NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.8128 8.2827 119.4914 53.5639 40.7038 172.4144 4 E 4.6621 8.8517 126.3182 54.0557 31.3932 173.2519 5 L 4.7848 8.7613 127.0423 51.9016 45.2700 174.3465 6 P 4.3819 0.0000 0.0000 62.1588 32.1777 175.9223 7 P 4.2250 0.0000 0.0000 65.5056 31.1038 178.3826 8 E 4.1875 8.0950 117.1613 58.5807 29.6509 177.6304 9 N 4.5959 8.1759 115.6205 53.7202 38.5819 176.3752 10 A 3.9689 8.0905 124.4996 55.5251 18.3862 179.3384 11 Y 4.1088 8.2592 115.5527 60.3950 37.7327 178.5204 12 R 3.8166 7.2089 118.0147 57.5649 30.0997 177.8021 13 I 4.3813 7.5869 118.9526 62.6151 38.7133 176.9481 14 L 4.6095 7.6466 117.6626 55.3204 42.5672 178.1812 15 E 4.0192 8.1436 119.6773 59.0906 29.6236 177.7758 16 S 4.3071 8.1180 110.8032 58.5594 63.5234 173.5629 17 G 3.8452 8.1474 109.3316 46.0808 0.0000 172.5587 18 P 4.4393 0.0000 0.0000 61.9239 32.2297 175.8231 19 I 4.0770 8.3928 121.3108 61.6831 38.2030 175.4183 20 V 4.6709 8.3863 119.9403 59.6246 36.4060 174.1275 21 L 4.6042 8.8223 122.6427 53.5038 44.1263 176.0003 22 V 4.6560 8.2298 122.7022 61.3556 33.5362 174.0173 23 S 5.2862 9.1155 124.7120 57.5766 63.9610 173.0176 24 T 5.0723 8.8754 115.9810 59.9730 72.8317 172.5070 25 R 4.9545 8.3455 121.4734 54.4660 32.8433 175.2578 26 G 3.8132 9.0564 115.4110 44.6499 0.0000 174.1258 27 A 3.9259 8.4503 122.2017 54.8902 18.3013 178.3462 28 D 4.5057 8.0560 112.8416 53.7349 39.8329 177.3408 29 G 3.9144 8.3081 108.9199 45.3563 0.0000 173.6008 30 R 4.3854 8.1792 120.0244 55.3018 31.1788 176.3845 31 A 4.7982 8.6071 125.7384 52.3510 19.6060 175.3883 32 N 5.1322 9.1550 117.0321 52.9320 43.4162 172.6523 33 L 5.7218 7.9723 120.2409 52.3829 46.3365 175.3697 *35 T 4.4065 7.7638 115.4588 63.8981 69.3053 174.4109 *37 G 4.0662 8.3545 109.3612 45.4511 0.0000 173.5144 38 F 4.8309 8.0822 119.5996 56.3541 37.8160 174.1271 39 H 5.7873 7.8461 118.0695 54.9157 31.3588 173.4215 *43 Q 4.0148 8.3026 120.2500 56.2357 29.6714 175.6165 44 H 3.9868 8.7115 122.2993 58.2906 29.0059 175.2058 45 E 4.5995 7.7733 120.8083 53.6327 31.3989 172.8739 46 P 4.2177 0.0000 0.0000 62.2750 32.0997 174.6282 47 P 4.8598 0.0000 0.0000 62.3687 31.9652 174.7393 48 L 5.3223 8.4490 125.0805 52.7676 44.3248 176.4666 49 V 4.4445 8.9646 122.6809 61.0497 35.0684 174.2381 50 G 4.5739 8.7465 113.9860 44.8176 0.0000 172.2077 51 A 5.3563 8.9659 125.3390 50.2164 22.8459 174.8153 52 I 5.0030 8.7731 123.5967 60.2186 38.4540 175.8732 53 I 4.4096 9.1354 128.3777 59.8760 40.4020 175.5038 54 G 2.7082 7.4114 115.6524 42.2422 0.0000 171.7024 55 P 4.0088 0.0000 0.0000 63.8568 31.3439 177.5173 56 W 4.3655 7.4531 115.5624 58.1355 28.7508 175.5052 57 D 4.8850 7.4050 120.8238 52.7679 41.9037 176.6864 58 Y 4.2000 8.8145 124.5258 61.1149 38.7407 178.5323 59 S 4.0136 8.1714 115.3034 61.4770 62.7772 175.7753 60 H 3.8410 7.9986 121.2534 59.0275 29.3219 176.9954 61 Q 3.7892 7.8571 121.0810 59.1276 28.8449 178.1101 62 A 3.8195 7.5108 121.2563 54.9043 18.4264 179.1314 63 L 3.5504 7.5922 118.8103 58.1651 41.7972 179.4562 64 S 4.1552 7.5787 113.9492 61.8206 62.9295 176.2859 65 E 4.1821 8.2554 120.0787 58.2913 28.8924 178.2470 66 T 4.4959 8.2170 108.8647 60.2132 70.3148 175.4764 67 G 3.8527 8.0812 109.1757 46.1317 0.0000 172.4330 68 E 5.2712 7.3434 113.8860 54.7653 33.7208 174.3863 69 C 4.7701 8.6127 115.8468 57.7638 33.9357 172.4101 70 V 4.7907 8.6841 119.0458 61.0586 34.1790 174.1479 71 L 4.9153 9.0079 128.3547 53.8534 42.9849 175.3747 72 A 5.0468 9.1511 127.4723 50.1878 21.3005 175.3546 73 V 4.5498 9.0277 124.5027 60.9290 32.8823 173.9028 74 P 4.8219 0.0000 0.0000 62.3338 33.2835 174.6649 75 T 4.7276 8.0869 109.3800 59.0262 71.7143 175.1817 76 V 3.5133 8.3078 121.0180 64.7213 31.1325 178.2180 77 D 4.3968 