NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 24 L 4.5925 8.1693 120.6452 54.7967 43.8422 175.4677 *26 R 4.3464 7.1548 120.4351 56.0444 33.6419 177.2187 27 H 4.3902 8.6317 119.5471 55.9908 30.1308 174.8280 28 W 5.5573 8.2215 124.1764 55.5836 33.6957 174.1705 29 H 4.8761 9.3698 117.8062 54.3660 32.6047 172.8998 30 T 4.7044 8.6218 119.1308 63.6041 68.8629 174.2025 31 V 4.3179 9.1761 125.9993 63.7698 34.3989 175.6120 32 V 4.9778 7.5140 118.6391 61.0334 35.1257 174.0345 33 L 5.3238 9.1084 126.6159 53.0438 45.3600 175.3634 34 A 4.7502 8.5844 123.0199 50.5663 22.6329 175.0445 35 S 4.9645 8.0670 115.0592 56.8094 65.3115 174.5822 36 S 3.6892 8.5945 120.1619 60.1249 63.7810 173.5121 37 D 4.7243 8.1170 120.1415 51.7387 41.7893 175.4783 38 R 3.8671 8.7327 128.1147 59.3589 29.8366 178.7497 39 S 4.5269 8.1177 111.0514 60.3893 63.2658 176.3986 40 L 4.0075 8.2696 121.8158 56.7135 41.3803 178.1943 41 I 4.3409 7.4561 109.0556 60.3269 38.1620 175.3241 42 E 4.3560 7.7158 121.7068 55.0365 30.7236 175.2532 43 E 3.8852 8.4466 118.8231 58.5908 29.6466 178.1023 44 E 3.8744 9.0017 120.2843 56.4215 27.8925 175.1156 45 G 3.8051 7.8535 108.5893 43.8054 0.0000 173.4190 46 P 3.9552 0.0000 0.0000 64.5716 31.3146 177.3672 47 F 4.2501 8.0971 114.8147 57.0868 39.3068 176.9430 48 R 4.0566 7.3760 123.8830 54.7330 28.1106 174.7613 49 N 4.6254 7.1728 116.5754 50.6770 42.6992 174.4280 50 F 4.7959 8.4569 120.8624 55.4066 41.1688 175.0340 51 I 3.1169 8.4044 125.3788 61.3826 37.9641 175.0712 52 Q 4.2145 8.3692 126.4205 57.0188 31.5900 175.0573 53 N 5.3066 7.3532 115.0211 52.3204 42.8199 173.0926 54 I 4.9243 8.6757 124.7351 59.8802 40.4506 174.9052 55 T 4.6317 8.8885 123.9710 61.6285 71.4308 173.3484 56 V 4.4808 8.3985 126.3089 61.8720 33.0023 175.0226 57 E 4.4051 9.0364 128.4275 55.5343 31.7225 175.1185 58 S 3.8488 9.8105 124.1909 59.7278 60.4177 173.9245 59 G 4.0660 8.4909 107.5316 45.5971 0.0000 173.9272 60 N 4.9750 8.1319 117.6150 52.4430 40.9853 174.1905 61 L 4.7374 8.3596 120.9614 53.3170 43.9923 175.7884 62 N 4.9831 9.5537 124.0457 51.8988 39.7318 174.4840 63 G 4.1151 9.0147 112.5246 44.5111 0.0000 171.1570 64 F 5.2586 8.6899 125.5998 56.3057 41.8327 174.1049 65 F 4.9334 9.2632 124.4911 55.4728 43.0250 174.0878 66 L 5.2158 8.5526 118.9242 53.4302 45.0075 176.1835 67 T 4.8416 9.0069 118.3479 61.7183 72.7034 172.9436 68 R 4.7774 8.7171 126.0472 55.3767 31.1417 175.6455 69 K 4.4381 9.3840 127.6077 56.4095 35.7852 175.4743 70 N 4.1094 9.8896 124.0566 54.4692 35.9636 175.3834 71 G 3.9583 8.1682 102.8630 45.8702 0.0000 173.0474 72 Q 4.7180 8.0108 118.8999 54.2892 32.2628 174.3161 73 C 5.1785 8.7127 119.0531 56.0390 38.4880 173.0910 74 I 4.6726 8.9875 126.0479 58.7187 39.2758 174.0594 75 P 4.9413 0.0000 0.0000 62.7293 32.4855 175.9049 76 L 4.6063 8.9875 125.0422 53.9294 45.1561 174.3020 77 Y 5.3593 8.8469 124.3261 56.3916 39.8917 175.4622 78 L 4.9030 9.0438 123.2843 53.3175 46.5352 175.3655 79 T 4.8291 8.6029 118.8307 61.6964 70.7324 173.4590 80 A 4.6513 8.6022 129.4777 50.5619 20.4888 176.1781 81 F 5.0471 9.2795 122.6684 57.0090 40.4755 176.1248 82 K 4.6467 9.3169 122.6693 57.6229 33.5483 175.6780 83 T 4.6337 7.8198 111.8724 60.7191 71.9392 174.5521 84 E 4.2883 8.8875 119.5375 57.0286 29.4527 172.5304 85 E 4.5861 8.0492 115.7954 54.9997 32.9115 179.8318 86 A 3.9298 8.7400 128.4144 54.0550 18.6436 178.2408 87 R 4.6161 7.9401 109.4317 55.7437 29.9464 174.4926 88 Q 4.7091 7.4387 119.7395 54.6789 31.1006 174.5868 89 F 5.2138 9.0837 123.4625 55.8977 44.3776 173.3501 90 K 5.2394 9.4475 119.5236 54.7509 35.2866 175.3939 91 L 5.1049 9.1530 125.7522 53.5859 