NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- *131 Y 4.6440 8.1444 119.1563 57.0777 38.9330 173.3324 132 R 4.2052 7.9932 128.2111 55.1473 33.8730 170.0745 133 G 3.8226 8.9750 104.4540 46.9846 0.0000 168.2504 *134 H 4.2511 9.1223 123.5572 54.0726 26.9656 171.1808 135 R 4.1285 8.3531 123.8298 55.1601 30.6399 176.7430 136 F 4.7713 8.2902 120.0346 56.8237 40.0585 175.6870 137 T 3.8008 8.8329 121.7306 65.0152 69.0159 175.4183 138 K 3.9907 9.0410 131.2713 60.2374 31.7131 175.6772 139 E 4.1072 8.2551 120.1815 59.0498 29.3845 178.5982 140 N 4.2335 8.3295 116.7086 56.3847 38.8687 177.6720 141 V 3.4257 7.7541 118.5677 65.2941 31.5394 178.2055 142 R 3.9207 8.1984 118.4355 59.5844 29.9711 178.8979 143 I 3.7831 7.7349 119.6031 64.2001 37.1170 178.3653 144 L 3.8154 7.8800 120.0757 57.8765 41.2177 179.5072 145 E 4.4741 8.1246 118.5234 59.4529 29.3137 179.4680 146 S 4.2061 8.3164 114.5099 61.1763 62.9673 176.4916 147 W 4.0273 8.5524 131.9680 60.3117 30.3719 177.7546 148 F 3.8217 8.7647 119.0150 61.0726 38.9255 176.7948 149 A 4.2867 8.6002 122.9515 55.8290 18.1810 180.4019 150 K 3.9817 8.0941 120.5239 58.5712 32.1350 178.7141 151 N 4.9542 7.5260 115.5391 53.3467 39.0333 176.5441 152 I 3.5074 7.3077 120.2590 63.2844 37.6310 177.9284 153 E 4.0603 7.9347 117.7786 59.0463 29.7838 176.9046 154 N 4.7936 7.0550 114.0156 52.7439 41.2670 172.2378 155 P 4.1910 0.0000 0.0000 61.9701 31.3616 176.7336 156 Y 4.8154 7.5448 114.5341 56.6671 40.8538 176.3994 157 L 4.2685 8.7300 124.5001 54.6628 42.5223 176.5198 158 D 5.1301 8.2496 122.0064 51.4822 43.8465 176.8288 159 T 3.8052 8.4238 111.1094 66.0558 68.6938 176.5325 160 K 4.1031 8.2499 126.6784 58.6627 31.9459 180.9875 161 G 4.1058 8.3887 107.3203 47.9698 0.0000 175.3648 162 L 3.8113 8.2505 123.6297 57.6593 42.1417 178.9963 163 E 3.9694 8.0348 117.9868 59.2437 29.1014 178.7832 164 N 4.5103 7.9579 116.5168 56.2413 39.2408 176.7484 165 L 4.0497 7.6463 120.3565 57.9188 41.5637 179.1175 166 M 4.0047 8.5101 121.0528 59.0808 31.9232 179.0914 167 K 4.1742 8.3553 123.5286 58.8451 31.8800 180.4399 168 N 5.0429 7.8366 113.8986 52.4320 39.3981 174.7046 169 T 4.6679 7.0623 109.4676 59.9780 71.8482 174.9062 170 S 4.1510 8.4806 117.1138 58.6144 62.7858 173.5394 171 L 4.4957 7.2644 121.1285 53.3044 43.2859 176.7870 172 S 3.9926 9.7854 118.7111 60.1603 63.4523 176.8749 173 R 3.3852 7.8738 125.1982 58.5198 31.6038 177.8023 174 I 3.7556 7.6621 118.1927 64.4252 37.0860 178.3516 175 Q 4.1340 8.6399 119.4944 58.9331 28.4808 178.8408 176 I 3.8406 7.6472 120.4432 64.3308 36.8475 178.3927 177 K 4.0297 8.2414 119.3978 59.5971 31.9124 179.0115 178 N 4.5472 8.7481 116.7644 55.2464 38.4902 177.4378 179 W 4.0716 8.4186 130.4276 60.5852 30.7327 178.0457 180 V 4.0137 8.0629 117.0887 66.3155 31.1276 177.7667 181 S 4.2367 7.9392 112.1470 61.4215 62.3523 175.5376 182 N 4.1696 8.0023 119.0030 56.5974 38.3572 177.2168 183 R 3.2798 8.0215 119.9031 59.3415 29.6636 178.7751 184 R 4.1207 7.7740 117.0014 59.1543 30.3705 178.4904 185 R 4.0020 7.8454 118.0938 59.2679 30.0283 178.2329 186 K 3.7636 7.8519 119.2191 59.6001 32.0800 178.2995 187 E 4.1034 7.8588 118.2364 59.0333 29.4395 178.1366 188 K 4.2941 7.6276 116.2750 57.4370 32.0490 176.6075 189 T 4.1936 8.1560 120.6882 64.2799 69.6329 173.5062 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 *131 Y 8.14 4.64 0.00 2.35 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 0.00 0.00 0.00 0.00 132 R 7.99 4.21 0.00 1.81 1.70 0.00 3.26 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.71 0.00 133 G 8.97 3.82 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 *134 H 9.12 4.25 0.00 3.12 3.11 0.00 7.21 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 R 8.35 4.13 0.00 1.80 1.91 0.00 3.20 0.00 0.00 3.23 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 136 F 8.29 4.77 0.00 2.87 2.79 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 T 8.83 3.80 4.40 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 1.21 0.00 0.00 138 K 9.04 3.99 0.00 1.76 1.85 0.00 1.80 0.00 0.00 1.74 0.00 0.00 2.88 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.12 7.81 139 E 8.26 4.11 0.00 2.02 1.96 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 2.36 2.40 0.00 140 N 8.33 4.23 0.00 2.98 2.79 0.00 0.00 6.60 8.40 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 0.00 141 V 7.75 3.43 2.11 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 1.20 0.00 0.00 0.95 0.00 0.00 142 R 8.20 3.92 0.00 2.14 1.96 0.00 3.18 0.00 0.00 3.17 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.77 0.00 143 I 7.73 3.78 1.81 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.82 0.93 0.00 0.00 144 L 7.88 3.82 0.00 0.62 