NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4162 8.2493 123.5854 52.9124 19.8008 176.6726 3 T 4.3482 7.6612 110.7298 61.0866 71.3442 173.4481 4 L 4.4049 7.6551 124.7537 53.5433 41.3235 176.4261 5 R 4.8916 8.0767 117.8932 53.4873 32.9352 175.9833 6 S 4.8111 8.6629 113.8786 58.8674 63.8858 173.0124 7 F 4.8805 8.2278 116.3827 55.9180 41.8454 173.0014 8 V 4.1454 8.2796 119.5987 62.0103 31.1957 175.2832 9 L 4.0720 8.4096 131.6591 57.2783 42.8974 176.9933 10 V 4.1777 7.4386 119.5282 61.0451 34.0542 174.2221 11 D 5.0511 8.7761 128.6801 53.2775 41.1698 176.2220 12 N 4.8075 9.2087 130.1231 52.7239 38.3065 175.8461 13 G 4.0899 8.8112 111.1509 44.8757 0.0000 174.4315 14 G 4.2117 7.2754 108.5309 45.5204 0.0000 174.1317 15 T 3.8185 8.1161 116.9221 65.5224 66.7833 176.9057 16 G 4.0409 8.9853 114.2136 45.9161 0.0000 173.9205 17 N 4.4702 8.0731 117.8698 53.4128 39.4265 175.2499 18 V 3.9592 8.4318 123.8254 61.8227 32.7902 174.5566 19 T 4.6987 8.2174 124.7187 61.9419 70.6560 174.4280 20 V 4.4813 8.0512 124.2772 61.1716 34.6484 174.8276 21 V 5.0199 9.0720 120.3812 58.8171 35.3276 173.1446 22 P 4.1916 0.0000 0.0000 62.6933 31.1925 176.2814 23 V 4.3635 8.7126 124.1373 63.9516 34.0448 175.2745 24 S 4.5582 7.5690 112.4075 56.8941 66.4312 174.0359 25 N 5.4916 8.2225 115.9653 52.3181 39.2093 173.5096 26 A 4.5464 7.6603 123.4727 51.9091 21.1573 177.2193 27 N 3.8908 9.5801 118.1267 54.4861 36.1380 175.2149 28 G 3.7974 8.5242 102.7228 45.8909 0.0000 173.9989 29 V 4.5356 7.5679 119.9162 60.6140 33.7806 174.5658 30 A 4.4731 8.8388 131.0070 51.4599 20.0848 175.4907 31 E 5.2174 8.6687 122.3343 54.1736 32.9779 174.5324 32 W 5.4619 10.0297 126.4601 55.2237 32.7687 174.6171 33 L 5.7770 9.4774 122.5980 52.0332 46.0515 176.3547 34 S 4.7124 8.5669 115.8233 56.9625 65.3042 174.4709 35 N 4.6993 8.1541 117.3247 52.2015 36.7262 173.3223 36 N 5.1323 7.3915 115.7343 50.7949 43.6414 174.9144 37 S 4.2232 8.4175 115.1195 58.8127 63.2817 176.0922 38 R 3.6875 8.8019 124.0467 59.3517 29.9611 178.2038 39 S 4.2507 8.0509 111.3756 60.7831 63.5213 174.6018 40 Q 4.4242 8.5770 119.0195 55.0905 28.2949 173.7132 41 A 4.9065 7.3351 118.4172 50.5819 22.8642 177.2307 42 Y 4.2534 8.9344 117.8241 58.2560 39.3819 175.3135 43 R 5.1937 8.8384 121.9637 54.9215 34.4002 173.9304 44 V 5.2119 9.1150 124.4428 61.6257 35.2760 174.0206 45 T 6.0563 9.5526 116.4885 59.5668 72.6769 172.4178 46 A 5.8903 8.8856 122.3525 52.1503 23.0567 175.1418 47 S 4.9831 8.6071 112.4443 57.3183 66.6642 172.5484 48 Y 4.8006 8.5949 122.6684 56.1010 40.8647 174.3946 49 R 4.5932 8.0530 124.2685 54.0675 35.2209 174.6293 50 A 4.4640 8.2233 121.8215 52.0998 19.5919 177.1766 51 S 4.1910 8.6837 113.7871 58.2414 66.1144 175.7687 52 G 4.0629 8.6145 117.0481 45.2525 0.0000 172.4178 53 A 4.4136 8.4547 120.5064 53.0590 19.4471 178.5451 54 D 4.5896 7.4734 114.8751 52.9185 40.5581 174.9549 55 K 5.1419 8.1334 117.0097 55.6253 36.9038 175.4512 56 R 4.8357 8.9918 120.1986 54.3650 34.3780 175.0164 57 K 5.0388 8.6624 122.4583 55.3601 35.4289 174.7869 58 Y 4.8220 9.3462 126.2663 57.8472 40.0596 175.3053 59 T 5.0051 8.9901 118.9131 62.2663 72.1099 172.6516 60 I 5.1993 8.8678 127.8788 59.3377 40.3545 175.2511 61 K 5.1483 9.2799 125.0629 54.5755 36.1423 175.0206 62 L 5.2856 8.9408 125.8948 53.3442 45.8051 175.0202 63 E 4.6395 9.1640 123.4148 54.6965 33.6020 174.5619 64 V 4.2065 8.5197 125.9433 60.3407 33.5040 173.1090 65 P 4.6195 0.0000 0.0000 61.8215 33.2742 175.8719 66 K 3.7141 7.6810 123.1646 54.4062 32.6124 174.8469 67 I 4.0117 7.7408 128.3143 61.2561 37.7680 175.8421 68 V 4.4561 8.3776 118.9058 60.5085 37.1066 173.7382 69 T 4.8949 8.2091 117.6285 61.9078 70.3395 174.3949 70 Q 4.3300 8.7981 128.4510 56.0578 30.8302 175.2289 71 V 4.9424 8.0269 115.6956 59.9545 