8.0054 118.4052 55.2628 39.5604 177.1771 78 L 4.4593 7.9829 119.3442 54.4154 41.7373 177.7331 79 A 3.6756 7.6897 123.8575 55.4199 18.1659 180.3069 80 E 3.8796 7.9888 116.3725 59.8258 29.4996 179.6135 81 T 3.6537 7.7038 115.3427 66.3377 68.3207 176.7000 82 V 3.3800 7.6578 119.6276 65.9188 31.9516 177.9806 83 V 3.7466 7.7493 117.8539 66.1647 31.3999 177.6893 84 D 4.3946 8.2815 118.9865 57.5097 40.4254 178.8344 85 I 3.6246 7.4466 119.7084 63.8847 37.0713 177.7233 86 G 4.0355 7.4980 103.4355 44.9391 0.0000 173.5348 87 N 5.1043 8.0220 116.3059 52.4625 40.0054 173.4008 88 C 4.8599 7.8727 111.9175 56.8295 32.6713 172.7537 89 S 4.7864 8.3977 113.8295 56.4870 64.3277 174.4276 90 G 4.4338 8.9781 113.8359 44.9203 0.0000 174.2148 91 D 3.3700 7.5395 119.9425 55.1469 39.3122 177.1994 92 A 4.6295 7.4456 117.9881 50.9288 20.4086 174.9239 93 L 4.4971 7.4174 118.7580 53.7234 45.2477 174.8723 94 D 4.6416 8.4245 124.3786 53.1338 40.9506 177.0272 95 K 4.1712 8.4905 127.1591 59.0280 32.3354 178.8970 96 F 4.2163 8.5833 117.9541 60.6250 38.5513 177.8190 97 G 3.6294 8.6514 105.1505 48.1704 0.0000 175.2680 98 H 4.0165 8.3358 119.9815 58.1328 29.9268 176.3595 99 F 4.7450 8.1178 116.4954 56.2610 39.3717 176.0116 100 G 3.9090 7.6036 106.2551 46.5192 0.0000 173.7083 101 L 4.8297 7.9098 118.4373 53.5325 43.7963 176.4518 102 T 4.7769 9.1321 118.8863 61.1685 70.7808 172.0058 103 P 4.8114 0.0000 0.0000 62.4340 32.4969 175.8167 104 V 4.3850 8.4496 122.5696 60.1175 34.6119 172.9230 105 P 4.5616 0.0000 0.0000 62.7289 31.7800 176.3333 106 A 4.3048 8.4169 126.9266 51.3781 19.9269 176.9129 107 Q 4.2692 9.5442 120.9513 57.9193 29.3624 176.5728 108 T 4.5870 8.7571 105.0642 61.1907 70.1623 173.8237 109 V 4.7202 7.4121 113.8310 60.0160 35.5456 174.8880 110 D 4.5666 9.1853 120.2984 54.7843 41.3116 177.4665 111 A 4.1500 7.7169 123.0309 51.3026 19.0278 175.2953 112 P 4.7248 0.0000 0.0000 62.1574 32.8609 176.0835 113 L 4.4238 8.7967 121.5671 54.8255 43.5461 176.2152 114 V 4.7109 8.9961 121.8800 61.3689 32.4870 176.3071 115 R 3.9028 8.8998 129.7479 59.7463 29.9647 177.7462 116 Q 4.2191 8.0032 113.8863 57.6093 29.1447 175.8715 117 C 4.5458 7.7190 116.3857 58.4641 29.4092 173.4208 118 W 4.5344 8.8629 134.3714 59.9850 31.4748 175.5712 119 A 4.9388 8.0720 119.7221 49.9411 22.3038 174.6430 120 N 5.3723 9.1383 117.5133 51.5409 42.8211 173.4708 121 L 5.0460 9.0051 124.6059 52.7462 44.2867 175.7995 122 E 4.4939 8.9825 125.1611 56.5064 30.7132 176.1938 123 C 5.4043 9.3380 121.4579 58.0439 32.8132 173.1757 124 R 5.0979 8.4784 120.5149 54.1247 33.2547 175.3815 125 V 4.1673 8.6482 123.9498 63.4609 31.2526 175.8721 126 V 4.2582 8.9040 121.9954 62.2663 33.7168 175.9583 127 D 4.5614 8.0043 120.2393 52.7419 44.1070 174.9595 128 D 4.4861 8.7197 125.0974 52.9071 39.8437 178.4214 129 G 3.6989 8.4369 111.5104 48.3325 0.0000 174.9863 130 W 4.8871 7.9432 117.4608 56.3850 30.0737 177.5072 131 A 3.6114 7.8394 124.1731 54.6501 17.8494 180.9739 132 R 3.7989 7.7990 114.4546 59.4585 30.5240 177.6115 133 R 3.6648 7.9430 116.4194 59.0816 29.1042 176.4766 134 Y 4.8203 7.7986 111.5823 56.6779 39.9102 175.5170 135 N 4.4582 8.2991 116.4767 54.0786 36.6964 172.7496 136 L 5.2548 7.2674 120.3156 53.6010 44.2098 175.0515 137 W 4.9861 9.3537 125.8980 54.8795 32.6152 174.4298 138 V 4.6551 8.6908 125.0789 61.7577 32.5360 174.4814 139 L 5.2865 9.1609 128.3089 52.9655 44.9059 174.8633 140 E 5.0609 8.9569 123.9114 54.2506 31.9678 175.0551 141 V 4.1126 8.3746 127.9001 63.4219 31.5598 175.4830 142 Q 4.4054 9.4421 127.5794 57.8780 29.9755 176.4335 143 R 4.5182 7.5813 115.4523 54.6111 35.1615 174.2562 144 I 4.8210 7.5471 121.4394 59.2005 41.0922 174.2293 145 W 5.2033 8.9885 126.4774 54.8634 32.1761 174.5952 146 I 4.3773 