45.7835 174.7725 92 N 5.3324 9.0566 123.9344 52.8276 39.2195 174.0701 93 Y 4.4642 9.0212 121.7636 58.1571 42.6606 173.5086 94 Y 3.3619 9.3173 128.8214 58.7710 38.5783 169.8657 95 G 4.1329 8.0272 107.0971 44.2970 0.0000 174.0821 96 T 5.3786 9.1524 113.8532 60.0650 72.5882 172.5335 97 N 5.5828 9.3230 118.6969 52.1477 43.7393 173.1232 98 D 5.2190 9.0895 123.0724 52.9441 43.1344 175.4887 99 V 4.7281 8.9439 124.0213 61.2210 34.3698 173.8067 100 Y 5.2910 8.9991 124.7835 56.4256 41.3260 173.7157 101 Y 4.7867 8.9797 125.2414 56.1467 40.6627 174.6412 102 E 4.2255 7.7598 124.5384 54.5206 34.6459 174.2444 103 S 4.5366 7.6051 113.9706 58.0650 64.7248 176.7567 104 S 4.5173 9.0148 121.6397 58.9890 64.1899 174.7976 105 K 4.6471 7.3946 120.1436 53.8465 32.7107 174.7500 106 P 4.3057 0.0000 0.0000 65.4304 31.8768 177.1228 107 N 4.7617 8.1297 113.1522 53.9748 39.5145 174.6479 108 E 4.7777 8.6241 116.8469 58.7385 31.1313 175.4307 109 Y 5.5337 7.7325 113.9887 56.1530 41.4943 174.0768 110 A 4.3654 8.9446 120.7450 49.9549 22.8072 174.8831 111 K 4.7791 8.3975 123.2390 54.4338 35.3192 174.7618 112 F 5.1802 8.9215 125.5002 55.7344 42.5197 173.8162 113 I 4.8278 8.9615 125.1162 59.5979 39.5070 174.5165 114 F 4.9380 9.5297 126.5857 56.0587 41.3311 174.5878 115 Y 4.7512 8.9601 123.3403 56.6548 38.8648 174.0971 116 N 5.0950 8.8882 124.5429 52.5827 41.2160 173.3840 117 Y 5.2257 8.9640 123.9889 56.7023 40.7494 174.2654 118 H 4.7005 9.1863 125.3951 54.2550 32.8109 173.3066 119 D 4.4034 9.5185 127.4452 55.5356 38.1990 174.8696 120 G 3.9084 8.5583 106.1941 46.2239 0.0000 174.2763 121 K 4.6794 7.9868 121.4802 52.4351 34.2294 179.6749 122 V 5.1287 8.3035 122.4751 60.9865 33.3446 174.5812 123 N 5.3014 9.0880 123.5284 51.6348 43.7590 173.4093 124 V 4.6629 8.7444 121.3940 59.9058 34.3456 174.6729 125 V 4.5545 8.7073 124.3167 61.0032 34.2453 173.6755 126 A 5.2453 8.9270 130.7271 50.4140 21.4147 174.9934 127 N 5.4026 9.5484 119.5643 51.1858 42.3026 173.2749 128 L 4.5622 8.4519 125.2702 53.2598 44.4074 174.9016 129 F 5.7677 9.2708 125.8316 56.0250 41.7496 175.2149 130 G 4.8314 9.4982 108.8975 44.4530 0.0000 174.1488 131 R 3.9308 9.0697 119.2081 58.1362 30.5846 176.4724 132 T 4.6732 7.5173 106.4781 58.6086 71.6351 172.6254 133 P 4.2136 0.0000 0.0000 64.7006 31.3343 175.6281 134 N 5.0348 7.5233 114.1536 51.6457 42.2603 172.6058 135 L 4.8849 7.9624 119.0227 51.5494 46.0316 176.9979 136 S 4.1256 8.6295 113.7310 59.2330 63.7815 175.1380 137 N 4.3351 8.7953 125.2462 56.4006 38.4061 177.2008 138 E 3.9144 8.1143 120.1288 59.3602 29.8042 178.8488 139 I 3.5286 7.4872 119.3721 64.2917 37.0754 178.6175 140 K 3.9674 8.0268 119.3022 59.2576 31.7843 179.3382 141 K 3.9492 8.3997 120.2862 59.5132 32.1356 178.7957 142 R 4.0359 7.9440 118.9238 59.3134 30.0918 178.2219 143 F 4.0741 8.2396 120.3910 61.4940 39.4533 177.0186 144 E 3.9973 8.7320 118.8483 59.3016 29.1987 179.1544 145 E 4.1011 8.6519 118.0541 59.1997 29.5970 178.8464 146 D 4.3163 7.8775 119.3574 57.1090 41.2751 178.1931 147 F 4.1565 7.9426 120.8231 61.5949 39.4302 177.1767 148 M 4.2944 8.2211 118.3530 58.3672 31.5670 178.0586 149 N 4.5040 8.3660 115.1479 54.8853 38.6277 175.6455 150 R 4.2747 7.4333 118.5756 55.7098 30.2911 176.3216 151 G 3.4720 7.9430 105.1277 46.5380 0.0000 173.9587 152 F 4.9699 7.4320 116.1273 54.8273 42.2294 175.9347 153 R 4.2337 8.4860 122.5158 56.0374 30.8255 178.2674 154 R 4.2815 8.6569 119.7800 59.0734 30.3793 178.7029 155 E 3.9748 8.3049 117.8395 59.1271 29.8811 176.9132 156 N 4.7506 8.8024 114.9741 53.2836 38.7064 173.7376 157 I 4.6855 7.6599 120.1361 59.3736 39.5289 175.1060 158 L 4.5707 