771 53.580 506 HB2 ALA 68 HB2 ALA 68 45.792 46.451 52.550 507 HB3 ALA 68 HB3 ALA 68 46.972 47.521 53.330 508 H VAL 69 H VAL 69 46.982 45.031 55.700 509 HA VAL 69 HA VAL 69 47.592 46.701 58.080 510 HB VAL 69 HB VAL 69 48.362 44.521 59.120 511 HG11 VAL 69 1HG1 VAL 69 46.072 43.761 59.660 512 HG12 VAL 69 2HG1 VAL 69 46.152 45.531 59.680 513 HG13 VAL 69 3HG1 VAL 69 45.422 44.721 58.290 514 HG21 VAL 69 1HG2 VAL 69 47.512 42.431 58.150 515 HG22 VAL 69 2HG2 VAL 69 46.882 43.311 56.730 516 HG23 VAL 69 3HG2 VAL 69 48.582 43.281 57.040 517 H VAL 70 H VAL 70 49.652 46.861 58.890 518 HA VAL 70 HA VAL 70 51.732 46.571 56.760 519 HB VAL 70 HB VAL 70 51.572 48.791 57.660 520 HG11 VAL 70 1HG1 VAL 70 52.122 49.161 60.020 521 HG12 VAL 70 2HG1 VAL 70 50.522 48.351 59.830 522 HG13 VAL 70 3HG1 VAL 70 51.992 47.541 60.430 523 HG21 VAL 70 1HG2 VAL 70 53.882 48.981 58.600 524 HG22 VAL 70 2HG2 VAL 70 54.042 47.331 58.770 525 HG23 VAL 70 3HG2 VAL 70 53.842 48.001 57.120 526 H LEU 71 H LEU 71 53.222 45.071 56.850 527 HA LEU 71 HA LEU 71 53.742 43.711 59.500 528 HB2 LEU 71 HB2 LEU 71 54.492 42.071 57.250 529 HB3 LEU 71 HB1 LEU 71 53.382 41.731 58.570 530 HG LEU 71 HG LEU 71 52.552 43.251 56.080 531 HD11 LEU 71 1HD1 LEU 71 51.732 41.131 55.260 532 HD12 LEU 71 2HD1 LEU 71 53.422 41.061 55.450 533 HD13 LEU 71 3HD1 LEU 71 52.332 40.281 56.660 534 HD21 LEU 71 1HD2 LEU 71 50.382 42.601 56.860 535 HD22 LEU 71 2HD2 LEU 71 50.982 41.771 58.260 536 HD23 LEU 71 3HD2 LEU 71 51.062 43.531 58.090 537 H GLN 72 H GLN 72 55.152 44.681 56.370 538 HA GLN 72 HA GLN 72 57.742 44.921 57.800 539 HB2 GLN 72 HB2 GLN 72 57.102 42.981 55.730 540 HB3 GLN 72 HB1 GLN 72 58.202 44.191 55.050 541 HG2 GLN 72 HG2 GLN 72 59.712 42.711 55.850 542 HG3 GLN 72 HG1 GLN 72 59.602 43.821 57.210 543 HE21 GLN 72 1HE2 GLN 72 60.542 41.851 58.290 544 HE22 GLN 72 2HE2 GLN 72 59.382 40.661 58.890 545 H VAL 73 H VAL 73 59.052 46.641 57.160 546 HA VAL 73 HA VAL 73 58.542 48.141 54.810 547 HB VAL 73 HB VAL 73 56.642 49.051 55.840 548 HG11 VAL 73 1HG1 VAL 73 56.522 49.841 58.120 549 HG12 VAL 73 2HG1 VAL 73 56.942 48.151 58.100 550 HG13 VAL 73 3HG1 VAL 73 58.222 49.351 58.400 551 HG21 VAL 73 1HG2 VAL 73 57.182 51.331 56.240 552 HG22 VAL 73 2HG2 VAL 73 58.882 50.991 56.460 553 HG23 VAL 73 3HG2 VAL 73 58.102 50.751 54.870 554 H ASP 74 H ASP 74 60.142 49.631 54.430 555 HA ASP 74 HA ASP 74 62.162 49.991 56.590 556 HB2 ASP 74 HB2 ASP 74 62.882 49.471 53.720 557 HB3 ASP 74 HB1 ASP 74 63.972 49.511 55.100 