NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1910 8.2893 120.3307 55.9037 32.3248 176.1206 2 K 4.3734 7.8683 120.6454 53.1846 31.6726 172.0321 3 E 4.6177 8.4844 120.5527 56.9076 32.3419 176.2512 4 V 4.6964 8.2463 121.8321 61.6865 30.7259 176.3485 5 A 4.3130 7.9444 129.8472 51.3845 20.7430 176.9554 6 V 4.2032 8.1170 113.8031 61.1770 33.4551 175.3075 7 Y 4.7118 8.0424 128.3184 58.0209 39.7792 175.4515 8 Q 4.2742 8.8835 123.1514 55.5006 31.8995 174.8036 9 I 3.8988 7.8501 126.9716 61.8361 34.7600 173.4232 10 P 4.4704 0.0000 0.0000 64.4442 33.1177 178.4210 11 V 4.3605 7.1532 117.1147 61.8926 31.2835 178.9503 12 L 4.1004 9.0026 118.6708 56.8759 41.6061 177.1577 13 S 4.2465 7.8561 113.9148 57.2434 64.2465 173.9006 14 P 4.4473 0.0000 0.0000 62.0313 30.6121 175.7083 15 S 4.3603 8.4059 120.7883 57.6097 64.5599 173.9087 16 G 4.3334 7.8798 121.4703 46.5279 0.0000 171.4373 17 R 4.9503 8.4334 121.1394 55.3702 34.5536 174.7935 18 R 4.6281 7.8655 121.4650 56.5165 33.7400 173.1965 19 E 5.8964 7.9962 114.3050 56.8091 31.8613 176.4185 20 L 4.9484 8.1394 116.4686 55.9684 44.7139 174.3415 21 A 3.5865 8.5216 129.5267 53.3411 18.1848 179.2255 22 A 4.3531 8.7021 118.5008 54.6434 18.3319 177.6588 23 D 4.8302 7.9667 115.5372 54.4626 41.6766 175.9299 24 L 5.1181 7.8975 119.6172 52.5692 45.4914 173.1897 25 P 4.2748 0.0000 0.0000 63.0479 31.5961 175.1891 26 A 4.7737 8.8491 125.7468 51.9076 20.8471 178.8037 27 E 4.4550 9.2047 123.4672 56.2782 32.0753 174.6856 28 I 4.0166 8.3965 118.4555 60.0560 38.7486 175.8983 29 N 4.6780 8.5887 124.1465 51.2375 38.9274 173.1231 30 P 4.2754 0.0000 0.0000 65.9664 31.6232 177.6582 31 H 4.2762 8.3265 116.0507 59.2942 29.9832 176.7654 32 L 4.0554 9.4973 123.3524 57.9660 41.8638 178.3682 33 L 3.9884 7.8646 119.8630 58.1086 41.9042 178.6682 34 W 4.2290 8.1731 127.3885 60.8047 30.5963 177.1774 35 E 3.0898 8.9588 119.4324 59.3106 28.7325 179.2488 36 V 3.6194 7.6707 117.4477 65.9204 31.7160 177.8764 37 V 3.6387 7.7228 118.0059 66.2198 31.2372 177.7751 38 R 3.7065 7.8565 118.3431 59.1932 29.8616 177.9324 39 W 4.6879 7.6439 129.0944 59.9704 30.6911 177.8727 40 Q 3.0516 8.1742 117.8325 58.8519 27.9751 178.9050 41 L 3.7110 7.5675 118.1735 57.2459 41.9235 179.1841 42 A 4.1566 8.1600 121.6270 55.1704 18.1993 179.9217 43 K 3.8584 7.2263 115.2909 59.8039 32.6557 179.2552 44 R 3.8740 7.3481 118.0549 57.7839 30.0957 177.3813 45 R 3.9648 6.8304 116.5873 56.5104 30.5102 176.5074 46 R 4.2643 8.2522 117.0615 55.3519 32.2410 176.6782 47 G 4.2162 7.8164 105.9497 46.0451 0.0000 173.3405 48 T 4.6981 7.4917 101.8275 61.3422 70.4941 175.2285 49 A 4.4500 8.0613 123.9711 51.9377 19.5731 177.3149 50 S 5.1222 8.5276 116.3443 55.9385 66.4006 172.1434 51 T 4.4297 7.9634 109.4457 61.2234 71.7395 172.3811 52 K 4.8165 8.2155 121.5388 54.4767 33.8293 176.3651 53 T 4.3275 8.6771 119.3656 61.7884 67.7716 174.8609 54 R 3.9814 8.7277 122.4342 58.8774 28.9679 177.9240 55 G 3.6733 7.7028 107.5654 48.2207 0.0000 174.5507 56 E 3.9802 8.1405 121.1544 58.3406 29.8657 178.5423 57 V 3.5933 7.2944 116.9905 62.9869 31.9788 175.0876 58 A 4.3506 7.9519 127.3352 52.4084 18.7892 177.6755 59 Y 4.5487 7.1103 116.8138 57.9865 40.1969 174.3544 60 S 4.7364 8.4591 114.1934 57.1084 65.0655 175.2044 61 G 3.7875 8.6649 113.0125 46.1504 0.0000 173.6402 62 R 3.8092 7.7210 120.7389 56.1546 29.1994 175.6064 63 K 5.1831 8.6550 124.7791 54.3102 32.3528 176.9100 64 I 3.7926 8.2462 121.1175 63.2062 37.4173 176.3227 65 W 5.4205 7.1534 117.2464 54.6220 32.6789 175.7579 66 P 3.9620 0.0000 0.0000 63.7197 31.3450 177.8054 67 Q 4.1229 9.2001 117.7778 56.0866 29.2356 173.4459 68 K 4.5888 7.7422 112.4313 56.6992 34.9059 175.4990 69 H 5.1186 8.0200 115.3018 55.9029 29.7518 174.3924 70 T 4.1243 8.2972 117.1613 63.6494 69.4675 176.6494 71 G 3.9310 8.4433 108.0784 44.8686 0.0000 173.0748 72 R 4.4593 7.1125 117.1136 53.5903 32.4504 175.8020 73 A 4.1527 8.4644 