8.7336 125.0655 59.4643 39.9584 176.0562 147 D 4.6123 8.8208 127.6712 53.3912 39.4495 176.6071 148 T 4.2037 8.1392 113.3902 62.9120 69.4381 176.0500 149 A 4.3101 7.6775 123.5127 53.1018 19.2536 177.7715 150 R 4.0796 7.7818 116.6378 56.5168 30.7628 176.6183 151 K 4.0659 8.7477 124.7508 58.9595 32.5720 176.9774 152 E 4.2571 8.0089 119.8827 55.5542 29.7240 175.4684 153 T 4.1918 8.1108 114.1333 60.7615 70.0761 173.7793 154 R 3.9678 8.2127 123.2005 56.4695 31.0485 176.4891 155 L 4.7426 8.5621 123.8954 54.0316 43.8591 175.4989 156 I 5.1675 8.0812 112.9556 59.5595 41.2429 173.8497 157 H 5.2708 9.3248 121.0653 54.2655 32.0516 172.2689 158 H 4.2400 9.1747 123.7949 55.7738 30.2744 174.7360 159 Q 4.2821 8.9164 124.2731 55.3541 29.2098 176.6765 160 G 3.7079 6.7054 104.1315 46.8955 0.0000 173.3814 161 D 4.2857 9.3655 117.7540 55.1220 38.3357 175.0989 162 G 3.9493 8.6455 104.9005 45.4434 0.0000 173.6221 163 R 4.5566 7.6948 120.7857 54.9632 31.6216 175.2227 164 F 5.4711 8.7690 123.8213 55.6462 42.7278 174.5195 165 S 4.7004 9.0307 117.1202 57.5846 64.9717 172.9398 166 V 4.7647 8.1754 122.0493 60.9217 33.1776 174.9649 167 D 4.4459 8.8171 127.9621 54.0871 41.1746 176.4157 168 G 4.1065 8.4996 109.9174 45.5073 0.0000 175.2886 169 D 4.5592 8.6467 124.9211 54.2286 41.3448 175.1592 170 T 4.5683 8.1478 117.4905 61.8332 70.4651 174.2378 171 L 4.4206 8.3311 125.8250 53.4843 42.9467 175.9942 172 D 4.7800 8.5290 122.5462 52.8043 41.5616 174.8059 173 L 4.8883 8.1592 127.0884 54.1615 42.3280 179.3448 174 G 3.7468 8.3563 111.4623 48.5692 0.0000 175.7664 175 E 4.0796 8.1930 116.8038 58.8701 29.7446 177.7720 176 R 4.2145 7.7014 120.2473 54.8923 28.4863 175.6588 *178 T 4.2976 7.8161 110.8574 61.0082 70.8895 175.9795 179 K 3.7662 7.7285 120.8844 57.0366 32.3858 176.5397 180 W 5.1788 7.4311 117.4008 56.6151 30.3179 175.3290 181 R 4.1607 8.2621 122.9513 56.7240 29.4487 176.7365 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 3 N 8.28 4.81 0.00 2.91 2.88 0.00 0.00 6.59 6.77 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 4 E 8.85 4.66 0.00 2.05 1.70 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 1.77 1.47 0.00 5 L 8.76 4.78 0.00 1.33 1.39 0.79 0.96 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 6 P 0.00 4.38 0.00 2.18 1.98 0.00 3.66 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.04 0.00 7 P 0.00 4.23 0.00 2.30 2.22 0.00 3.63 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.13 0.00 8 E 8.10 4.19 0.00 1.97 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 2.49 2.48 0.00 9 N 8.18 4.60 0.00 2.93 2.72 0.00 0.00 6.69 6.71 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 10 A 8.09 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 Y 8.26 4.11 0.00 3.12 3.09 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 0.00 0.00 0.00 0.00 12 R 7.21 3.82 0.00 1.64 1.84 0.00 2.90 0.00 0.00 3.05 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.50 0.00 13 I 7.59 4.38 1.96 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.69 0.98 0.00 0.00 14 L 7.65 4.61 0.00 1.72 1.76 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 15 E 8.14 4.02 0.00 2.08 2.16 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 2.36 2.28 0.00 16 S 8.12 4.31 0.00 4.10 4.03 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 17 G 8.15 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 18 P 0.00 4.44 0.00 2.24 2.07 0.00 4.04 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.22 0.00 19 I 8.39 4.08 2.17 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 1.43 0.79 0.99 0.00 0.00 20 V 8.39 4.67 2.08 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 0.93 0.00 0.00 0.88 0.00 0.00 21 L 8.82 4.60 0.00 1.64 1.49 0.80 0.62 