558 H ALA 75 H ALA 75 62.972 51.991 56.780 559 HA ALA 75 HA ALA 75 61.792 54.101 55.140 560 HB1 ALA 75 HB1 ALA 75 63.072 55.581 56.600 561 HB2 ALA 75 HB2 ALA 75 62.162 54.401 57.560 562 HB3 ALA 75 HB3 ALA 75 63.932 54.211 57.320 563 H GLU 76 H GLU 76 64.852 52.421 55.230 564 HA GLU 76 HA GLU 76 66.112 54.361 53.370 565 HB2 GLU 76 HB2 GLU 76 67.042 51.841 54.790 566 HB3 GLU 76 HB1 GLU 76 67.972 52.551 53.470 567 HG2 GLU 76 HG2 GLU 76 67.222 54.611 55.410 568 HG3 GLU 76 HG1 GLU 76 68.022 53.261 56.220 569 H ARG 77 H ARG 77 64.792 51.051 53.380 570 HA ARG 77 HA ARG 77 65.562 50.671 50.570 571 HB2 ARG 77 HB2 ARG 77 65.242 48.901 52.620 572 HB3 ARG 77 HB1 ARG 77 63.642 48.851 51.910 573 HG2 ARG 77 HG2 ARG 77 64.952 47.091 50.980 574 HG3 ARG 77 HG1 ARG 77 64.592 48.281 49.700 575 HD2 ARG 77 HD2 ARG 77 66.782 49.011 49.600 576 HD3 ARG 77 HD1 ARG 77 67.112 48.621 51.300 577 HE ARG 77 HE ARG 77 66.662 46.191 49.920 578 HH11 ARG 77 1HH1 ARG 77 68.982 48.811 50.050 579 HH12 ARG 77 2HH1 ARG 77 70.342 47.841 49.580 580 HH21 ARG 77 1HH2 ARG 77 68.432 44.901 49.310 581 HH22 ARG 77 2HH2 ARG 77 70.012 45.611 49.150 582 H GLU 78 H GLU 78 62.852 51.911 52.350 583 HA GLU 78 HA GLU 78 60.832 52.681 51.760 584 HB2 GLU 78 HB2 GLU 78 61.712 52.701 48.870 585 HB3 GLU 78 HB1 GLU 78 60.592 53.771 49.730 586 HG2 GLU 78 HG2 GLU 78 62.862 54.291 51.140 587 HG3 GLU 78 HG1 GLU 78 63.602 53.751 49.630 588 H ARG 79 H ARG 79 61.402 49.761 51.660 589 HA ARG 79 HA ARG 79 59.352 48.871 49.700 590 HB2 ARG 79 HB2 ARG 79 60.302 46.671 49.850 591 HB3 ARG 79 HB1 ARG 79 61.532 47.851 49.380 592 HG2 ARG 79 HG2 ARG 79 62.812 46.971 50.960 593 HG3 ARG 79 HG1 ARG 79 61.812 47.811 52.140 594 HD2 ARG 79 HD2 ARG 79 60.862 45.891 52.890 595 HD3 ARG 79 HD1 ARG 79 60.732 45.211 51.250 596 HE ARG 79 HE ARG 79 63.412 45.351 52.370 597 HH11 ARG 79 1HH1 ARG 79 60.462 43.531 52.310 598 HH12 ARG 79 2HH1 ARG 79 61.192 41.991 52.690 599 HH21 ARG 79 1HH2 ARG 79 64.422 43.361 52.820 600 HH22 ARG 79 2HH2 ARG 79 63.462 41.901 52.980 601 H ILE 80 H ILE 80 57.412 48.771 50.580 602 HA ILE 80 HA ILE 80 57.172 47.631 53.330 603 HB ILE 80 HB ILE 80 56.442 49.921 53.330 604 HG12 ILE 80 2HG1 ILE 80 54.042 48.021 53.320 605 HG13 ILE 80 1HG1 ILE 80 55.122 48.291 54.670 606 HG21 ILE 80 1HG2 ILE 80 54.612 50.681 51.860 607 HG22 ILE 80 2HG2 ILE 80 56.032 50.181 50.990 608 HG23 ILE 80 3HG2 ILE 80 54.592 49.111 51.040 609 HD11 ILE 80 HD1 ILE 80 53.062 49.481 54.970 610 HD12 ILE 80 HD2 ILE 80 