35.6696 174.9645 72 V 4.2516 8.7184 125.1131 62.1895 34.2027 174.9671 73 N 4.1571 9.8416 125.4484 54.5655 35.9376 175.0197 74 G 3.8148 8.3646 101.8461 45.8300 0.0000 173.4436 75 V 4.3932 7.8818 121.0296 60.8058 33.3475 174.2392 76 E 5.1431 8.7559 126.4091 55.1361 31.5071 175.4958 77 L 4.9433 8.8776 122.2094 52.1284 46.3507 173.9053 78 P 4.7174 0.0000 0.0000 62.8799 32.1818 175.4559 79 V 4.5084 8.7262 123.7267 61.0872 35.8936 173.3758 80 S 4.9445 8.2671 116.5323 56.1722 63.5056 174.4136 81 A 4.1821 8.7369 130.4829 54.3154 18.9282 176.8298 82 W 4.3452 6.4937 107.9957 56.5147 31.7716 173.8410 83 K 5.2701 9.1920 118.1719 54.7667 35.8152 175.6319 84 A 4.9547 9.1089 124.3706 50.6427 21.4497 175.4899 85 Y 5.1770 8.8480 118.2297 56.1048 41.3454 175.0490 86 A 4.8837 8.9276 124.1813 50.2085 22.6932 174.8471 87 S 5.0831 8.7781 115.5034 56.5847 65.5569 173.1262 88 I 4.7525 9.0927 127.3032 59.5950 40.9481 173.9639 89 D 5.3748 8.9072 125.6995 52.4472 43.5941 174.8185 90 L 4.8537 9.1223 126.0335 53.4669 44.8661 174.9933 91 T 5.1882 8.6908 122.1483 61.8970 71.3577 173.4331 92 I 4.7477 8.9359 126.7915 58.6981 41.3120 173.5581 93 P 4.9980 0.0000 0.0000 62.5962 32.2344 177.3678 94 I 3.8888 8.3106 115.4647 62.4309 37.8777 177.1299 95 F 4.3090 7.4495 118.7649 58.9826 39.2304 175.4294 96 A 3.9579 7.7472 124.0247 52.4540 18.4650 177.8079 97 A 4.6003 8.7849 125.5988 50.8336 22.1564 177.4643 98 T 3.8035 8.4281 116.1465 67.5780 68.3470 176.1105 99 D 4.3858 8.1449 119.5042 57.7221 40.9186 178.5421 100 D 4.3870 8.1596 118.4994 57.6045 40.8385 178.8920 101 V 3.6067 7.8143 118.2679 66.4213 31.4636 177.8971 102 T 3.8262 8.0730 115.4680 66.7696 68.2866 176.2835 103 V 3.5330 7.8291 119.7046 66.2372 31.6260 177.6885 104 I 3.6585 7.7900 119.3287 64.6550 36.8950 177.8703 105 S 4.0132 8.5655 113.8808 61.7525 62.1697 176.6434 106 K 3.9979 8.4044 121.1445 59.2467 31.6469 179.5492 107 S 4.0656 8.4414 116.0156 61.6343 62.8234 176.5090 108 L 4.0257 7.7979 120.9999 57.8646 41.1847 179.3755 109 A 4.1199 7.5701 119.3308 55.2495 18.6547 179.4523 110 G 3.7513 8.5538 104.3301 47.8936 0.0000 175.0649 111 L 3.7517 8.1341 122.2335 57.8447 42.0989 178.5190 112 F 4.5058 7.7981 113.4002 56.1205 40.0004 176.1180 113 K 3.9445 7.5741 121.4801 56.3559 32.5648 176.0454 114 V 3.9275 8.1985 125.4197 64.0782 31.9471 175.4220 115 G 4.1062 9.0548 115.1622 45.8369 0.0000 174.1682 116 N 4.6910 7.9811 116.7150 51.4037 40.8443 174.0508 117 P 4.2080 0.0000 0.0000 66.6745 31.0228 178.3331 118 I 3.9309 7.8603 119.4002 63.7584 36.9389 178.1162 119 A 4.0386 7.9389 120.7994 55.0855 18.1311 178.8147 120 E 3.8412 7.9616 116.2766 59.5109 29.9574 178.4881 121 A 4.0415 8.4211 120.7941 55.3051 18.4852 179.4078 122 I 3.7243 7.9012 118.3434 64.6647 37.0400 178.4401 123 S 4.6556 8.1085 110.8283 58.9133 62.6105 174.4955 124 S 4.5816 7.3683 113.8203 58.1361 63.7261 173.6242 125 Q 3.4007 8.2463 116.3712 57.5793 26.0571 173.6304 126 S 4.6854 7.9697 112.9970 57.0777 65.2678 173.1519 127 G 3.8820 8.1421 109.9849 43.9861 0.0000 172.3250 128 F 4.3937 8.2717 119.7633 55.9650 39.1618 174.2636 129 Y 4.9209 8.0318 122.9842 54.8563 41.1559 175.4698 130 A 4.2924 8.7816 121.3894 53.4229 19.2139 176.3627 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 2 A 8.25 4.42 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 3 T 7.66 4.35 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 4 L 7.66 4.40 0.00 1.54 1.58 0.20 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 5 R 8.08 4.89 0.00 2.02 1.92 0.00 3.16 0.00 0.00 3.43 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.77 0.00 6 S 8.66 4.81 0.00 4.06 4.02 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 7 F 8.23 4.88 0.00 3.05 3.11 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 