NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 21 K 4.2527 8.3149 121.7871 56.1243 33.1646 174.8093 22 K 4.5886 8.2745 124.7228 53.8393 36.0422 176.1989 23 Q 4.2894 8.4100 121.2717 55.9092 30.0745 177.2257 24 V 4.1861 7.8362 118.5338 61.8343 32.2450 174.5656 25 T 3.6252 7.5645 118.5418 59.2090 68.5845 172.1068 26 N 4.9251 8.3721 125.8178 50.8597 40.1382 172.9430 27 P 4.3357 0.0000 0.0000 62.7825 32.4376 175.4626 28 I 4.3429 8.3356 125.6461 60.8267 38.9958 174.0244 29 D 4.4038 8.6545 126.6722 53.2848 42.3998 176.0947 30 E 3.4635 8.8767 115.4952 57.2031 29.3425 174.3288 31 K 4.0407 8.6926 115.7282 59.8134 32.8483 178.4629 32 N 4.1924 8.6743 115.5222 55.8211 38.5140 176.4459 33 G 3.8778 8.2214 103.0181 46.1367 0.0000 172.9382 34 T 4.7498 7.6857 115.6979 61.7071 71.3005 174.0691 35 S 5.1056 8.2715 119.7549 55.9340 63.8903 173.5184 36 N 4.2941 8.8334 123.8442 54.7798 38.9290 173.9541 37 C 4.8125 9.0076 121.2352 59.4821 30.3027 173.0971 38 I 4.9247 7.7330 120.0532 59.5356 38.4690 175.4296 39 V 4.3662 8.0317 124.9309 61.1226 35.0017 173.8122 40 R 4.1080 8.4762 128.6329 55.6385 31.1855 175.9053 41 V 4.2676 8.6611 125.7332 59.1801 33.9555 172.8477 42 P 5.1025 0.0000 0.0000 61.8613 31.9956 176.1486 43 I 4.8442 8.7565 116.7334 59.0930 41.5003 173.7339 44 A 5.4337 8.7698 124.9861 50.1763 21.5672 175.5365 45 L 4.8891 9.2302 121.6296 54.2159 44.5123 175.3144 46 Y 4.2432 8.3118 122.8273 56.1579 38.6736 174.9400 47 V 3.9722 7.9039 126.2704 60.3715 34.2093 175.5274 48 S 4.7719 8.2210 117.9643 56.2596 60.4611 173.0576 49 L 4.1203 8.0396 125.3820 55.0247 42.9349 175.6525 50 A 4.6924 8.4550 125.1560 49.0292 21.0319 176.8458 51 P 4.1350 0.0000 0.0000 63.1761 30.8125 177.2145 *53 Y 4.5618 7.9201 113.4903 58.6044 39.4164 175.4772 54 L 4.1579 7.7009 120.8621 55.3909 42.2147 177.6085 55 E 3.8459 9.0962 118.5378 56.7323 28.9344 173.9682 56 N 4.7435 7.4318 110.6279 52.3030 41.3019 173.0596 57 P 4.4864 0.0000 0.0000 65.2147 31.9414 177.9270 58 L 3.8807 7.9899 120.3672 58.6775 41.7833 178.6864 59 Q 4.0606 7.9777 116.1540 57.6997 28.7775 178.6436 60 G 2.8108 6.9989 106.5362 47.0222 0.0000 177.1070 61 V 3.6966 7.9434 123.4242 61.7017 29.0174 176.5786 *63 K 4.3065 7.5711 114.2011 56.0390 33.6453 175.3340 64 Q 4.3853 8.3319 117.4135 55.0505 30.5294 174.5090 65 H 4.8552 7.4621 112.6400 57.1206 32.5218 176.8741 66 L 3.9826 7.5154 108.5198 55.9765 42.0568 178.6997 67 N 4.3984 9.8664 124.6908 57.6580 39.0837 173.3648 68 P 4.3895 0.0000 0.0000 65.0075 31.5726 176.8188 69 L 4.6734 8.3402 115.5742 55.1574 44.3864 177.7302 70 V 4.3462 8.3034 120.4323 62.0311 30.0929 175.8433 *72 K 4.3173 7.5981 119.4567 56.3397 34.1857 176.6088 73 Y 4.4901 8.8493 125.1627 57.8044 39.7635 174.1996 74 N 5.1647 8.4200 123.8382 52.1035 42.2159 174.7772 75 N 4.7067 8.8514 120.8410 55.3761 39.6932 177.9538 76 K 4.0577 8.7696 117.7622 59.3121 32.0811 178.4057 77 V 3.8491 7.9812 108.5387 60.5061 32.5827 175.6982 78 G 3.7167 7.2130 107.1069 44.7987 0.0000 172.1846 79 G 3.4956 5.8871 105.9558 45.2159 0.0000 170.3116 80 V 4.2652 7.9440 119.8694 62.3702 32.8452 175.8815 81 V 4.4707 8.3008 128.6336 61.9419 31.0962 176.2985 82 L 4.0965 9.1802 129.6829 55.7243 42.3934 178.1783 83 G 3.8522 7.1912 104.4609 45.9227 0.0000 170.2614 84 Y 5.4397 7.0341 116.3418 55.7013 41.3853 173.6274 85 E 4.6507 9.0600 120.1818 55.8982 32.9057 175.0602 86 G 3.9154 8.8942 111.5619 46.1592 