123.2004 52.2080 18.9417 177.7163 74 R 4.2544 8.4034 117.7137 56.4220 30.1839 175.6548 75 H 4.8766 8.6174 118.6282 54.7635 33.0892 175.1001 76 G 3.8938 8.9700 107.7959 46.7173 0.0000 175.5909 77 D 5.5018 9.4681 123.6156 50.2358 43.3578 177.1921 78 I 2.8578 7.8634 110.2974 60.4351 37.6460 176.7799 79 G 3.7904 9.3340 112.9379 47.1588 0.0000 174.5063 80 A 4.3023 7.6287 123.3564 52.0678 18.6624 176.3170 81 P 4.8587 0.0000 0.0000 63.2045 31.1764 176.3691 82 I 4.1523 7.3438 112.0373 61.7687 37.3599 176.3668 83 F 4.8508 7.6913 116.7061 56.8241 40.5436 174.7773 84 V 3.5333 7.5362 122.4455 63.6478 31.1508 174.3163 85 G 3.8007 8.1621 108.5478 48.0106 0.0000 173.5574 86 G 3.9404 7.5296 106.3860 45.5458 0.0000 173.4543 87 G 4.1021 9.6256 108.6919 45.5846 0.0000 173.5468 88 V 4.0701 8.2906 120.5796 61.5336 32.6529 176.8309 89 V 4.1754 8.2678 130.1559 62.8608 29.7943 179.9180 90 F 4.7898 8.6961 111.0793 56.7894 36.5708 174.6235 91 G 4.6344 8.0778 110.1783 44.2137 0.0000 169.4854 92 P 4.6036 0.0000 0.0000 62.9432 32.3108 175.4271 93 K 4.9002 8.4565 121.1947 53.3759 35.7289 173.9494 94 P 4.6865 0.0000 0.0000 63.3417 31.6556 175.7018 95 R 4.7337 8.6808 117.9051 54.7137 33.8573 173.4919 96 D 4.9505 8.5646 119.0244 53.1111 41.5426 175.4413 97 Y 4.3338 8.7900 124.0283 58.2689 38.4273 176.2076 98 S 4.4578 9.0327 116.0948 58.3569 64.2233 173.0586 99 Y 4.8323 7.6084 117.5431 56.2512 40.1673 174.4996 100 T 4.2315 8.4874 119.0583 62.7624 67.4845 173.7538 101 L 3.8598 7.4862 128.6680 53.3134 42.6062 174.7324 102 P 4.0474 0.0000 0.0000 63.2136 31.8772 176.6606 103 K 3.6844 8.9414 123.1982 59.8922 32.0425 179.1049 104 K 3.8846 7.9998 117.4722 58.9002 31.8558 179.3686 105 V 3.6079 8.2365 119.3116 65.8151 31.6843 178.0793 106 R 3.9568 7.7357 117.1840 59.1586 29.6815 179.1557 107 K 3.9660 8.2529 118.3536 59.4902 32.1712 179.3199 108 K 4.0216 7.9968 118.7732 59.6613 31.8429 179.3507 109 G 3.6543 8.7452 106.0997 47.6777 0.0000 175.1641 110 L 3.9426 8.1161 123.2462 58.0870 42.1152 178.5174 111 A 4.2211 8.6064 120.6223 55.5070 18.1783 179.0454 112 M 3.9718 9.1741 115.5791 58.5261 32.4096 179.1006 113 A 3.9889 8.8116 120.9515 55.2678 18.6115 179.7955 114 V 3.4849 7.8838 116.2729 66.3331 31.6153 177.3888 115 A 4.0135 8.6078 120.3280 55.7122 17.8730 178.6471 116 D 4.3082 8.4699 115.8095 57.6247 41.2099 178.5908 117 R 4.0582 7.9289 118.1984 59.7428 30.0352 178.2040 118 A 4.1756 8.4074 120.6369 55.0504 18.0721 178.9277 119 R 4.1087 8.1502 114.2652 56.9027 30.0845 176.6696 120 E 4.5426 8.0687 114.6937 54.6454 31.7555 176.8550 121 G 3.9744 8.4840 106.2624 45.2986 0.0000 174.1009 122 K 4.2797 7.6873 117.5248 57.3457 33.0473 176.4684 123 L 4.8563 7.8036 122.6202 54.2983 43.6219 175.8575 124 L 4.4478 8.5057 127.1783 54.1081 45.6507 174.3695 125 L 4.9646 8.3504 127.5368 53.9357 41.7865 177.2090 126 V 4.0824 8.2942 119.5886 62.0102 33.8313 174.7837 127 E 4.2093 8.1978 122.8412 57.6981 35.5291 177.2520 128 A 4.2933 7.9849 124.3163 52.0915 16.7681 175.9042 129 F 4.4955 7.8928 120.1714 55.9046 38.1431 176.6028 130 A 4.2682 8.3903 124.3315 52.8085 18.5520 177.9327 131 G 3.8224 7.3975 105.6605 44.4194 0.0000 173.5967 132 V 4.4167 9.0370 125.7150 60.2932 34.3435 175.0453 133 N 4.0562 9.7605 113.6412 53.3381 36.7886 174.7633 134 G 3.8851 7.8293 105.2466 46.3521 0.0000 173.5706 135 K 4.5436 7.3048 118.7672 54.6492 35.8002 175.7084 136 T 4.0377 8.4658 123.4116 66.6943 68.5923 176.5596 137 K 3.9131 8.2435 119.9956 59.9192 32.0157 178.6539 138 E 3.9747 8.1948 117.8322 59.4429 29.5551 178.7106 139 F 3.9754 8.1599 120.0302 61.8406 39.2969 176.3615 140 L 4.1628 8.5963 119.2750 58.3928 41.3304 178.4543 141 A 3.9890 8.4621 120.1240 55.4128 18.2513 179.3178 142 W 3.9563 8.4124 126.2812 60.5662 30.8330 177.8733 143 A 3.5424 8.6173 121.1349 55.7332 17.7291 178.1954 144 K 3.7831 8.4202 117.5796 60.3014 31.6810 177.4026 145 E 4.0470 7.6101 116.6945 57.4109 29.6839 