NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 H 4.7237 8.4449 116.3447 55.4601 29.1638 173.1295 6 S 4.1672 8.4410 116.3519 57.5158 63.5566 171.2853 7 A 4.7569 7.8244 123.7873 49.3164 22.5972 173.9207 8 P 4.3802 0.0000 0.0000 62.5390 31.8938 175.7192 9 A 4.9894 8.2236 124.2185 49.4655 22.1975 175.3831 10 I 4.0300 8.2427 120.9963 62.0639 38.6332 174.7429 11 A 5.0508 8.5225 125.8187 50.2265 21.9894 175.2319 12 I 4.7904 8.7048 122.2080 59.3543 41.2311 174.4201 13 A 5.1853 9.3976 128.8496 50.4066 21.3671 175.4439 14 V 4.7138 8.9138 117.1414 60.1755 33.8903 175.2507 15 I 5.2517 8.4248 127.2012 59.3074 38.5893 175.7561 16 D 4.3178 8.2237 125.6533 57.8465 38.2964 174.4368 17 G 4.5340 8.2693 102.0221 46.1805 0.0000 175.3391 18 C 4.2380 7.9359 115.3554 59.2085 29.6654 174.8591 19 D 4.3904 8.0003 121.6475 56.5054 38.3157 178.8267 20 G 3.5908 7.9911 106.3295 47.9106 0.0000 175.2413 21 L 3.8778 8.1237 121.0628 56.2491 41.6063 178.4807 22 W 5.2445 7.2940 117.2200 56.6436 29.3303 177.7525 23 R 3.9261 8.1055 120.3359 60.3493 29.3856 178.0377 24 E 4.1953 8.1986 116.7263 58.5127 29.5069 179.0089 25 V 3.9266 7.8709 118.2344 65.3476 31.6441 177.5406 26 L 3.8858 7.8735 118.1502 56.8204 41.3741 179.3938 27 L 4.2030 7.8378 119.2642 57.8397 41.7879 179.4582 28 G 3.7805 8.2248 105.4140 48.3138 0.0000 174.7722 29 I 4.0083 7.9259 122.3274 63.4797 37.1527 177.2659 30 E 3.9011 8.7269 120.8105 59.6754 29.3063 179.3735 31 E 3.9856 8.2626 118.7434 59.1523 29.9052 177.9627 32 E 4.2999 8.1870 115.7386 56.8855 29.6381 177.7037 33 G 3.9282 7.7775 107.6795 45.3701 0.0000 173.1777 34 I 4.3791 7.3561 119.8415 58.7776 38.9926 173.7856 35 P 4.5693 0.0000 0.0000 62.8130 32.6683 175.0072 36 F 5.6283 7.9011 115.3692 55.8318 41.4978 173.4271 37 R 4.9711 8.9619 116.8092 54.5993 34.4873 174.2728 38 L 5.2245 8.6552 120.8553 53.1395 44.5011 175.8103 39 Q 4.4399 9.0693 123.6729 54.7272 32.1708 173.4258 40 H 5.1884 8.9535 124.1476 55.3427 30.0473 174.3544 41 H 4.8748 9.1312 121.1704 53.2441 30.3799 172.6895 42 P 4.3182 0.0000 0.0000 65.6569 31.0552 176.1453 43 A 4.8867 7.8055 121.2410 49.1037 22.5741 174.5733 44 G 3.9711 7.7955 108.3823 44.4018 0.0000 172.8368 45 E 4.1704 7.9184 120.2502 55.4823 30.7227 176.4282 46 V 3.5526 8.6036 126.4135 66.7043 31.5454 178.1136 47 V 3.5941 7.9515 116.7181 66.0313 31.6504 177.4207 48 D 4.4301 8.9387 118.1947 57.4953 40.9433 178.2867 49 S 4.0858 8.2165 115.2653 61.7580 62.8429 176.2965 50 A 4.0242 8.3678 123.6369 55.1912 18.0436 179.5459 51 W 3.8714 8.3075 126.3486 60.8826 30.6800 178.1742 52 Q 3.8953 8.5984 116.7209 58.8024 28.3254 178.9140 53 A 4.0409 8.7593 121.9749 55.1861 18.0173 179.2479 54 A 3.8351 8.0828 119.5372 55.6999 18.1344 180.1194 55 R 3.5446 7.7237 115.7728 58.8792 30.0408 178.8720 56 S 4.3147 7.7242 113.1842 59.2100 63.7864 174.6898 57 S 4.2937 7.3169 118.0619 56.8808 62.5638 173.0617 58 P 3.7266 0.0000 0.0000 65.2961 31.4313 176.9609 59 L 4.2313 7.7968 118.2703 54.5419 41.9265 178.7510 60 L 3.9087 8.8173 119.2917 55.0612 41.1129 173.8368 61 V 4.6969 7.6693 120.0400 61.7632 32.9010 175.0615 62 G 4.3392 8.8795 113.7798 44.5498 0.0000 171.3366 63 I 5.2676 9.6287 122.0102 59.3022 41.4938 174.4426 64 A 5.3311 8.3601 125.0637 50.7712 23.3162 174.7313 65 C 4.9225 8.8055 113.5335 57.4481 33.2457 173.1811 66 D 5.6700 8.4783 122.8902 52.0330 41.3925 176.3871 67 R 4.0990 8.8146 116.5307 58.6954 30.7665 176.4026 68 H 4.9847 9.5003 115.6948 57.1571 30.8254 174.4689 69 M 5.6473 8.1691 114.3109 53.9228 34.9837 173.4024 70 L 4.8615 7.7476 119.6565 53.8888 44.0212 175.2761 71 V 4.7094 8.2565 118.6883 61.1648 35.3868 174.2524 72 V 4.0653 8.3917 127.9146 62.7243 32.9538 174.2863 73 H 5.4084 9.2033 126.5846 54.5602 34.2675 171.0585 74 Y 5.3802 8.6914 120.6966 55.6355 41.6020 175.5664 75 K 3.2978 8.3735 127.9882 59.5365 32.2504 177.2864 76 N 4.5145 6.8612 112.3541 53.6976 38.8731 175.1056 77 L 4.4514 7.6457 119.1633 53.0837 42.7975 174.5980 78 P 4.3310 0.0000 0.0000 