8 V 8.28 4.15 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 0.89 0.00 0.00 9 L 8.41 4.07 0.00 1.22 1.43 0.91 1.02 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 10 V 7.44 4.18 1.88 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 0.88 0.00 0.00 0.72 0.00 0.00 11 D 8.78 5.05 0.00 2.63 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 12 N 9.21 4.81 0.00 2.72 2.75 0.00 0.00 6.71 7.90 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 13 G 8.81 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 0.00 0.00 0.00 14 G 7.28 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 0.00 0.00 0.00 0.00 15 T 8.12 3.82 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 16 G 8.99 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 17 N 8.07 4.47 0.00 2.55 2.71 0.00 0.00 6.68 8.39 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 18 V 8.43 3.96 1.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.21 0.00 0.00 0.60 0.00 0.00 19 T 8.22 4.70 4.15 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 1.14 0.00 0.00 20 V 8.05 4.48 1.22 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 1.01 0.00 0.00 0.64 0.00 0.00 21 V 9.07 5.02 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 0.71 0.00 0.00 0.97 0.00 0.00 22 P 0.00 4.19 0.00 1.80 1.56 0.00 3.66 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.25 0.00 23 V 8.71 4.36 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 0.78 0.00 0.00 0.93 0.00 0.00 24 S 7.57 4.56 0.00 3.84 3.86 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 0.00 0.00 0.00 25 N 8.22 5.49 0.00 2.49 2.64 0.00 0.00 7.23 7.96 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 26 A 7.66 4.55 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 27 N 9.58 3.89 0.00 2.88 2.91 0.00 0.00 7.04 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 28 G 8.52 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 29 V 7.57 4.54 2.23 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 1.00 0.00 0.00 0.96 0.00 0.00 30 A 8.84 4.47 0.95 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 31 E 8.67 5.22 0.00 2.05 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 2.25 2.34 0.00 32 W 10.03 5.46 0.00 3.47 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 33 L 9.48 5.78 0.00 1.56 1.55 0.95 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.57 4.71 0.00 3.88 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 35 N 8.15 4.70 0.00 2.72 2.82 0.00 0.00 6.59 8.00 0.00 0.00 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 7.39 5.13 0.00 2.71 2.68 0.00 0.00 7.25 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 37 S 8.42 4.22 0.00 3.86 3.78 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 0.00 0.00 0.00 0.00 38 R 8.80 3.69 0.00 1.80 2.03 0.00 3.39 0.00 0.00 3.43 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.60 0.00 39 S 8.05 4.25 0.00 3.95 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 40 Q 8.58 4.42 0.00 1.97 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.20 2.41 0.00 41 A 7.34 4.91 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 42 Y 8.93 4.25 0.00 2.91 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 43 R 8.84 5.19 0.00 1.90 1.73 0.00 3.09 0.00 0.00 3.33 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.66 0.00 44 V 9.12 5.21 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 0.86 0.00 0.00 0.95 0.00 0.00 45 T 9.55 6.06 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 1.34 0.00 0.00 46 A 8.89 5.89 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 47 S 8.61 4.98 0.00 3.90 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 48 Y 8.59 4.80 0.00 2.58 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 49 R 8.05 4.59 0.00 1.60 1.62 0.00 3.14 