9.3492 128.0063 52.9005 44.0557 175.5447 159 D 5.0222 8.7746 125.5354 53.2784 41.5062 175.6856 160 I 4.3523 8.6050 119.8767 60.5049 38.1806 177.6478 161 S 4.3320 8.3958 117.1082 60.7778 62.5583 175.1415 162 E 4.3877 8.0103 116.7742 55.8122 29.9607 175.7750 163 V 3.9090 7.3830 120.0260 61.5173 32.3568 174.9422 164 D 4.3277 8.5627 127.0009 54.3281 40.9841 174.5950 165 H 4.7308 7.7953 120.7999 53.3947 31.9153 174.0035 166 C 4.2576 7.9606 115.6546 57.3991 40.9826 174.0772 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 24 L 8.17 4.59 0.00 1.67 1.85 0.54 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 *26 R 7.15 4.35 0.00 1.79 1.89 0.00 2.78 0.00 0.00 3.17 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.29 0.00 27 H 8.63 4.39 0.00 3.01 3.02 0.00 5.88 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 W 8.22 5.56 0.00 2.81 2.69 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 0.00 0.00 0.00 0.00 29 H 9.37 4.88 0.00 3.38 3.18 0.00 5.61 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 30 T 8.62 4.70 4.44 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 0.00 0.00 0.00 1.38 0.00 0.00 31 V 9.18 4.32 2.19 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 0.94 0.00 0.00 1.06 0.00 0.00 32 V 7.51 4.98 1.66 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 1.17 0.00 0.00 0.87 0.00 0.00 33 L 9.11 5.32 0.00 1.54 1.44 0.85 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 34 A 8.58 4.75 0.01 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 0.00 0.00 0.00 0.00 0.00 35 S 8.07 4.96 0.00 3.66 3.54 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 0.00 0.00 0.00 0.00 36 S 8.59 3.69 0.00 4.01 3.67 0.00 0.00 0.00 0.00 0.00 0.00 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 D 8.12 4.72 0.00 2.68 2.54 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 0.00 0.00 0.00 0.00 38 R 8.73 3.87 0.00 1.90 1.95 0.00 3.26 0.00 0.00 3.54 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 39 S 8.12 4.53 0.00 4.08 4.12 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 0.00 0.00 0.00 0.00 40 L 8.27 4.01 0.00 1.72 1.72 0.77 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 41 I 7.46 4.34 1.81 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.61 0.88 0.00 0.00 42 E 7.72 4.36 0.00 2.04 1.93 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 2.38 2.55 0.00 43 E 8.45 3.89 0.00 1.96 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 2.35 2.32 0.00 44 E 9.00 3.87 0.00 2.13 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 0.00 2.18 2.29 0.00 45 G 7.85 3.81 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 46 P 0.00 3.96 0.00 1.07 1.09 0.00 3.40 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.64 0.00 47 F 8.10 4.25 0.00 2.92 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 48 R 7.38 4.06 0.00 1.76 1.69 0.00 3.41 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.53 0.00 49 N 7.17 4.63 0.00 1.97 2.19 0.00 0.00 7.07 7.45 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 50 F 8.46 4.80 0.00 2.88 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 I 8.40 3.12 0.83 0.00 0.00 -0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.30 -0.02 -0.17 0.00 0.00 52 Q 8.37 4.21 0.00 1.27 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.46 0.00 0.00 0.00 0.00 0.00 1.63 1.31 0.00 53 N 7.35 5.31 0.00 2.87 2.71 0.00 0.00 6.93 7.73 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 54 I 8.68 4.92 2.11 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 1.02 0.72 0.89 0.00 0.00 55 T 8.89 4.63 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 1.21 0.00 0.00 56 V 8.40 4.48 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 0.80 0.00 0.00 0.94 0.00 0.00 57 E 9.04 4.41 0.00 1.95 1.