62.1186 32.0081 177.0133 79 A 2.5800 8.0135 126.0197 54.9670 17.9182 178.6331 80 S 4.1117 7.6038 109.0485 60.2610 63.0014 174.5901 81 A 4.4250 8.3405 123.8833 49.5316 19.0922 173.8931 82 P 4.1096 0.0000 0.0000 62.0871 32.5644 177.0466 83 L 3.9861 7.8276 120.4600 57.1031 41.8214 176.3047 84 F 5.3582 7.6353 116.8924 55.8093 42.5409 173.5947 85 T 4.8971 8.5503 116.1488 60.1430 69.8823 172.4485 86 L 4.6070 8.5966 130.9219 53.3930 44.5277 175.0002 87 M 4.2744 9.4028 127.5774 55.3778 32.6343 176.1156 88 H 4.4077 9.3467 125.5653 59.9791 29.2331 175.9851 89 H 3.8378 8.3480 112.3931 58.5645 28.2808 175.6561 90 Q 4.1269 7.3798 117.7407 55.2012 28.7891 176.1431 91 D 4.5984 8.4999 121.1913 53.2833 41.3120 177.5715 92 S 4.0963 8.5867 114.3881 61.8291 62.6578 175.7427 93 Q 3.8680 8.2915 122.0830 59.5283 28.1661 178.7327 94 A 4.0363 8.1483 120.6117 54.9026 18.4080 179.2304 95 H 4.1563 7.8312 114.7968 58.9431 28.9979 177.8141 96 R 4.1938 8.5936 120.8382 59.3918 29.9170 178.1483 97 N 4.4119 8.3102 117.5880 56.4137 38.5205 177.4680 98 T 3.7383 7.4296 116.5072 66.5516 68.3084 176.3450 99 G 3.7656 7.4012 106.7825 48.0778 0.0000 174.6477 100 N 4.8304 8.6274 120.6757 55.5844 38.4667 176.6587 101 N 4.5333 9.1649 117.5387 57.0117 38.7179 177.3147 102 A 4.1303 8.2371 120.9850 54.3307 18.5457 178.4689 103 A 4.5925 8.9962 119.4167 53.3203 20.7650 178.7926 104 R 3.9729 8.1221 116.2815 59.4030 30.0397 178.7409 105 L 4.0049 8.7238 120.5611 58.3040 42.0107 179.2343 106 V 3.7123 7.4265 116.1838 64.8997 31.4297 176.8974 107 K 4.5337 7.7141 114.8373 54.5923 33.6408 175.5588 108 G 3.9180 7.7306 107.1921 46.7058 0.0000 173.5523 109 I 4.4504 7.1074 109.7154 57.5915 40.2405 173.9932 110 P 4.1167 0.0000 0.0000 62.6032 31.8001 176.3814 111 F 4.9421 8.1431 119.0184 57.4637 39.6599 175.6717 112 R 4.2592 10.0644 125.0112 56.1840 31.1832 176.0032 113 D 4.8418 8.5662 119.1460 54.4215 41.7791 174.0506 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 5 H 8.44 4.72 0.00 3.29 3.21 0.00 5.49 0.00 0.00 0.00 0.00 7.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6 S 8.44 4.17 0.00 3.97 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 7 A 7.82 4.76 1.16 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 0.00 0.00 8 P 0.00 4.38 0.00 2.20 2.08 0.00 3.69 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 9 A 8.22 4.99 1.23 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 0.00 0.00 0.00 10 I 8.24 4.03 2.02 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 1.21 1.12 0.93 0.00 0.00 11 A 8.52 5.05 1.19 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 0.00 0.00 0.00 12 I 8.70 4.79 1.97 0.00 0.00 0.42 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 0.71 0.84 0.00 0.00 13 A 9.40 5.19 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 14 V 8.91 4.71 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 0.82 0.00 0.00 0.75 0.00 0.00 15 I 8.42 5.25 1.96 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 1.30 0.06 1.04 0.00 0.00 16 D 8.22 4.32 0.00 2.96 2.78 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 17 G 8.27 4.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 C 7.94 4.24 0.00 3.10 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 19 D 8.00 4.39 0.00 3.08 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 20 G 7.99 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 L 8.12 3.88 0.00 0.27 0.60 0.64 -0.47 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 22 W 7.29 5.24 0.00 3.34 3.02 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 23 R 8.11 3.93 0.00 1.89 1.99 0.00 3.19 0.00 0.00 3.36 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 24 E 8.20 4.20 0.00 2.09 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 2.43 2.32 0.00 25 V 7.87 3.93 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 0.99 0.00 0.00 1.09 0.00 0.00 26 L 7.87 3.89 0.00 1.95 1.72 0.87 0.30 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 27 L 7.84 4.20 0.00 1.94 