0.00 0.00 3.13 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 50 A 8.22 4.46 1.08 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 0.00 0.00 51 S 8.68 4.19 0.00 3.83 3.61 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 52 G 8.61 4.06 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 0.00 53 A 8.45 4.41 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 54 D 7.47 4.59 0.00 2.63 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 55 K 8.13 5.14 0.00 1.88 1.66 0.00 1.61 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.38 7.81 56 R 8.99 4.84 0.00 1.68 1.28 0.00 3.01 0.00 0.00 2.92 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.68 0.00 57 K 8.66 5.04 0.00 1.72 1.54 0.00 1.62 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.56 7.81 58 Y 9.35 4.82 0.00 3.06 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 59 T 8.99 5.01 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 60 I 8.87 5.20 1.89 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.94 0.90 0.00 0.00 61 K 9.28 5.15 0.00 1.73 1.74 0.00 1.67 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.42 1.43 7.81 62 L 8.94 5.29 0.00 1.73 1.47 1.00 0.66 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 63 E 9.16 4.64 0.00 2.01 1.63 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 1.79 2.23 0.00 64 V 8.52 4.21 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 0.87 0.00 0.00 1.01 0.00 0.00 65 P 0.00 4.62 0.00 1.76 1.70 0.00 2.32 0.00 0.00 3.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.28 0.00 66 K 7.68 3.71 0.00 0.79 0.74 0.00 1.10 0.00 0.00 1.12 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.81 7.81 67 I 7.74 4.01 1.76 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 1.17 0.43 0.84 0.00 0.00 68 V 8.38 4.46 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 0.57 0.00 0.00 0.91 0.00 0.00 69 T 8.21 4.89 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 1.23 0.00 0.00 70 Q 8.80 4.33 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.68 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 71 V 8.03 4.94 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 0.71 0.00 0.00 0.93 0.00 0.00 72 V 8.72 4.25 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 1.09 0.00 0.00 0.93 0.00 0.00 73 N 9.84 4.16 0.00 2.88 2.85 0.00 0.00 7.15 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 74 G 8.36 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 75 V 7.88 4.39 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 1.00 0.00 0.00 0.99 0.00 0.00 76 E 8.76 5.14 0.00 1.99 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 0.00 2.20 2.32 0.00 77 L 8.88 4.94 0.00 1.53 1.52 0.92 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.72 0.00 2.04 2.05 0.00 3.69 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.94 0.00 79 V 8.73 4.51 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 0.91 0.00 0.00 0.95 0.00 0.00 80 S 8.27 4.94 0.00 3.93 3.61 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 81 A 8.74 4.18 1.04 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 0.00 0.00 0.00 0.00 0.00 82 W 6.49 4.35 0.00 3.46 3.21 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 0.00 83 K 9.19 5.27 0.00 1.37 1.18 0.00 1.73 0.00 0.00 1.44 0.00 0.00 2.68 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.16 1.42 7.81 84 A 9.11 4.95 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 8.85 5.18 0.00 2.81 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 86 A 8.93 4.88 1.21 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 0.00 0.00 0.00 87 S 8.78 5.08 0.00 3.90 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 88 I 9.09 4.75 1.88 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 1.16 0.46 0.94 0.00 0.00 89 D 