NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 101 T 4.3975 8.1744 117.3752 63.1369 69.6737 171.9196 102 D 4.5251 7.5604 121.0653 54.1546 47.3800 175.2515 103 A 4.2304 8.8057 121.1038 54.4904 19.2814 179.1383 104 T 3.9652 7.8643 114.5157 66.6401 68.8251 176.6216 105 I 3.7265 7.7836 120.0049 63.9150 37.8899 177.8280 106 K 3.9349 7.7190 117.9429 59.4438 31.9428 179.3913 107 K 4.0841 7.7187 117.2465 59.7299 32.1711 179.3872 108 E 4.0000 8.4230 118.7887 59.3361 29.2796 179.2658 109 Q 3.9821 8.0866 119.8500 59.0364 29.0567 178.3183 110 K 3.9782 8.2981 119.7280 59.1263 32.0276 179.0181 111 L 3.8067 7.8539 121.0103 58.1380 41.8791 179.1662 112 I 3.8278 7.5843 112.5726 63.6228 37.5530 177.8237 113 Q 4.0137 8.2252 121.1963 58.9963 28.8710 178.1747 114 A 3.9566 8.2442 121.9413 55.3675 18.5752 179.5160 115 Q 3.9344 8.4264 116.8345 59.2622 28.8030 179.0075 116 N 4.3538 8.8849 118.3052 56.4214 38.5945 177.5659 117 L 4.0647 8.2037 120.7155 57.4032 41.6546 179.7380 118 V 3.7165 8.3818 121.2594 66.7676 31.4086 178.6228 119 R 4.1178 7.7977 120.0063 61.8976 28.8251 180.0292 120 E 4.2237 8.1885 119.6739 58.4671 29.6044 178.5977 121 F 4.5076 8.3573 121.0501 61.6176 39.3368 176.6957 122 E 3.8187 8.1817 119.2366 60.1020 29.2998 179.9057 123 K 4.2695 7.5568 122.2098 58.2859 32.0451 180.6318 124 T 4.6653 7.4961 110.2332 61.4697 69.0350 173.6766 125 H 4.4296 8.4069 117.8255 56.4155 27.2351 174.3452 126 T 4.8382 7.4136 108.1784 60.4164 71.6381 174.8784 127 V 3.6286 7.9251 121.7608 65.2586 31.2427 178.4822 128 S 4.0599 8.2389 115.2563 61.6908 62.6331 176.7123 129 A 4.0451 7.9066 122.2907 54.7653 18.2552 179.1502 130 H 2.5800 7.9997 117.1249 58.8960 29.9163 177.3268 131 R 3.6852 7.9076 120.1158 59.3454 29.8920 179.1355 132 K 3.8413 7.8329 117.4201 59.4220 32.0708 179.2514 133 A 3.8991 7.9843 121.3004 55.1718 18.2531 179.4341 134 Q 3.7939 8.2726 118.2854 59.0604 28.8822 178.4598 135 K 3.8362 7.7387 119.0992 59.3707 32.5963 178.0280 136 A 4.1135 7.9978 121.2399 55.4743 18.1240 179.5905 137 V 3.5357 8.0912 116.7015 66.4616 31.3691 177.9380 138 N 4.4667 8.1521 114.2393 55.4960 38.4119 176.6408 139 L 4.2447 7.7072 119.3203 55.2263 42.3930 177.4991 140 V 3.7942 6.8620 118.8131 62.5218 32.3201 175.6253 141 S 4.3259 8.8464 122.7489 58.5790 63.1405 175.6565 *142 F 4.3835 8.5947 124.0801 58.5952 38.0000 177.0571 143 E 3.9676 8.0477 116.2075 59.4746 29.7348 177.7424 144 Y 4.7892 8.0049 117.5260 58.4279 38.4963 178.2621 145 K 4.3132 7.8877 123.7034 59.9626 32.9240 178.1230 146 V 3.6228 7.8009 119.2048 65.7376 31.7438 177.7839 147 K 4.1242 8.0509 118.2388 58.3445 32.1106 178.6348 148 K 3.9146 8.0512 120.3601 59.9819 32.2077 178.2807 149 M 4.0211 7.7130 119.0648 58.6727 31.8449 179.0031 150 V 3.6322 7.6893 117.5965 66.0233 31.7047 178.1047 151 L 3.9877 8.0187 118.7774 57.6144 41.3743 179.0817 152 Q 3.9703 8.5146 120.0166 59.2544 28.9667 177.9981 153 E 4.2621 8.4873 121.8783 58.9874 29.7936 178.9946 154 R 3.9467 8.2696 118.1311 59.2642 29.9329 179.1695 155 I 3.9129 7.8644 119.6337 64.5953 37.1274 177.7820 156 D 4.4656 8.3635 119.7932 57.8398 40.8321 179.2170 157 N 4.3277 8.3726 116.5381 56.3636 38.3865 177.3721 158 V 3.4178 7.2856 117.6896 66.1729 31.8530 177.6566 159 L 4.2414 8.4134 121.1859 58.4011 41.2125 180.3605 160 K 4.0579 7.9902 122.9215 59.8895 31.7449 181.1637 161 Q 4.2960 7.7585 117.9444 56.4488 28.8274 177.8403 162 G 4.0724 7.5079 104.7998 45.2485 0.0000 172.6747 163 L 4.8731 8.0431 118.8323 52.5772 44.9345 176.1387 164 V 4.4139 7.7401 121.7929 60.4879 34.5827 176.6143 165 R 4.1216 8.5435 116.4205 56.8414 29.2097 173.4662 NUM RES H HA HB HB2 HB3 HD1 HD2 HD21 HD22 HD3 HE HE1 HE2 HE21 HE22 HE3 HG HG1 HG12 HG13 HG2 HG3 HZ 101 T 8.17 4.40 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 102 D 7.56 4.53 0.00 2.74 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 8.81 4.23 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 T 7.86 3.97 4.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 105 I 7.78 3.73 1.89 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.36 1.01 0.00 0.00 106 K 7.72 3.93 0.00 2.06 1.87 0.00 1.90 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.50 7.81 107 K 7.72 4.08 0.00 2.12 2.12 0.00 1.73 0.00 0.00 1.57 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.68 7.81 108 E 8.42 4.00 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.74 0.00 109 Q 8.09 3.98 0.00 2.35 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.80 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 110 K 8.30 3.98 0.00 2.02 1.86 0.00 1.76 0.00 0.00 1.77 0.00 0.00 2.89 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.47 1.57 7.81 111 L 7.85 3.81 0.00 1.29 1.58 0.63 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 112 I 7.58 3.83 1.83 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.63 0.93 0.00 0.00 113 Q 8.23 4.01 0.00 2.28 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.83 0.00 0.00 0.00 0.00 0.00 2.34 2.41 0.00 114 A 8.24 3.96 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 Q 8.43 3.93 0.00 2.22 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.40 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.43 0.00 116 N 8.88 4.35 0.00 2.97 2.86 0.00 0.00 7.08 5.