1.77 1.02 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 28 G 8.22 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 0.00 0.00 0.00 29 I 7.93 4.01 2.39 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 1.72 0.85 1.26 0.00 0.00 30 E 8.73 3.90 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.26 0.00 31 E 8.26 3.99 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 2.35 2.42 0.00 32 E 8.19 4.30 0.00 2.14 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 2.45 2.52 0.00 33 G 7.78 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 34 I 7.36 4.38 1.95 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 1.52 0.96 0.96 0.00 0.00 35 P 0.00 4.57 0.00 2.07 2.10 0.00 3.67 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 2.29 1.94 0.00 36 F 7.90 5.63 0.00 2.89 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 37 R 8.96 4.97 0.00 1.77 1.86 0.00 3.28 0.00 0.00 3.17 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.76 0.00 38 L 8.66 5.22 0.00 1.55 1.50 1.01 0.77 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 39 Q 9.07 4.44 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.91 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 40 H 8.95 5.19 0.00 3.04 3.25 0.00 5.90 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 41 H 9.13 4.87 0.00 3.08 3.20 0.00 5.64 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 P 0.00 4.32 0.00 2.14 2.33 0.00 3.75 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 2.13 2.05 0.00 43 A 7.81 4.89 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 44 G 7.80 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 45 E 7.92 4.17 0.00 2.02 1.85 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 2.38 2.30 0.00 46 V 8.60 3.55 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 1.08 0.00 0.00 0.97 0.00 0.00 47 V 7.95 3.59 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 0.99 0.00 0.00 0.93 0.00 0.00 48 D 8.94 4.43 0.00 2.79 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 49 S 8.22 4.09 0.00 4.21 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 50 A 8.37 4.02 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 51 W 8.31 3.87 0.00 3.26 3.38 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 52 Q 8.60 3.90 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.73 0.00 0.00 0.00 0.00 0.00 2.74 2.83 0.00 53 A 8.76 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 54 A 8.08 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 55 R 7.72 3.54 0.00 1.48 1.64 0.00 2.21 0.00 0.00 2.42 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.50 0.00 56 S 7.72 4.31 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 57 S 7.32 4.29 0.00 3.90 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 58 P 0.00 3.73 0.00 2.21 2.16 0.00 3.81 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.98 0.00 59 L 7.80 4.23 0.00 1.73 1.77 0.98 0.56 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 60 L 8.82 3.91 0.00 2.08 1.95 0.95 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 61 V 7.67 4.70 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 0.99 0.00 0.00 0.98 0.00 0.00 62 G 8.88 4.34 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 0.00 63 I 9.63 5.27 1.76 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.95 0.72 0.00 0.00 64 A 8.36 5.33 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 65 C 8.81 4.92 0.00 2.43 2.31 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 66 D 8.48 5.67 0.00 2.95 2.93 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 67 R 8.81 4.10 0.00 1.85 1.92 0.00 3.21 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.68 0.00 68 H 9.50 4.98 0.00 3.11 3.42 0.00 5.61 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 M 8.17 5.65 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 70 L 7.75 4.86 0.00 1.24 0.44 0.17 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 71 V 8.26 4.71 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 0.98 0.00 0.00 0.88 0.00 0.00 72 V 8.39 4.07 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.77 0.00 0.00 0.97 0.00 0.00 73 H 9.20 5.41 0.00 3.27 3.26 0.00 5.58 0.00 0.00 0.00 0.00 6.