0.13 0.10 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 145 E 8.12 4.47 0.00 2.38 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 0.00 2.76 2.62 0.00 146 S 8.32 4.21 0.00 4.11 4.32 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 0.00 147 W 8.55 4.03 0.00 3.47 3.58 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 0.00 148 F 8.76 3.82 0.00 3.58 3.16 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 0.00 149 A 8.60 4.29 1.43 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 0.00 0.00 0.00 0.00 0.00 0.00 150 K 8.09 3.98 0.00 1.86 1.76 0.00 1.75 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.39 1.36 7.81 151 N 7.53 4.95 0.00 1.53 1.97 0.00 0.00 6.85 6.62 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 0.00 152 I 7.31 3.51 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.49 0.96 0.00 0.00 153 E 7.93 4.06 0.00 2.04 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 2.19 2.19 0.00 154 N 7.05 4.79 0.00 2.78 2.73 0.00 0.00 7.21 7.57 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 0.00 155 P 0.00 4.19 0.00 1.24 1.17 0.00 3.52 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 1.33 0.00 156 Y 7.54 4.82 0.00 3.01 2.92 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 0.00 0.00 0.00 157 L 8.73 4.27 0.00 1.64 1.49 0.84 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 158 D 8.25 5.13 0.00 2.88 2.85 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 0.00 159 T 8.42 3.81 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 0.00 160 K 8.25 4.10 0.00 1.78 1.86 0.00 1.82 0.00 0.00 1.82 0.00 0.00 2.96 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.08 7.81 161 G 8.39 4.11 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 0.00 162 L 8.25 3.81 0.00 1.65 1.62 0.89 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 163 E 8.03 3.97 0.00 2.22 1.97 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 2.48 0.00 164 N 7.96 4.51 0.00 2.73 2.86 0.00 0.00 7.25 7.38 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 0.00 165 L 7.65 4.05 0.00 1.68 1.53 0.26 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 166 M 8.51 4.00 0.00 2.00 2.11 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.50 0.00 167 K 8.36 4.17 0.00 1.85 1.71 0.00 1.84 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.39 1.35 7.81 168 N 7.84 5.04 0.00 2.70 2.82 0.00 0.00 6.77 7.65 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 0.00 169 T 7.06 4.67 4.08 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 1.10 0.00 0.00 170 S 8.48 4.15 0.00 3.91 3.93 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 0.00 171 L 7.26 4.50 0.00 1.44 1.42 -0.28 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 172 S 9.79 3.99 0.00 3.91 3.97 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 0.00 173 R 7.87 3.39 0.00 1.90 1.99 0.00 3.16 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 174 I 7.66 3.76 1.88 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 1.64 0.82 0.97 0.00 0.00 175 Q 8.64 4.13 0.00 2.09 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.44 2.39 0.00 176 I 7.65 3.84 1.81 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.46 0.80 0.00 0.00 177 K 8.24 4.03 0.00 1.97 1.90 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.47 1.65 7.81 178 N 8.75 4.55 0.00 2.94 2.95 0.00 0.00 6.63 7.38 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 0.00 179 W 8.42 4.07 0.00 3.61 3.35 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 0.00 180 V 8.06 4.01 2.21 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 1.09 0.00 0.00 1.17 0.00 0.00 181 S 7.94 4.24 0.00 4.01 3.88 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 0.00 182 N 8.00 4.17 0.00 2.85 2.66 0.00 0.00 6.76 7.66 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 0.00 183 R 8.02 3.28 0.00 0.69 1.79 0.00 2.21 0.00 0.00 2.56 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.50 0.00 184 R 7.77 4.12 0.00 2.03 2.00 0.00 2.93 0.00 0.00 2.64 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 2.05 0.00 185 R 7.85 4.00 0.00 1.87 1.92 0.00 3.14 0.00 0.00 3.24 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.68 0.00 186 K 7.85 3.76 0.00 1.67 1.69 0.00 1.53 0.00 0.00 1.34 0.00 0.00 2.80 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.29 1.32 7.81 187 E 7.86 4.10 0.00 1.89 2.21 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 2.54 2.45 0.00 188 K 7.63 4.29 0.00 2.08 1.77 0.00 1.82 0.00 0.00 1.71 0.00 0.00 3.07 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.46 1.50 7.81 189 T 8.16 4.19 4.20 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 1.19 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.