177.9991 146 A 4.0201 7.0054 122.1018 51.8407 19.4559 178.7095 147 G 3.7608 8.3226 105.2930 45.0944 0.0000 173.5479 148 L 4.6069 7.9709 120.4349 53.0803 41.9346 175.6975 149 D 4.6421 8.1561 125.0279 52.6755 39.8137 178.4224 150 G 2.3550 7.0419 109.1754 45.9217 0.0000 175.4566 151 S 4.1118 7.2409 115.1380 61.0142 63.0282 174.7906 152 E 5.1251 7.7800 116.2931 52.7882 33.2027 175.3818 153 S 4.8712 8.7691 116.7183 58.6014 64.6253 172.9491 154 V 4.8988 9.2750 122.3130 61.2086 34.9130 174.2082 155 L 4.7656 8.8235 130.1961 53.7062 42.6781 174.3604 156 L 4.7860 8.7563 129.7053 54.0188 43.0049 176.0155 157 V 5.1082 8.8563 126.7446 60.7192 33.2187 173.9816 158 T 4.8840 8.2466 121.6055 60.3649 70.9078 174.6706 159 G 3.6993 8.3191 114.2995 47.6319 0.0000 174.7730 160 N 4.5107 7.8358 118.8244 53.4534 37.5160 174.3277 161 E 3.9216 8.6655 126.9844 59.3120 29.6993 178.9802 162 L 3.9875 7.7408 118.1999 57.6114 42.0638 179.3473 163 V 3.3774 7.5533 117.6810 65.4610 31.4145 177.5959 164 R 3.6649 8.1507 119.1370 59.5945 29.6465 178.3941 165 R 3.7734 7.4821 115.6653 59.2282 30.1735 178.5755 166 A 3.9985 7.5399 118.6571 55.2536 18.8708 179.3153 167 A 3.1586 7.2483 117.4794 53.6776 18.1108 179.2621 168 R 3.5039 7.1609 116.5448 59.8478 30.2175 176.2899 169 N 4.5058 7.5168 114.0939 53.7908 39.4261 174.5840 170 L 4.1836 7.4499 118.9072 53.6061 42.2736 176.0641 171 P 4.2310 0.0000 0.0000 65.1814 31.3517 176.9142 172 W 4.8169 7.8093 113.9131 55.7458 28.4296 174.8999 173 V 4.7141 7.2689 118.1975 61.3380 33.9254 174.7829 174 V 4.2324 9.3064 128.4567 61.4015 33.4744 175.2277 175 T 4.5932 8.3267 122.8379 60.7078 69.2405 173.2088 176 L 4.9466 7.6878 128.0115 54.7210 45.1507 172.8898 177 A 4.7645 8.2890 129.0832 50.4404 19.4252 176.1378 178 P 4.2749 0.0000 0.0000 66.1565 31.2360 177.5860 179 E 4.4889 8.1749 116.1096 56.5367 29.1572 176.9282 180 G 4.1353 8.0720 104.9521 44.7819 0.0000 173.5040 181 L 4.1295 7.6357 122.2942 54.8946 42.6527 175.8418 182 N 4.9854 8.1150 120.3961 50.8596 40.1561 175.9490 183 V 3.6320 8.6220 112.8407 64.6435 31.6714 177.7852 184 Y 4.2931 8.6093 119.6645 61.2948 38.3013 178.1784 185 D 4.2179 8.9716 118.2430 57.3857 41.0894 178.6849 186 I 3.8171 7.4314 120.2148 64.5410 36.9343 178.7547 187 V 3.6512 8.2911 118.4603 65.5429 31.4620 177.4363 188 R 4.0964 7.7897 113.3632 56.1744 29.7460 176.1308 189 T 4.7149 6.7620 109.5376 60.0163 71.6352 173.9812 190 E 4.2660 8.9839 123.0143 58.8405 30.7786 176.9769 191 R 4.8092 8.4232 117.2260 54.1135 34.1284 174.5936 192 L 5.1153 8.7473 123.4235 53.4508 45.2965 175.4185 193 V 5.1433 8.6343 124.5624 61.6985 35.3523 173.5745 194 M 5.6532 9.1602 123.9432 53.4046 35.1716 173.7365 195 D 4.7180 9.0155 121.1963 54.5506 42.1499 176.9893 196 L 4.2424 8.4362 125.5646 58.0352 41.7659 179.3323 197 D 4.4279 8.6936 118.1236 57.5801 41.0749 178.9158 198 A 4.1557 8.5819 121.3394 54.9124 18.5991 179.3593 199 W 4.2572 8.3706 126.2233 60.3709 30.6574 177.4791 200 E 4.0540 8.8672 120.2003 58.9195 29.1769 178.8480 201 V 3.6875 7.4431 118.3750 64.3871 31.5788 178.3257 202 F 4.2395 8.5198 121.9248 61.4100 38.9479 177.2160 203 Q 4.0138 7.3087 118.4060 57.8282 28.0657 178.0458 204 N 4.3050 7.5698 117.6001 55.8823 39.1319 176.2676 205 R 4.1960 7.5520 117.2710 55.1626 30.9975 176.3951 206 I 4.0848 6.1795 114.8314 60.9300 40.3418 174.1989 207 G 4.0291 8.0289 110.7731 44.5321 0.0000 172.7979 *208 G 3.7078 8.1768 112.8465 45.5066 0.0000 173.1091 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 1 M 8.29 4.19 0.00 2.05 2.16 0.00 0.00 0.00 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.55 0.00 2 K 7.87 4.37 0.00 2.03 2.11 0.00 1.64 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.40 1.65 7.81 3 E 8.48 4.62 0.00 2.20 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 2.34 2.45 0.00 4 V 8.25 4.70 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 0.94 0.00 0.00 5 A 7.94 4.31 1.13 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 6 V 8.12 4.20 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 0.96 0.00 0.00 0.93 0.00 0.00 7 Y 8.04 4.71 0.00 2.95 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 8 Q 8.88 4.27 0.00 2.09 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.64 6.48 0.00 0.00 0.00 0.00 0.00 2.28 2.45 0.00 9 I 7.85 3.90 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.58 0.91 0.00 0.00 10 P 0.00 4.47 0.00 2.21 2.20 0.00 3.76 0.00 0.00 3.