54.412 50.641 54.780 611 HD13 ILE 80 HD3 ILE 80 53.262 50.331 53.440 612 H SER 81 H SER 81 55.722 46.081 53.760 613 HA SER 81 HA SER 81 54.212 44.961 51.450 614 HB2 SER 81 HB2 SER 81 54.742 42.701 52.800 615 HB3 SER 81 HB1 SER 81 55.792 43.321 51.510 616 HG SER 81 HG SER 81 56.922 42.721 53.430 617 H LEU 82 H LEU 82 52.252 44.171 51.840 618 HA LEU 82 HA LEU 82 51.182 44.581 54.570 619 HB2 LEU 82 HB2 LEU 82 48.942 44.641 53.240 620 HB3 LEU 82 HB1 LEU 82 49.932 46.071 53.350 621 HG LEU 82 HG LEU 82 50.432 44.251 50.980 622 HD11 LEU 82 1HD1 LEU 82 48.572 45.271 49.700 623 HD12 LEU 82 2HD1 LEU 82 48.152 44.201 50.940 624 HD13 LEU 82 3HD1 LEU 82 47.932 45.961 51.230 625 HD21 LEU 82 1HD2 LEU 82 50.652 46.461 49.860 626 HD22 LEU 82 2HD2 LEU 82 50.152 47.201 51.410 627 HD23 LEU 82 3HD2 LEU 82 51.702 46.381 51.300 628 H GLY 83 H GLY 83 49.642 43.171 55.350 629 HA2 GLY 83 HA2 GLY 83 49.882 40.401 54.280 630 HA3 GLY 83 HA1 GLY 83 49.542 40.841 55.960 631 H VAL 84 H VAL 84 47.752 42.841 54.120 632 HA VAL 84 HA VAL 84 45.292 41.781 54.890 633 HB VAL 84 HB VAL 84 45.712 44.061 54.030 634 HG11 VAL 84 1HG1 VAL 84 45.612 44.511 51.590 635 HG12 VAL 84 2HG1 VAL 84 46.922 43.431 52.160 636 HG13 VAL 84 3HG1 VAL 84 45.552 42.781 51.260 637 HG21 VAL 84 1HG2 VAL 84 43.512 44.331 52.910 638 HG22 VAL 84 2HG2 VAL 84 43.402 42.591 52.700 639 HG23 VAL 84 3HG2 VAL 84 43.412 43.291 54.350 640 H LYS 85 H LYS 85 47.322 41.031 52.100 641 HA LYS 85 HA LYS 85 45.252 39.561 50.650 642 HB2 LYS 85 HB2 LYS 85 48.272 39.951 50.420 643 HB3 LYS 85 HB1 LYS 85 47.492 38.641 49.540 644 HG2 LYS 85 HG2 LYS 85 46.962 40.041 47.910 645 HG3 LYS 85 HG1 LYS 85 45.852 40.881 49.010 646 HD2 LYS 85 HD2 LYS 85 47.992 42.161 49.820 647 HD3 LYS 85 HD1 LYS 85 48.732 41.521 48.330 648 HE2 LYS 85 HE2 LYS 85 46.252 42.521 47.480 649 HE3 LYS 85 HE1 LYS 85 46.722 43.671 48.740 650 HZ1 LYS 85 HZ1 LYS 85 47.552 44.331 46.580 651 HZ2 LYS 85 HZ2 LYS 85 48.832 43.981 47.570 652 HZ3 LYS 85 HZ3 LYS 85 48.362 42.921 46.400 653 H GLN 86 H GLN 86 47.692 38.781 53.070 654 HA GLN 86 HA GLN 86 47.262 35.881 52.740 655 HB2 GLN 86 HB2 GLN 86 49.512 36.671 53.280 656 HB3 GLN 86 HB1 GLN 86 48.912 37.551 54.700 657 HG2 GLN 86 HG2 GLN 86 50.002 35.461 55.370 658 HG3 GLN 86 HG1 GLN 86 48.322 35.451 55.800 659 HE21 GLN 86 1HE2 GLN 86 47.742 33.321 55.680 660 HE22 GLN 86 2HE2 GLN 86 48.022 32.301 54.280 661 H LEU 87 H LEU 87 45.932 38.531 54.560 662 HA LEU 87 HA LEU 87 45.042 37.061 56.820 663 HB2 LEU 87 