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 8.69 5.38 0.00 2.92 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 75 K 8.37 3.30 0.00 1.60 1.42 0.00 1.61 0.00 0.00 1.49 0.00 0.00 2.66 0.00 0.00 2.75 0.00 0.00 0.00 0.00 1.18 0.96 7.81 76 N 6.86 4.51 0.00 2.22 2.73 0.00 0.00 6.93 7.85 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 77 L 7.65 4.45 0.00 2.11 1.77 1.06 0.97 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 78 P 0.00 4.33 0.00 2.12 2.14 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 2.04 1.95 0.00 79 A 8.01 2.58 -0.38 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 80 S 7.60 4.11 0.00 3.77 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 81 A 8.34 4.43 1.14 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 82 P 0.00 4.11 0.00 2.11 1.61 0.00 3.69 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.86 0.00 83 L 7.83 3.99 0.00 1.46 1.46 0.59 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 84 F 7.64 5.36 0.00 2.85 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 85 T 8.55 4.90 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 1.20 0.00 0.00 86 L 8.60 4.61 0.00 1.62 1.25 0.89 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 87 M 9.40 4.27 0.00 1.58 2.04 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.65 0.00 88 H 9.35 4.41 0.00 3.13 3.75 0.00 5.80 0.00 0.00 0.00 0.00 6.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 89 H 8.35 3.84 0.00 3.22 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 Q 7.38 4.13 0.00 2.05 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.94 0.00 0.00 0.00 0.00 0.00 2.17 2.59 0.00 91 D 8.50 4.60 0.00 2.87 2.83 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 92 S 8.59 4.10 0.00 4.07 4.16 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 93 Q 8.29 3.87 0.00 2.21 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 94 A 8.15 4.04 1.36 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 95 H 7.83 4.16 0.00 3.36 3.45 0.00 5.62 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 96 R 8.59 4.19 0.00 1.90 1.94 0.00 3.22 0.00 0.00 3.48 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.74 0.00 97 N 8.31 4.41 0.00 2.70 2.76 0.00 0.00 6.58 6.61 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 98 T 7.43 3.74 4.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 99 G 7.40 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 0.00 0.00 0.00 100 N 8.63 4.83 0.00 2.88 3.00 0.00 0.00 6.54 6.95 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 0.00 101 N 9.16 4.53 0.00 2.58 2.58 0.00 0.00 7.07 7.91 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 0.00 102 A 8.24 4.13 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 A 9.00 4.59 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 0.00 104 R 8.12 3.97 0.00 2.35 2.33 0.00 3.47 0.00 0.00 3.63 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.88 0.00 105 L 8.72 4.00 0.00 2.16 1.92 1.03 0.46 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 0.00 106 V 7.43 3.71 2.27 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 0.91 0.00 0.00 0.96 0.00 0.00 107 K 7.71 4.53 0.00 1.73 1.78 0.00 1.97 0.00 0.00 1.83 0.00 0.00 3.07 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.34 1.75 7.81 108 G 7.73 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 I 7.11 4.45 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 1.45 0.75 0.89 0.00 0.00 110 P 0.00 4.12 0.00 2.03 1.96 0.00 3.63 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 111 F 8.14 4.94 0.00 3.13 2.84 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 0.00 112 R 10.06 4.26 0.00 1.82 1.99 0.00 3.47 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 113 D 8.57 4.84 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