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 2.06 0.00 11 V 7.15 4.36 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 0.83 0.00 0.00 0.95 0.00 0.00 12 L 9.00 4.10 0.00 1.66 1.70 0.92 0.82 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 13 S 7.86 4.25 0.00 3.91 3.87 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 14 P 0.00 4.45 0.00 2.12 1.90 0.00 3.49 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 15 S 8.41 4.36 0.00 3.73 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 16 G 7.88 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 0.00 0.00 0.00 0.00 17 R 8.43 4.95 0.00 1.66 1.78 0.00 3.16 0.00 0.00 3.15 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.64 0.00 18 R 7.87 4.63 0.00 1.52 1.20 0.00 3.07 0.00 0.00 2.78 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.49 0.00 19 E 8.00 5.90 0.00 2.25 1.91 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 2.01 2.13 0.00 20 L 8.14 4.95 0.00 2.06 1.75 1.22 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.52 3.59 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 A 8.70 4.35 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 23 D 7.97 4.83 0.00 2.80 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 24 L 7.90 5.12 0.00 1.69 1.66 1.05 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 25 P 0.00 4.27 0.00 2.11 2.10 0.00 3.95 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.07 0.00 26 A 8.85 4.77 0.96 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 27 E 9.20 4.46 0.00 1.93 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 0.00 2.22 2.29 0.00 28 I 8.40 4.02 1.92 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 1.34 0.46 0.98 0.00 0.00 29 N 8.59 4.68 0.00 2.82 2.82 0.00 0.00 7.15 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 30 P 0.00 4.28 0.00 2.23 2.16 0.00 3.70 0.00 0.00 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.22 0.00 31 H 8.33 4.28 0.00 3.27 3.54 0.00 5.87 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 L 9.50 4.06 0.00 1.76 1.73 0.96 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 33 L 7.86 3.99 0.00 2.20 1.83 1.01 1.18 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 34 W 8.17 4.23 0.00 3.47 3.52 0.00 0.00 0.00 0.00 0.00 0.00 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 E 8.96 3.09 0.00 2.14 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 2.29 2.23 0.00 36 V 7.67 3.62 2.34 0.00 0.00 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 0.97 0.00 0.00 37 V 7.72 3.64 2.25 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 1.27 0.00 0.00 1.14 0.00 0.00 38 R 7.86 3.71 0.00 1.50 1.19 0.00 3.08 0.00 0.00 2.68 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.62 0.00 39 W 7.64 4.69 0.00 3.22 3.28 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 40 Q 8.17 3.05 0.00 1.92 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.57 0.00 0.00 0.00 0.00 0.00 2.34 2.63 0.00 41 L 7.57 3.71 0.00 1.46 1.53 0.87 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.16 4.16 1.53 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 0.00 0.00 43 K 7.23 3.86 0.00 1.62 1.52 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.59 0.00 0.00 2.65 0.00 0.00 0.00 0.00 0.68 1.02 7.81 44 R 7.35 3.87 0.00 1.64 1.88 0.00 2.96 0.00 0.00 2.86 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.62 0.00 45 R 6.83 3.96 0.00 1.78 1.49 0.00 2.83 