0.0000 173.7228 87 L 4.0158 8.3362 121.1963 54.9426 42.5963 175.9410 88 K 4.4625 9.4342 127.2446 54.5097 33.4707 176.1275 89 I 3.9822 8.4503 127.9468 63.6234 38.2750 177.9356 90 L 3.9251 8.0058 119.9006 57.2495 41.8071 178.8492 91 D 4.7456 8.2619 121.1088 52.9533 40.2447 176.0096 92 A 4.3538 10.2500 116.1943 51.9099 23.5062 177.1148 93 D 4.7210 7.6053 117.9600 53.6253 42.6388 174.6663 94 P 4.6019 0.0000 0.0000 63.5986 31.8758 176.8311 95 L 4.4546 7.6973 116.1945 56.4704 43.9488 177.6972 *114 G 3.6626 7.8859 104.1651 45.3343 0.0000 171.4700 115 F 5.2841 7.3664 116.4352 55.7891 42.6852 174.2180 116 T 4.3810 7.7412 112.1888 62.1118 71.2497 171.6715 117 W 5.4851 9.0256 124.7389 55.7082 31.8207 174.8631 118 C 5.0068 8.8485 115.1143 57.9750 33.2160 172.0396 119 H 5.4864 9.4936 119.3851 54.6320 33.0358 172.3859 120 V 4.7581 8.5897 123.3497 60.6739 35.6456 173.1717 121 N 5.1693 8.9626 118.7410 51.6008 40.5307 174.2862 122 L 4.7924 8.4437 124.1945 54.4177 43.8037 175.6337 123 Y 4.6654 8.7705 119.4613 56.2274 40.7698 175.0870 124 V 4.9240 8.4508 123.1062 60.6705 35.1173 174.1546 125 W 4.4266 9.2946 135.0000 56.9523 31.2610 175.8702 126 Q 4.5063 7.8486 131.0920 54.1902 27.2102 173.9073 127 P 3.9077 0.0000 0.0000 62.7901 32.7516 176.1439 128 Q 4.5538 8.5076 118.8851 53.4189 32.6423 175.0524 129 V 3.6997 8.0733 119.1859 64.6700 31.8615 176.5580 130 G 3.9797 8.9076 115.0096 45.2396 0.0000 173.5694 131 D 4.4231 7.6614 119.5685 54.2430 42.5501 176.0930 132 V 4.2902 8.2835 122.6175 61.7975 32.3740 175.1143 133 L 4.6317 7.6413 128.5861 53.1842 44.4512 175.0963 134 E 5.0438 8.2959 117.5037 55.2585 33.4635 175.7351 135 G 4.3127 9.0173 107.9993 45.3190 0.0000 172.0456 136 Y 5.1871 8.7775 120.1495 57.3035 39.9123 175.0460 137 I 4.5527 8.7337 123.7573 61.3185 37.6684 175.4238 138 F 5.3065 8.4740 131.6491 57.0265 42.2627 174.1017 139 I 3.5571 6.6052 110.2318 60.1150 38.1543 174.5300 140 Q 5.0675 8.7459 124.8264 54.2741 31.5020 174.7902 141 S 4.4322 8.9642 112.2858 57.5126 66.1850 176.5508 142 A 2.0000 5.8000 125.2331 53.5235 19.4231 177.7164 143 S 4.5741 7.8060 109.7862 57.8734 64.5380 169.9196 144 H 4.5887 9.0225 130.5570 57.0549 27.6738 172.6893 145 I 4.2395 7.6043 127.4860 60.3278 38.4977 175.6761 146 G 4.4086 8.7990 114.3383 45.3244 0.0000 172.4148 147 L 5.5978 9.1743 120.4032 52.9730 47.1619 175.5565 148 L 5.0052 8.9044 119.3828 53.2926 45.3620 175.9332 149 I 4.2948 8.9360 126.1824 61.0334 38.6935 176.2380 150 H 4.1472 8.9407 123.7719 57.6029 26.1887 173.7813 151 D 4.4753 8.5513 112.8297 54.6724 39.7290 173.4769 152 A 4.3060 8.0647 117.8051 51.3584 23.6358 177.1767 153 F 5.0130 7.4349 114.6313 55.5095 41.7200 175.3428 154 N 5.0153 9.0761 121.0622 53.6843 39.5163 173.9288 155 A 5.4211 8.7722 124.8540 50.5509 23.5985 174.6836 156 S 4.8840 8.2504 110.2581 57.4613 66.9637 174.6702 157 I 4.7434 7.8685 116.7190 58.9069 39.8443 175.8142 158 K 4.5065 8.4442 125.0304 55.3942 33.2796 177.7507 159 K 3.8568 8.7782 121.1861 59.9753 32.2236 178.2995 160 N 4.2508 8.3852 114.3215 56.7457 38.4659 175.6521 161 N 4.5610 7.9460 112.7542 53.6680 38.8742 174.4140 162 I 3.9204 7.8258 121.1358 59.9415 38.1022 176.3923 163 P 3.6167 0.0000 0.0000 63.4656 31.5207 178.2416 164 V 3.7489 7.7713 116.4164 61.4073 31.5523 171.5470 165 D 5.0381 7.7024 117.7190 52.9644 40.5908 175.6990 166 W 5.2096 8.3320 119.3002 56.6649 30.5224 175.7023 167 T 4.7703 9.7296 