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.27 0.00 58 S 9.81 3.85 0.00 4.09 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 59 G 8.49 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 60 N 8.13 4.98 0.00 2.69 2.61 0.00 0.00 6.70 6.54 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 61 L 8.36 4.74 0.00 1.14 1.27 0.13 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.36 0.00 0.00 0.00 0.00 0.00 0.00 62 N 9.55 4.98 0.00 2.68 2.78 0.00 0.00 6.40 8.05 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 63 G 9.01 4.12 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.69 5.26 0.00 2.94 2.77 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 0.00 0.00 0.00 65 F 9.26 4.93 0.00 2.61 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 L 8.55 5.22 0.00 1.64 1.57 0.90 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 67 T 9.01 4.84 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 1.18 0.00 0.00 68 R 8.72 4.78 0.00 1.94 1.95 0.00 3.29 0.00 0.00 3.38 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 69 K 9.38 4.44 0.00 1.73 1.59 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.34 1.41 7.81 70 N 9.89 4.11 0.00 2.86 2.83 0.00 0.00 7.10 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 71 G 8.17 3.96 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 0.00 0.00 0.00 0.00 0.00 0.00 72 Q 8.01 4.72 0.00 2.14 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.04 6.73 0.00 0.00 0.00 0.00 0.00 2.29 2.31 0.00 73 C 8.71 5.18 0.00 2.86 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 74 I 8.99 4.67 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 1.25 0.93 0.96 0.00 0.00 75 P 0.00 4.94 0.00 2.14 2.19 0.00 3.71 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 2.17 2.27 0.00 76 L 8.99 4.61 0.00 1.60 1.49 0.85 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 8.85 5.36 0.00 2.89 2.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 L 9.04 4.90 0.00 1.56 1.45 -0.04 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 79 T 8.60 4.83 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 0.00 0.00 80 A 8.60 4.65 1.06 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 0.00 0.00 81 F 9.28 5.05 0.00 3.17 3.08 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 0.00 82 K 9.32 4.65 0.00 1.80 2.23 0.00 1.60 0.00 0.00 1.98 0.00 0.00 3.03 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.77 1.48 7.81 83 T 7.82 4.63 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 84 E 8.89 4.29 0.00 2.01 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 1.87 0.00 85 E 8.05 4.59 0.00 1.86 1.79 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 2.13 2.10 0.00 86 A 8.74 3.93 1.31 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 0.00 0.00 0.00 87 R 7.94 4.62 0.00 2.40 2.31 0.00 3.12 0.00 0.00 3.33 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.75 0.00 88 Q 7.44 4.71 0.00 1.87 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.70 6.75 0.00 0.00 0.00 0.00 0.00 1.87 1.20 0.00 89 F 9.08 5.21 0.00 2.89 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 90 K 9.45 5.24 0.00 1.84 1.82 0.00 1.67 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.43 1.42 7.81 91 L 9.15 5.10 0.00 1.89 1.70 1.08 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 92 N 9.06 5.33 0.00 2.81 2.90 0.00 0.00 6.84 7.46 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 93 Y 9.02 4.46 0.00 2.85 2.82 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 94 Y 9.32 3.36 0.00 2.00 2.