0.00 0.00 2.64 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.71 0.00 46 R 8.25 4.26 0.00 1.70 1.91 0.00 3.30 0.00 0.00 3.18 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 47 G 7.82 4.22 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 0.00 0.00 0.00 0.00 0.00 0.00 48 T 7.49 4.70 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 1.23 0.00 0.00 49 A 8.06 4.45 1.27 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 0.00 0.00 50 S 8.53 5.12 0.00 3.85 3.74 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 51 T 7.96 4.43 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 52 K 8.22 4.82 0.00 1.81 1.75 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.38 7.81 53 T 8.68 4.33 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 1.30 0.00 0.00 54 R 8.73 3.98 0.00 1.97 2.10 0.00 3.08 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 55 G 7.70 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 0.00 0.00 0.00 56 E 8.14 3.98 0.00 1.94 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 2.38 0.00 57 V 7.29 3.59 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 0.82 0.00 0.00 0.98 0.00 0.00 58 A 7.95 4.35 1.02 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 0.00 0.00 0.00 0.00 0.00 59 Y 7.11 4.55 0.00 2.94 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 60 S 8.46 4.74 0.00 3.78 3.70 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 61 G 8.66 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 62 R 7.72 3.81 0.00 1.87 1.77 0.00 3.08 0.00 0.00 3.08 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.57 0.00 63 K 8.66 5.18 0.00 1.79 1.66 0.00 1.83 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.40 1.46 7.81 64 I 8.25 3.79 1.34 0.00 0.00 0.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 -0.36 0.59 0.00 0.00 65 W 7.15 5.42 0.00 3.55 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 66 P 0.00 3.96 0.00 2.28 2.09 0.00 3.86 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.20 0.00 67 Q 9.20 4.12 0.00 2.20 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.78 0.00 0.00 0.00 0.00 0.00 2.25 2.33 0.00 68 K 7.74 4.59 0.00 1.68 1.59 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.99 1.28 7.81 69 H 8.02 5.12 0.00 3.14 3.22 0.00 5.76 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.30 4.12 4.18 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 0.82 0.00 0.00 71 G 8.44 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 0.00 0.00 0.00 72 R 7.11 4.46 0.00 1.10 1.17 0.00 3.11 0.00 0.00 3.01 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.66 0.00 73 A 8.46 4.15 1.27 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 0.00 0.00 74 R 8.40 4.25 0.00 1.96 1.99 0.00 3.12 0.00 0.00 3.20 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.58 0.00 75 H 8.62 4.88 0.00 2.25 3.00 0.00 5.68 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 G 8.97 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 0.00 0.00 0.00 77 D 9.47 5.50 0.00 2.83 2.72 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 0.00 0.00 0.00 78 I 7.86 2.86 0.68 0.00 0.00 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.51 0.07 0.16 0.00 0.00 79 G 9.33 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 80 A 7.63 4.30 1.47 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 81 P 0.00 4.86 0.00 2.16 2.26 0.00 3.37 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.84 0.00 82 I 7.34 4.15 1.54 0.00 0.00 0.68 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 0.57 0.82 0.00 0.00 83 F 7.69 4.85 0.00 3.29 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 84 V 7.54 3.53 2.13 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 0.97 0.00 0.00 0.99 0.00 0.00 85 G 8.16 3.80 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 0.00 0.00 0.00 86 G 7.53 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 87 G 9.63 