121.1278 61.7399 71.5605 172.8267 168 F 4.5365 8.5765 128.0588 56.5107 40.3988 174.8554 169 V 4.2305 7.3987 124.7924 60.0598 34.9623 173.8433 170 H 4.8555 8.3909 117.0058 53.9290 31.5686 173.3454 171 N 4.6687 8.1453 118.7330 52.4926 39.7805 174.4972 172 D 4.2394 8.5904 126.2447 55.7402 38.1320 175.0065 *210 G 3.7883 8.1150 104.0555 44.9844 0.0000 172.8268 211 N 5.0503 7.4894 114.9285 49.9249 40.1119 175.4929 212 R 4.1918 8.2411 115.7121 57.7178 30.0630 177.0211 213 S 4.0167 8.6772 113.5794 59.6434 60.1921 172.8094 214 L 4.4180 7.2819 115.7334 54.5812 44.2573 174.8092 215 G 3.5030 8.2847 108.3634 45.8132 0.0000 174.2320 216 H 4.9653 8.0442 117.9540 55.2742 29.6337 174.3883 217 W 3.8098 8.0870 114.0466 58.8256 25.7444 172.7487 218 V 4.5737 8.4128 123.5677 60.9727 33.0982 175.0041 219 D 4.4247 7.8187 125.9828 52.5808 40.8389 176.6705 220 S 4.5920 8.6230 111.7564 61.5618 61.7737 176.2535 221 N 4.3414 8.4983 117.7116 55.5708 39.0469 175.7689 222 G 4.3049 7.5015 105.9647 46.7034 0.0000 173.6954 223 E 4.6423 8.6406 117.7515 53.3710 33.0205 174.5742 224 P 4.4889 0.0000 0.0000 63.2377 32.0889 175.6360 225 I 2.6868 8.0995 122.7210 59.3133 37.8604 173.1619 226 D 3.6562 8.5696 123.3270 56.7746 41.0581 176.8527 227 G 4.3470 8.3951 114.6979 45.3666 0.0000 172.6348 228 K 5.0467 10.3300 121.7575 54.5110 34.4026 175.6250 229 L 4.8740 9.4983 128.2569 53.2473 44.3350 175.4520 230 R 4.9907 8.5638 123.0380 54.9928 31.4042 175.2274 231 F 5.1139 8.3900 119.6490 56.0112 41.7793 172.8746 232 T 4.8361 8.3914 111.2080 60.0469 70.8758 174.2661 233 V 3.9600 9.1389 126.2863 63.4143 32.2670 176.0066 234 R 4.5365 8.6356 126.3311 55.8293 32.0160 174.9058 235 N 4.2214 7.4982 113.5947 53.4019 42.2871 173.0001 236 V 4.3181 8.5182 126.0788 61.7041 33.3726 175.1584 237 H 4.6433 9.1824 127.7760 55.0223 28.7174 174.0930 238 T 4.0387 7.9608 119.8186 62.8652 69.3262 174.4935 239 T 3.8682 8.7206 115.4052 61.9527 68.5080 171.3865 240 G 4.0000 8.3098 117.6975 45.7263 0.0000 175.7675 241 R 4.4921 7.7535 122.7675 54.5504 33.2355 175.6960 242 V 3.5277 7.9844 117.0450 61.0868 32.6880 176.7695 243 V 4.1676 8.3654 126.1782 61.6779 32.8329 175.3054 244 S 4.9326 8.7353 116.8637 56.6498 65.4789 172.8497 245 V 4.3689 9.2123 128.6517 62.5424 32.9236 174.0925 246 D 4.9028 9.7586 128.9998 53.1706 42.4619 175.1802 247 G 4.5575 8.1766 114.3104 45.0537 0.0000 171.0807 248 T 4.6196 8.2542 112.5693 60.7626 70.9404 174.1799 249 L 4.6623 8.2123 127.9882 54.5513 42.3983 177.0139 250 I 3.7252 7.1455 119.0068 61.1114 37.1625 175.2765 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 21 K 8.31 4.25 0.00 1.72 1.79 0.00 1.67 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.31 1.46 7.81 22 K 8.27 4.59 0.00 1.80 1.64 0.00 1.79 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.31 1.51 7.81 23 Q 8.41 4.29 0.00 2.00 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 7.07 0.00 0.00 0.00 0.00 0.00 2.33 2.25 0.00 24 V 7.84 4.19 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.76 0.00 0.00 0.89 0.00 0.00 25 T 7.56 3.63 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 1.18 0.00 0.00 26 N 8.37 4.93 0.00 2.75 2.94 0.00 0.00 7.02 8.