8.91 5.37 0.00 2.54 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 90 L 9.12 4.85 0.00 1.79 1.74 0.91 0.82 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 91 T 8.69 5.19 4.29 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 1.24 0.00 0.00 92 I 8.94 4.75 2.03 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.96 1.00 0.00 0.00 93 P 0.00 5.00 0.00 2.22 2.18 0.00 3.66 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.17 0.00 94 I 8.31 3.89 1.62 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.69 -0.36 0.73 0.00 0.00 95 F 7.45 4.31 0.00 3.17 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 96 A 7.75 3.96 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 97 A 8.78 4.60 1.33 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 98 T 8.43 3.80 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 99 D 8.14 4.39 0.00 2.69 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 0.00 100 D 8.16 4.39 0.00 2.93 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 0.00 101 V 7.81 3.61 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 1.04 0.00 0.00 0.99 0.00 0.00 102 T 8.07 3.83 4.47 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 1.20 0.00 0.00 103 V 7.83 3.53 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 1.09 0.00 0.00 1.00 0.00 0.00 104 I 7.79 3.66 2.08 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 1.43 1.13 0.92 0.00 0.00 105 S 8.57 4.01 0.00 3.83 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 0.00 106 K 8.40 4.00 0.00 1.93 1.83 0.00 1.72 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.44 1.65 7.81 107 S 8.44 4.07 0.00 3.94 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 0.00 108 L 7.80 4.03 0.00 1.88 1.81 0.90 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.57 4.12 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 0.00 110 G 8.55 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 0.00 111 L 8.13 3.75 0.00 1.59 1.70 0.68 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.80 4.51 0.00 3.11 3.10 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 0.00 113 K 7.57 3.94 0.00 1.96 1.84 0.00 1.64 0.00 0.00 1.57 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.45 1.41 7.81 114 V 8.20 3.93 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 0.85 0.00 0.00 0.96 0.00 0.00 115 G 9.05 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 0.00 116 N 7.98 4.69 0.00 2.97 2.70 0.00 0.00 6.54 7.34 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 0.00 117 P 0.00 4.21 0.00 2.28 2.34 0.00 3.68 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 2.03 2.06 0.00 118 I 7.86 3.93 1.88 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.40 0.85 0.00 0.00 119 A 7.94 4.04 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 0.00 120 E 7.96 3.84 0.00 1.99 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 0.00 2.32 2.35 0.00 121 A 8.42 4.04 1.15 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 0.00 122 I 7.90 3.72 2.12 0.00 0.00 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.12 0.98 0.00 0.00 123 S 8.11 4.66 0.00 4.02 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 0.00 124 S 7.37 4.58 0.00 3.98 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 0.00 125 Q 8.25 3.40 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.14 6.85 0.00 0.00 0.00 0.00 0.00 2.25 2.35 0.00 126 S 7.97 4.69 0.00 3.82 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 0.00 127 G 8.14 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 0.00 128 F 8.27 4.39 0.00 3.11 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 0.00 129 Y 8.03 4.92 0.00 3.00 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 0.00 130 A 8.78 4.29 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00