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.29 4.07 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 0.76 0.00 0.00 0.95 0.00 0.00 89 V 8.27 4.18 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 0.20 0.00 0.00 0.79 0.00 0.00 90 F 8.70 4.79 0.00 3.10 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 91 G 8.08 4.63 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 0.00 0.00 0.00 92 P 0.00 4.60 0.00 2.34 2.25 0.00 3.69 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.04 0.00 93 K 8.46 4.90 0.00 1.65 1.75 0.00 1.79 0.00 0.00 1.79 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.37 1.37 7.81 94 P 0.00 4.69 0.00 2.09 2.09 0.00 3.73 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 2.00 1.98 0.00 95 R 8.68 4.73 0.00 1.83 2.01 0.00 2.47 0.00 0.00 2.98 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.43 0.00 96 D 8.56 4.95 0.00 2.67 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 97 Y 8.79 4.33 0.00 2.99 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 98 S 9.03 4.46 0.00 3.89 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 99 Y 7.61 4.83 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 0.00 100 T 8.49 4.23 4.28 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 1.18 0.00 0.00 101 L 7.49 3.86 0.00 0.27 0.13 0.78 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 102 P 0.00 4.05 0.00 2.12 1.95 0.00 3.56 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.09 0.00 103 K 8.94 3.68 0.00 1.73 1.84 0.00 1.64 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.51 7.81 104 K 8.00 3.88 0.00 1.75 1.83 0.00 1.63 0.00 0.00 1.72 0.00 0.00 2.92 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.51 1.47 7.81 105 V 8.24 3.61 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 0.99 0.00 0.00 0.88 0.00 0.00 106 R 7.74 3.96 0.00 1.79 1.82 0.00 2.21 0.00 0.00 2.56 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.52 0.00 107 K 8.25 3.97 0.00 1.73 1.83 0.00 1.67 0.00 0.00 1.74 0.00 0.00 3.11 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.43 1.64 7.81 108 K 8.00 4.02 0.00 1.94 1.90 0.00 1.69 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.75 1.63 7.81 109 G 8.75 3.65 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 0.00 0.00 0.00 110 L 8.12 3.94 0.00 2.00 1.88 1.04 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.61 4.22 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 0.00 112 M 9.17 3.97 0.00 2.08 2.44 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.65 0.00 113 A 8.81 3.99 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 0.00 114 V 7.88 3.48 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 1.21 0.00 0.00 0.30 0.00 0.00 115 A 8.61 4.01 1.48 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 0.00 0.00 0.00 116 D 8.47 4.31 0.00 2.67 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 0.00 117 R 7.93 4.06 0.00 2.17 2.10 0.00 3.39 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.76 0.00 118 A 8.41 4.18 1.49 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 0.00 0.00 119 R 8.15 4.11 0.00 1.81 2.11 0.00 3.23 0.00 0.00 3.26 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.70 0.00 120 E 8.07 4.54 0.00 2.17 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 2.25 2.45 0.00 121 G 8.48 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 0.00 0.00 0.00 122 K 7.69 4.28 0.00 1.78 2.00 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.83 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.48 1.66 7.81 123 L 7.80 4.86 0.00 1.71 1.61 1.07 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 124 L 8.51 4.45 0.00 1.76 1.54 0.99 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.35 4.96 0.00 1.52 1.55 -0.04 0.89 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 0.00 126 V 8.29 4.08 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 1.17 0.00 0.00 0.71 0.00 0.00 127 E 8.20 4.21 0.00 2.00 