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 P 0.00 4.34 0.00 2.22 2.17 0.00 3.64 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.94 0.00 28 I 8.34 4.34 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 1.38 0.89 0.88 0.00 0.00 29 D 8.65 4.40 0.00 2.63 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.88 3.46 0.00 2.20 1.99 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 2.19 2.33 0.00 31 K 8.69 4.04 0.00 1.74 1.87 0.00 1.83 0.00 0.00 1.71 0.00 0.00 3.04 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.47 7.81 32 N 8.67 4.19 0.00 3.19 2.91 0.00 0.00 6.94 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 33 G 8.22 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 0.00 0.00 0.00 34 T 7.69 4.75 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 35 S 8.27 5.11 0.00 3.99 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 N 8.83 4.29 0.00 2.77 2.80 0.00 0.00 7.06 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 37 C 9.01 4.81 0.00 2.44 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 38 I 7.73 4.92 1.99 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.58 1.07 0.00 0.00 39 V 8.03 4.37 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 0.90 0.00 0.00 0.93 0.00 0.00 40 R 8.48 4.11 0.00 1.40 1.58 0.00 3.04 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.86 0.00 41 V 8.66 4.27 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 0.00 0.00 0.89 0.00 0.00 42 P 0.00 5.10 0.00 1.99 2.15 0.00 3.64 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.09 0.00 43 I 8.76 4.84 1.90 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.93 0.94 0.00 0.00 44 A 8.77 5.43 1.38 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 0.00 0.00 0.00 0.00 0.00 0.00 45 L 9.23 4.89 0.00 1.71 1.78 0.84 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 46 Y 8.31 4.24 0.00 1.43 2.29 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 47 V 7.90 3.97 1.95 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 0.60 0.00 0.00 0.82 0.00 0.00 48 S 8.22 4.77 0.00 4.12 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 49 L 8.04 4.12 0.00 1.55 1.59 0.89 1.20 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 50 A 8.46 4.69 1.40 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 0.00 0.00 0.00 51 P 0.00 4.13 0.00 2.16 2.23 0.00 3.67 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 *53 Y 7.92 4.56 0.00 3.17 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.70 4.16 0.00 1.82 1.60 0.93 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 55 E 9.10 3.85 0.00 2.11 2.07 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 2.20 2.29 0.00 56 N 7.43 4.74 0.00 2.66 2.75 0.00 0.00 7.14 8.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.49 0.00 2.32 2.32 0.00 3.80 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.05 0.00 58 L 7.99 3.88 0.00 1.79 1.72 0.95 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 59 Q 7.98 4.06 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.85 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 60 G 7.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.94 3.70 1.99 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 0.89 0.00 0.00 0.92 0.00 0.00 *63 K 7.57 4.31 0.00 1.55 1.75 0.00 1.98 0.00 0.00 1.88 0.00 0.00 3.14 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.45 7.81 64 Q 8.33 4.39 0.00 1.78 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.18 6.54 0.00 0.00 0.00 0.00 0.00 2.10 2.20 0.00 65 H 7.46 4.86 0.00 2.86 2.74 0.00 5.71 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 7.52 3.98 0.00 1.79 1.03 1.