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 G 8.03 4.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 96 T 9.15 5.38 4.48 0.00 0.00 0.00 0.00 0.00 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 97 N 9.32 5.58 0.00 3.00 2.98 0.00 0.00 7.25 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 98 D 9.09 5.22 0.00 3.00 2.82 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 99 V 8.94 4.73 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 0.63 0.00 0.00 0.88 0.00 0.00 100 Y 9.00 5.29 0.00 3.01 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 0.00 101 Y 8.98 4.79 0.00 2.84 3.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 102 E 7.76 4.23 0.00 1.67 1.57 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 2.12 2.15 0.00 103 S 7.61 4.54 0.00 3.09 3.25 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 0.00 104 S 9.01 4.52 0.00 4.08 4.01 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 0.00 0.00 0.00 105 K 7.39 4.65 0.00 1.99 1.82 0.00 1.95 0.00 0.00 1.92 0.00 0.00 2.98 0.00 0.00 3.20 0.00 0.00 0.00 0.00 1.44 1.56 7.81 106 P 0.00 4.31 0.00 2.10 2.27 0.00 3.67 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 2.08 2.13 0.00 107 N 8.13 4.76 0.00 2.70 2.86 0.00 0.00 6.88 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 0.00 108 E 8.62 4.78 0.00 2.17 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 0.00 2.35 2.32 0.00 109 Y 7.73 5.53 0.00 3.15 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 0.00 110 A 8.94 4.37 0.51 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 0.00 0.00 111 K 8.40 4.78 0.00 1.93 1.73 0.00 1.81 0.00 0.00 1.85 0.00 0.00 2.90 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.33 1.58 7.81 112 F 8.92 5.18 0.00 2.80 2.65 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 0.00 0.00 0.00 0.00 113 I 8.96 4.83 1.85 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.00 0.36 0.00 0.00 114 F 9.53 4.94 0.00 2.91 3.03 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 0.00 0.00 0.00 115 Y 8.96 4.75 0.00 3.08 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 0.00 116 N 8.89 5.09 0.00 2.85 2.59 0.00 0.00 6.74 8.37 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 0.00 117 Y 8.96 5.23 0.00 2.99 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 0.00 118 H 9.19 4.70 0.00 3.20 3.12 0.00 5.93 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 D 9.52 4.40 0.00 2.71 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 0.00 120 G 8.56 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 K 7.99 4.68 0.00 1.67 1.65 0.00 1.78 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.27 1.21 7.81 122 V 8.30 5.13 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 1.15 0.00 0.00 1.17 0.00 0.00 123 N 9.09 5.30 0.00 2.69 2.53 0.00 0.00 6.36 7.22 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 0.00 124 V 8.74 4.66 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 0.67 0.00 0.00 0.76 0.00 0.00 125 V 8.71 4.55 1.62 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 0.74 0.00 0.00 0.01 0.00 0.00 126 A 8.93 5.25 1.24 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 0.00 0.00 0.00 127 N 9.55 5.40 0.00 2.47 2.44 0.00 0.00 6.17 6.78 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 0.00 128 L 8.45 4.56 0.00 0.27 0.83 0.58 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 129 F 9.27 5.77 0.00 2.64 2.80 0.00 0.00 0.00 0.00 0.00 0.00 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 G 9.50 4.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 R 9.07 3.93 0.00 1.82 1.92 0.00 2.84 0.00 0.00 2.