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 2.23 2.35 0.00 128 A 7.98 4.29 1.54 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 0.00 0.00 129 F 7.89 4.50 0.00 2.92 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 0.00 130 A 8.39 4.27 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 0.00 131 G 7.40 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 0.00 132 V 9.04 4.42 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 0.83 0.00 0.00 0.93 0.00 0.00 133 N 9.76 4.06 0.00 2.83 2.90 0.00 0.00 6.84 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 0.00 134 G 7.83 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 0.00 0.00 0.00 135 K 7.30 4.54 0.00 1.84 1.74 0.00 1.61 0.00 0.00 1.82 0.00 0.00 3.13 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.55 7.81 136 T 8.47 4.04 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 1.23 0.00 0.00 137 K 8.24 3.91 0.00 1.83 1.94 0.00 1.70 0.00 0.00 1.85 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.58 1.60 7.81 138 E 8.19 3.97 0.00 2.24 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 2.44 2.40 0.00 139 F 8.16 3.98 0.00 3.11 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 0.00 140 L 8.60 4.16 0.00 2.11 1.83 1.33 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 141 A 8.46 3.99 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 0.00 142 W 8.41 3.96 0.00 3.36 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 0.00 143 A 8.62 3.54 1.48 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 0.00 0.00 0.00 144 K 8.42 3.78 0.00 1.78 1.86 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.38 1.46 7.81 145 E 7.61 4.05 0.00 1.80 1.82 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 2.26 2.24 0.00 146 A 7.01 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 G 8.32 3.76 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 148 L 7.97 4.61 0.00 1.88 1.98 1.22 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 149 D 8.16 4.64 0.00 2.62 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 0.00 150 G 7.04 2.36 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 0.00 151 S 7.24 4.11 0.00 3.72 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 0.00 152 E 7.78 5.13 0.00 1.93 1.83 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 2.19 2.19 0.00 153 S 8.77 4.87 0.00 4.00 4.09 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 0.00 154 V 9.28 4.90 2.24 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 1.14 0.00 0.00 1.36 0.00 0.00 155 L 8.82 4.77 0.00 1.82 1.59 0.94 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 156 L 8.76 4.79 0.00 1.66 1.47 1.19 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 157 V 8.86 5.11 2.15 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 0.85 0.00 0.00 0.95 0.00 0.00 158 T 8.25 4.88 4.50 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 1.23 0.00 0.00 159 G 8.32 3.70 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 0.00 0.00 0.00 160 N 7.84 4.51 0.00 2.87 2.76 0.00 0.00 6.98 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 0.00 161 E 8.67 3.92 0.00 2.02 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 2.39 2.43 0.00 162 L 7.74 3.99 0.00 1.69 1.65 0.89 0.85 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 0.00 163 V 7.55 3.38 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 -0.08 0.00 0.00 0.75 0.00 0.00 164 R 8.15 3.66 0.00 2.01 1.93 0.00 3.08 0.00 0.00 3.10 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 165 R 7.48 3.77 0.00 1.77 1.92 0.00 3.17 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 166 A 7.54 4.00 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 0.00 167 A 7.25 3.16 -0.07 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 0.00 168 R 7.16 3.50 0.00 1.91 1.82 0.00 3.15 0.00 0.00 3.04 7.