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 L 8.20 4.06 0.00 1.71 1.68 0.89 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 118 V 8.38 3.72 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 1.01 0.00 0.00 119 R 7.80 4.12 0.00 1.89 1.95 0.00 3.32 0.00 0.00 3.09 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 120 E 8.19 4.22 0.00 2.28 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.47 0.00 121 F 8.36 4.51 0.00 3.14 3.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.18 3.82 0.00 2.14 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.26 0.00 123 K 7.56 4.27 0.00 1.82 1.72 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.36 1.31 7.81 124 T 7.50 4.67 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 125 H 8.41 4.43 0.00 3.23 3.26 0.00 5.66 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 126 T 7.41 4.84 4.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 127 V 7.93 3.63 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.95 0.00 0.00 128 S 8.24 4.06 0.00 3.90 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 129 A 7.91 4.05 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 H 8.00 2.58 0.00 2.50 3.32 0.00 5.81 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 7.91 3.69 0.00 1.98 1.90 0.00 3.17 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.94 0.00 132 K 7.83 3.84 0.00 1.73 1.79 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.41 1.54 7.81 133 A 7.98 3.90 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 134 Q 8.27 3.79 0.00 1.93 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 135 K 7.74 3.84 0.00 1.75 1.76 0.00 1.85 0.00 0.00 1.67 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.43 7.81 136 A 8.00 4.11 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 V 8.09 3.54 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.98 0.00 0.00 138 N 8.15 4.47 0.00 2.88 2.86 0.00 0.00 7.10 7.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 L 7.71 4.24 0.00 1.78 1.73 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 140 V 6.86 3.79 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.84 0.00 0.00 1.03 0.00 0.00 141 S 8.85 4.33 0.00 3.94 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *142 F 8.59 4.38 0.00 2.25 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 143 E 8.05 3.97 0.00 1.86 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.47 0.00 144 Y 8.00 4.79 0.00 3.10 2.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 145 K 7.89 4.31 0.00 2.02 2.24 0.00 1.31 0.00 0.00 1.69 0.00 0.00 2.89 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.52 7.81 146 V 7.80 3.62 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.95 0.00 0.00 147 K 8.05 4.12 0.00 1.93 1.78 0.00 1.67 0.00 0.00 1.74 0.00 0.00 2.96 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.51 7.81 148 K 8.05 3.91 0.00 1.96 1.97 0.00 1.86 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.46 1.62 7.81 149 M 7.71 4.02 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.92 2.58 0.00 150 V 7.69 3.63 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.99 0.00 0.00 151 L 8.02 3.99 0.00 1.90 1.71 0.93 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 152 Q 8.51 3.97 0.00 2.20 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.77 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 153 E 8.49 4.26 0.00 2.28 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 154 R 8.27 3.95 0.00 2.11 2.15 0.00 3.18 0.00 0.00 3.18 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 155 I 7.86 3.91 2.10 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.95 1.08 0.00 0.00 156 D 8.36 4.47 0.00 2.82 2.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 157 N 8.37 4.33 0.00 3.05 2.85 0.00 0.00 6.65 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 V 7.29 3.42 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.50 0.00 0.00 0.69 0.00 0.00 159 L 8.41 4.24 0.00 1.95 1.74 1.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 0.00 0.00 0.00 0.00 0.00 0.00 160 K 7.99 4.06 0.00 1.85 1.73 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.35 7.81 161 Q 7.76 4.30 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 5.38 0.00 0.00 0.00 0.00 0.00 2.38 2.51 0.00 162 G 7.51 4.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 163 L 8.04 4.87 0.00 1.62 1.60 1.04 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 164 V 7.74 4.41 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.94 0.00 0.00 165 R 8.54 4.12 0.00 1.87 1.85 0.00 3.28 0.00 0.00 3.37 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.17 0.00 * Residues marked with a * may have inaccurate shift predictions.