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 67 N 9.87 4.40 0.00 2.70 2.90 0.00 0.00 6.85 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 P 0.00 4.39 0.00 2.34 2.12 0.00 3.73 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.18 0.00 69 L 8.34 4.67 0.00 1.81 1.76 1.08 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 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0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.94 4.27 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 1.09 0.00 0.00 81 V 8.30 4.47 2.37 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 1.06 0.00 0.00 0.96 0.00 0.00 82 L 9.18 4.10 0.00 1.72 1.80 1.09 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 83 G 7.19 3.85 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 0.00 0.00 0.00 84 Y 7.03 5.44 0.00 3.00 2.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 E 9.06 4.65 0.00 1.99 1.99 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 2.27 2.24 0.00 86 G 8.89 3.92 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 0.00 0.00 0.00 87 L 8.34 4.02 0.00 1.70 1.69 0.94 0.62 0.00 0.00 0.00 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0.00 0.00 0.00 0.00 0.00 *114 G 7.89 3.66 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 F 7.37 5.28 0.00 2.93 2.30 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 0.00 116 T 7.74 4.38 4.33 0.00 0.00 0.00 0.00 0.00 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 0.00 117 W 9.03 5.49 0.00 3.40 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 0.00 118 C 8.85 5.01 0.00 3.15 3.07 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 0.00 119 H 9.49 5.49 0.00 3.25 3.19 0.00 5.77 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 V 8.59 4.76 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.59 0.00 0.00 1.04 0.00 0.00 121 N 8.96 5.17 0.00 2.97 2.82 0.00 0.00 7.40 6.44 0.00 0.00 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 L 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2.35 0.00 0.00 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 1.27 0.00 164 V 7.77 3.75 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.00 0.00 0.96 0.00 0.00 165 D 7.70 5.04 0.00 2.95 2.97 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 0.00 166 W 8.33 5.21 0.00 3.31 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 167 T 9.73 4.77 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 1.22 0.00 0.00 168 F 8.58 4.54 0.00 1.51 2.37 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 0.00 169 V 7.40 4.23 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.78 0.00 0.00 170 H 8.39 4.86 0.00 2.86 3.31 0.00 5.88 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 171 N 8.15 4.67 0.00 2.75 2.69 0.00 0.00 7.19 8.35 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 0.00 172 D 8.59 4.24 0.00 2.97 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 *210 G 8.11 3.79 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 0.00 0.00 0.00 211 N 7.49 5.05 0.00 2.83 2.75 0.00 0.00 6.84 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 212 R 8.24 4.19 0.00 2.05 2.19 0.00 3.12 0.00 0.00 3.35 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 213 S 8.68 4.02 0.00 4.03 3.98 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 0.00 0.00 0.00 214 L 7.28 4.42 0.00 2.06 1.57 1.01 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 215 G 8.28 