HB2 LEU 87 45.092 39.731 56.120 664 HB3 LEU 87 HB1 LEU 87 43.412 39.371 55.790 665 HG LEU 87 HG LEU 87 43.442 38.311 58.230 666 HD11 LEU 87 1HD1 LEU 87 44.992 39.551 59.720 667 HD12 LEU 87 2HD1 LEU 87 45.882 38.541 58.550 668 HD13 LEU 87 3HD1 LEU 87 45.762 40.301 58.300 669 HD21 LEU 87 1HD2 LEU 87 42.802 40.531 59.120 670 HD22 LEU 87 2HD2 LEU 87 43.482 41.311 57.670 671 HD23 LEU 87 3HD2 LEU 87 42.082 40.231 57.530 672 H ALA 88 H ALA 88 43.182 38.191 53.960 673 HA ALA 88 HA ALA 88 41.892 35.741 53.480 674 HB1 ALA 88 HB1 ALA 88 39.612 36.271 54.320 675 HB2 ALA 88 HB2 ALA 88 40.752 36.111 55.660 676 HB3 ALA 88 HB3 ALA 88 40.252 37.731 55.110 677 H GLU 89 H GLU 89 41.672 35.941 51.370 678 HA GLU 89 HA GLU 89 41.262 38.521 50.100 679 HB2 GLU 89 HB2 GLU 89 42.312 35.981 49.330 680 HB3 GLU 89 HB1 GLU 89 40.872 36.211 48.350 681 HG2 GLU 89 HG2 GLU 89 41.712 38.421 47.610 682 HG3 GLU 89 HG1 GLU 89 43.172 38.181 48.580 683 H ASP 90 H ASP 90 39.592 38.331 48.110 684 HA ASP 90 HA ASP 90 37.062 37.221 49.100 685 HB2 ASP 90 HB2 ASP 90 37.292 40.121 48.240 686 HB3 ASP 90 HB1 ASP 90 35.882 39.321 48.890 687 HA PRO 91 HA PRO 91 36.442 36.321 44.840 688 HB2 PRO 91 HB1 PRO 91 33.662 36.391 44.660 689 HB3 PRO 91 HB2 PRO 91 34.562 35.081 45.500 690 HG2 PRO 91 HG1 PRO 91 33.232 37.531 46.670 691 HG3 PRO 91 HG2 PRO 91 33.172 35.831 47.260 692 HD2 PRO 91 HD1 PRO 91 34.802 37.701 48.330 693 HD3 PRO 91 HD2 PRO 91 35.302 35.991 48.210 694 H PHE 92 H PHE 92 35.672 39.361 46.130 695 HA PHE 92 HA PHE 92 35.392 41.411 45.260 696 HB2 PHE 92 HB2 PHE 92 36.112 40.211 42.560 697 HB3 PHE 92 HB1 PHE 92 36.292 41.881 43.070 698 HD1 PHE 92 HD1 PHE 92 37.562 41.701 45.700 699 HD2 PHE 92 HD2 PHE 92 38.242 39.361 42.150 700 HE1 PHE 92 HE1 PHE 92 39.862 41.231 46.460 701 HE2 PHE 92 HE2 PHE 92 40.562 38.901 42.900 702 HZ PHE 92 HZ PHE 92 41.382 39.821 45.050 703 H ASN 93 H ASN 93 34.062 42.751 43.800 704 HA ASN 93 HA ASN 93 32.042 41.501 42.190 705 HB2 ASN 93 HB2 ASN 93 31.382 41.111 44.780 706 HB3 ASN 93 HB1 ASN 93 30.822 42.771 44.630 707 HD21 ASN 93 1HD2 ASN 93 29.062 43.231 43.250 708 HD22 ASN 93 2HD2 ASN 93 28.022 41.921 42.640 709 H ASN 94 H ASN 94 30.562 43.021 41.260 710 HA ASN 94 HA ASN 94 31.812 45.581 40.780 711 HB2 ASN 94 HB2 ASN 94 28.962 44.751 40.090 712 HB3 ASN 94 HB1 ASN 94 29.932 46.001 39.310 713 HD21 ASN 94 1HD2 ASN 94 32.272 44.851 38.780 714 HD22 ASN 94 2HD2 ASN 94 32.062 43.421 37.750
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