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 22 V 8.23 4.66 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 0.91 0.00 0.00 0.92 0.00 0.00 23 S 9.12 5.29 0.00 4.04 3.89 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 24 T 8.88 5.07 4.17 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 1.10 0.00 0.00 25 R 8.35 4.95 0.00 1.77 1.78 0.00 3.21 0.00 0.00 3.31 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 26 G 9.06 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 27 A 8.45 3.93 1.28 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 0.00 0.00 28 D 8.06 4.51 0.00 2.80 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 29 G 8.31 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 30 R 8.18 4.39 0.00 1.98 1.94 0.00 3.15 0.00 0.00 3.36 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.62 0.00 31 A 8.61 4.80 1.18 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 0.00 0.00 32 N 9.16 5.13 0.00 2.98 2.73 0.00 0.00 7.24 6.18 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 33 L 7.97 5.72 0.00 1.36 1.38 -0.03 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 *35 T 7.76 4.41 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 1.24 0.00 0.00 *37 G 8.35 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 38 F 8.08 4.83 0.00 3.14 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 39 H 7.85 5.79 0.00 3.38 3.36 0.00 5.36 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 *43 Q 8.30 4.01 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.37 0.00 44 H 8.71 3.99 0.00 3.14 3.14 0.00 5.82 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 E 7.77 4.60 0.00 1.87 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 2.18 2.32 0.00 46 P 0.00 4.22 0.00 2.07 2.15 0.00 3.93 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.08 0.00 47 P 0.00 4.86 0.00 2.12 2.40 0.00 3.81 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 2.18 1.83 0.00 48 L 8.45 5.32 0.00 1.53 1.59 0.93 0.98 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 49 V 8.96 4.44 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 1.01 0.00 0.00 0.96 0.00 0.00 50 G 8.75 4.57 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 0.00 0.00 0.00 51 A 8.97 5.36 1.35 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 52 I 8.77 5.00 2.22 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.32 1.32 0.00 0.00 53 I 9.14 4.41 1.72 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.65 0.78 0.00 0.00 54 G 7.41 2.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 0.00 130 W 7.94 4.89 0.00 3.38 3.24 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 0.00 131 A 7.84 3.61 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.80 3.80 0.00 1.98 1.88 0.00 3.36 0.00 0.00 3.15 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.19 0.00 133 R 7.94 3.66 0.00 1.40 1.57 0.00 2.27 0.00 0.00 2.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.80 0.00 134 Y 7.80 4.82 0.00 3.00 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 0.00 135 N 8.30 4.46 0.00 3.12 3.14 0.00 0.00 6.54 6.16 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 0.00 136 L 7.27 5.25 0.00 2.15 1.89 1.08 1.24 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 0.00 137 W 9.35 4.99 0.00 3.32 3.14 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 0.00 0.00 0.00 138 V 8.69 4.66 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 1.05 0.00 0.00 0.92 0.00 0.00 139 L 9.16 5.29 0.00 1.61 1.55 0.95 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 140 E 8.96 5.06 0.00 2.01 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 2.20 2.42 0.00 141 V 8.37 4.11 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 0.74 0.00 0.00 0.93 0.00 0.00 142 Q 9.44 4.41 0.00 