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 216 H 8.04 4.97 0.00 3.26 3.31 0.00 5.67 0.00 0.00 0.00 0.00 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 217 W 8.09 3.81 0.00 3.93 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 218 V 8.41 4.57 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.00 0.00 0.85 0.00 0.00 219 D 7.82 4.42 0.00 2.71 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 220 S 8.62 4.59 0.00 4.04 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 221 N 8.50 4.34 0.00 2.87 2.95 0.00 0.00 7.09 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 0.00 222 G 7.50 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 0.00 0.00 0.00 0.00 223 E 8.64 4.64 0.00 2.04 1.77 0.00 0.00 0.00 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 2.37 0.00 224 P 0.00 4.49 0.00 1.93 2.07 0.00 3.69 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 225 I 8.10 2.69 1.96 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.58 1.02 0.00 0.00 226 D 8.57 3.66 0.00 2.76 2.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 227 G 8.40 4.35 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 0.00 0.00 0.00 228 K 10.33 5.05 0.00 1.91 1.74 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.51 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.22 1.02 7.81 229 L 9.50 4.87 0.00 1.80 1.74 1.04 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 230 R 8.56 4.99 0.00 1.82 1.88 0.00 3.26 0.00 0.00 3.22 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 231 F 8.39 5.11 0.00 3.27 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 232 T 8.39 4.84 4.23 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 0.00 0.00 0.00 1.20 0.00 0.00 233 V 9.14 3.96 2.20 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 1.00 0.00 0.00 0.99 0.00 0.00 234 R 8.64 4.54 0.00 1.82 2.04 0.00 3.36 0.00 0.00 3.14 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.52 0.00 235 N 7.50 4.22 0.00 2.72 2.48 0.00 0.00 6.67 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 236 V 8.52 4.32 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 0.00 0.00 0.96 0.00 0.00 237 H 9.18 4.64 0.00 3.23 3.22 0.00 5.66 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 238 T 7.96 4.04 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.37 0.00 0.00 239 T 8.72 3.87 4.21 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 0.00 0.00 1.24 0.00 0.00 240 G 8.31 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 241 R 7.75 4.49 0.00 1.85 1.96 0.00 3.45 0.00 0.00 3.19 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 242 V 7.98 3.53 2.17 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 0.97 0.00 0.00 1.01 0.00 0.00 243 V 8.37 4.17 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 1.03 0.00 0.00 244 S 8.74 4.93 0.00 3.99 3.79 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 0.00 245 V 9.21 4.37 2.33 0.00 0.00 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 1.14 0.00 0.00 246 D 9.76 4.90 0.00 2.83 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 247 G 8.18 4.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 248 T 8.25 4.62 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 249 L 8.21 4.66 0.00 1.39 1.36 1.02 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 250 I 7.15 3.73 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 1.13 0.49 0.86 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.