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.56 0.00 169 N 7.52 4.51 0.00 2.64 2.71 0.00 0.00 6.99 7.78 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 0.00 170 L 7.45 4.18 0.00 1.29 0.65 0.62 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 171 P 0.00 4.23 0.00 2.29 2.26 0.00 3.77 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.10 0.00 172 W 7.81 4.82 0.00 3.65 3.33 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 0.00 173 V 7.27 4.71 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.04 0.00 0.00 174 V 9.31 4.23 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 0.92 0.00 0.00 0.90 0.00 0.00 175 T 8.33 4.59 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 1.12 0.00 0.00 176 L 7.69 4.95 0.00 1.82 1.50 0.95 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 177 A 8.29 4.76 1.26 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 0.00 0.00 0.00 178 P 0.00 4.27 0.00 2.27 2.39 0.00 3.71 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.05 0.00 179 E 8.17 4.49 0.00 1.97 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 2.32 2.38 0.00 180 G 8.07 4.14 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 0.00 0.00 0.00 181 L 7.64 4.13 0.00 1.71 1.58 0.86 0.55 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 0.00 182 N 8.12 4.99 0.00 3.02 2.89 0.00 0.00 6.25 7.68 0.00 0.00 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 V 8.62 3.63 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 0.94 0.00 0.00 1.04 0.00 0.00 184 Y 8.61 4.29 0.00 3.08 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 0.00 185 D 8.97 4.22 0.00 2.77 2.71 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 0.00 186 I 7.43 3.82 2.00 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.93 0.89 0.00 0.00 187 V 8.29 3.65 2.13 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 0.87 0.00 0.00 1.00 0.00 0.00 188 R 7.79 4.10 0.00 1.75 1.50 0.00 2.21 0.00 0.00 3.02 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.43 0.00 189 T 6.76 4.71 4.27 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 1.22 0.00 0.00 190 E 8.98 4.27 0.00 2.24 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 0.00 2.34 2.32 0.00 191 R 8.42 4.81 0.00 1.83 1.88 0.00 3.15 0.00 0.00 3.26 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.58 0.00 192 L 8.75 5.12 0.00 1.74 1.53 0.91 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 193 V 8.63 5.14 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 1.28 0.00 0.00 1.13 0.00 0.00 194 M 9.16 5.65 0.00 2.25 2.26 0.00 0.00 0.00 0.00 0.00 2.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.49 0.00 195 D 9.02 4.72 0.00 2.89 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 0.00 196 L 8.44 4.24 0.00 1.66 1.75 0.97 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 197 D 8.69 4.43 0.00 2.74 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 0.00 198 A 8.58 4.16 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 0.00 199 W 8.37 4.26 0.00 3.52 3.39 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 0.00 200 E 8.87 4.05 0.00 2.24 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 0.00 2.31 2.34 0.00 201 V 7.44 3.69 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 0.77 0.00 0.00 0.95 0.00 0.00 202 F 8.52 4.24 0.00 2.90 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 0.00 203 Q 7.31 4.01 0.00 1.92 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.60 0.00 0.00 0.00 0.00 0.00 1.16 1.48 0.00 204 N 7.57 4.31 0.00 2.86 2.93 0.00 0.00 7.20 7.77 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 0.00 205 R 7.55 4.20 0.00 2.00 1.97 0.00 3.35 0.00 0.00 3.34 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 206 I 6.18 4.08 1.70 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.36 0.83 0.00 0.00 207 G 8.03 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 0.00 0.00 0.00 *208 G 8.18 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 * Residues marked with a * may have inaccurate shift predictions.