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.52 0.00 132 T 7.52 4.67 4.19 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 0.00 0.00 0.00 1.20 0.00 0.00 133 P 0.00 4.21 0.00 2.13 2.09 0.00 3.42 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.77 0.00 134 N 7.52 5.03 0.00 2.75 2.64 0.00 0.00 6.93 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 0.00 135 L 7.96 4.88 0.00 1.60 1.48 0.95 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 136 S 8.63 4.13 0.00 3.90 3.77 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 0.00 0.00 0.00 137 N 8.80 4.34 0.00 2.81 2.86 0.00 0.00 6.74 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 0.00 138 E 8.11 3.91 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.41 0.00 139 I 7.49 3.53 1.86 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.45 0.23 0.00 0.00 140 K 8.03 3.97 0.00 1.81 1.88 0.00 1.75 0.00 0.00 1.84 0.00 0.00 2.90 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.41 1.39 7.81 141 K 8.40 3.95 0.00 1.86 1.86 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.47 7.81 142 R 7.94 4.04 0.00 2.01 2.05 0.00 3.16 0.00 0.00 3.10 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.65 0.00 143 F 8.24 4.07 0.00 3.13 3.18 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 0.00 144 E 8.73 4.00 0.00 2.30 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 0.00 2.45 2.64 0.00 145 E 8.65 4.10 0.00 2.18 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 0.00 2.63 2.34 0.00 146 D 7.88 4.32 0.00 2.81 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 0.00 147 F 7.94 4.16 0.00 2.76 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 0.00 148 M 8.22 4.29 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.70 0.00 149 N 8.37 4.50 0.00 2.78 2.83 0.00 0.00 6.97 7.20 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 0.00 150 R 7.43 4.27 0.00 1.90 1.82 0.00 3.17 0.00 0.00 3.27 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 151 G 7.94 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.43 4.97 0.00 2.68 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 153 R 8.49 4.23 0.00 1.97 1.91 0.00 3.17 0.00 0.00 3.39 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.71 0.00 154 R 8.66 4.28 0.00 1.91 2.03 0.00 3.16 0.00 0.00 3.30 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.67 0.00 155 E 8.30 3.97 0.00 1.97 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 0.00 2.32 2.37 0.00 156 N 8.80 4.75 0.00 3.18 3.11 0.00 0.00 6.72 7.31 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 0.00 157 I 7.66 4.69 2.02 0.00 0.00 1.00 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 0.68 0.95 0.00 0.00 158 L 9.35 4.57 0.00 1.51 1.59 0.94 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 0.00 0.00 0.00 0.00 159 D 8.77 5.02 0.00 2.71 2.62 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 0.00 160 I 8.60 4.35 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.59 0.99 0.00 0.00 161 S 8.40 4.33 0.00 4.04 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 0.00 162 E 8.01 4.39 0.00 1.98 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 0.00 2.25 2.22 0.00 163 V 7.38 3.91 2.26 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 0.74 0.00 0.00 0.95 0.00 0.00 164 D 8.56 4.33 0.00 2.60 2.54 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 0.00 0.00 0.00 0.00 165 H 7.80 4.73 0.00 2.02 2.93 0.00 5.79 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 166 C 7.96 4.26 0.00 2.96 3.03 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 0.00 0.00 0.00 * Residues marked with a * may have inaccurate shift predictions.