1.93 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.40 0.00 0.00 0.00 0.00 0.00 2.46 2.48 0.00 143 R 7.58 4.52 0.00 1.58 1.18 0.00 3.20 0.00 0.00 3.21 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.72 0.00 144 I 7.55 4.82 1.76 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 1.20 0.55 0.69 0.00 0.00 145 W 8.99 5.20 0.00 3.17 2.99 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 0.00 146 I 8.73 4.38 1.71 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.63 0.46 0.00 0.00 147 D 8.82 4.61 0.00 2.74 2.67 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 0.00 148 T 8.14 4.20 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 1.24 0.00 0.00 149 A 7.68 4.31 1.35 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 0.00 150 R 7.78 4.08 0.00 2.27 2.03 0.00 3.51 0.00 0.00 3.53 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.69 0.00 151 K 8.75 4.07 0.00 1.79 1.84 0.00 1.80 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.44 1.44 7.81 152 E 8.01 4.26 0.00 1.88 1.84 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 2.34 2.29 0.00 153 T 8.11 4.19 3.46 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 1.05 0.00 0.00 154 R 8.21 3.97 0.00 1.82 1.83 0.00 3.21 0.00 0.00 3.12 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 155 L 8.56 4.74 0.00 1.65 1.49 0.94 0.61 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 0.00 156 I 8.08 5.17 1.87 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 1.17 0.83 0.00 0.00 157 H 9.32 5.27 0.00 3.11 3.28 0.00 5.61 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 158 H 9.17 4.24 0.00 3.14 3.20 0.00 5.72 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 159 Q 8.92 4.28 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.19 0.00 0.00 0.00 0.00 0.00 2.27 2.24 0.00 160 G 6.71 3.71 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 161 D 9.37 4.29 0.00 2.78 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 0.00 162 G 8.65 3.95 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 0.00 0.00 0.00 163 R 7.69 4.56 0.00 1.87 1.68 0.00 3.03 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 164 F 8.77 5.47 0.00 2.90 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 0.00 165 S 9.03 4.70 0.00 3.93 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 0.00 166 V 8.18 4.76 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 0.96 0.00 0.00 167 D 8.82 4.45 0.00 2.56 2.58 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 0.00 168 G 8.50 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 0.00 169 D 8.65 4.56 0.00 2.67 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 170 T 8.15 4.57 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 1.21 0.00 0.00 171 L 8.33 4.42 0.00 1.64 1.60 0.92 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 172 D 8.53 4.78 0.00 2.60 2.58 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 0.00 173 L 8.16 4.89 0.00 1.76 1.66 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 174 G 8.36 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 175 E 8.19 4.08 0.00 2.10 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 2.29 2.30 0.00 176 R 7.70 4.21 0.00 1.92 1.97 0.00 3.37 0.00 0.00 3.29 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.73 0.00 *178 T 7.82 4.30 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 1.25 0.00 0.00 179 K 7.73 3.77 0.00 1.30 0.74 0.00 1.48 0.00 0.00 1.47 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.30 0.85 7.81 180 W 7.43 5.18 0.00 3.30 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 0.00 181 R 8.26 4.16 0.00 1.80 1.87 0.00 3.43 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 * Residues marked with a * may have inaccurate shift predictions.