NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4085 8.3044 118.1945 55.0220 32.0598 174.2329 2 L 3.8269 8.5042 120.9953 54.2672 42.6619 175.4664 3 N 4.3563 9.0375 121.0056 53.1811 40.8780 172.7758 4 R 4.7240 8.3580 123.9666 54.4506 34.4141 174.9207 5 V 4.3815 8.6356 123.1477 60.9622 35.2085 174.1975 6 F 4.7042 8.8177 125.0367 55.6583 41.4698 174.0851 7 L 4.8240 8.4919 124.4526 53.0826 45.6510 174.7682 8 E 5.1017 8.6488 125.0311 54.7539 32.9456 174.3341 9 G 4.2064 8.9039 112.2605 45.6516 0.0000 170.8314 10 E 4.9576 9.0077 121.2906 54.7759 31.2889 175.3168 11 I 4.2578 8.5365 128.4474 61.8449 37.0258 175.5057 12 E 4.5611 9.0710 127.7515 58.1647 30.9187 176.1075 13 S 4.7121 7.4738 111.7525 58.1960 65.9036 174.9800 14 S 4.7761 8.4940 111.5566 58.1500 64.8326 174.6579 15 C 4.7749 7.9250 116.1609 57.6130 33.3668 172.6297 16 W 5.2189 8.8014 119.0392 55.4168 30.8129 177.0269 17 S 4.4380 9.0528 118.0150 58.2846 63.4338 175.6065 18 V 3.6457 8.2864 119.9627 66.7246 31.2364 177.7059 19 K 4.1059 7.9599 115.7341 56.5906 31.9731 176.8833 20 K 4.2391 7.6921 118.9514 57.8168 31.0780 176.9639 21 T 4.1735 8.4454 115.4199 65.5239 68.8147 174.9010 22 G 4.3440 8.7482 107.1865 44.3104 0.0000 171.3832 23 F 4.7500 8.5812 123.0482 56.1257 41.1158 174.2596 24 L 4.7781 8.0388 127.0520 53.3285 43.6536 175.9734 25 V 4.4906 8.6720 123.0076 61.3316 35.0210 174.0354 26 T 5.0168 8.7969 124.6513 62.3263 70.3417 173.7988 27 I 5.0899 9.2286 127.2834 59.3389 40.8294 174.4591 28 K 4.8278 9.4388 126.4620 54.6382 35.2891 174.6783 29 Q 4.9124 9.2206 125.6902 54.2981 31.8274 174.0368 30 M 5.1226 8.5503 123.5291 53.7933 34.8098 174.2928 31 R 4.6813 9.4678 124.8298 55.4748 34.4247 173.6064 32 F 4.7645 8.7437 122.2487 57.0171 39.9369 174.4925 33 F 4.6020 9.7983 122.9988 58.5240 42.4991 176.8589 34 G 4.0521 8.6188 104.6254 45.8781 0.0000 174.8017 35 E 4.3915 9.5792 123.5460 56.9890 30.9485 176.4441 36 R 4.8564 7.8546 118.3167 54.1555 34.2605 174.1920 37 L 4.2573 7.7882 123.2547 54.3465 43.1581 175.7727 38 F 4.8817 10.0067 125.4856 55.7084 42.4724 174.1071 39 T 4.9751 8.6172 112.4877 59.9832 71.0979 172.7780 40 D 4.8823 10.2224 124.8251 52.5242 44.0068 174.6464 41 Y 4.8104 8.0434 119.0955 56.3137 40.7639 174.6535 42 Y 4.8797 9.2946 121.4685 56.1443 42.3668 174.7647 43 V 4.8670 8.6621 123.4385 61.5394 33.3111 174.4193 44 I 5.0710 8.6512 122.4256 59.7550 40.6956 173.9310 45 Y 5.3282 8.4692 120.2919 56.2481 41.9778 173.1658 46 A 4.9892 8.8526 120.4013 50.5305 23.1128 175.1236 47 N 5.1341 8.6631 117.1947 51.7780 41.2093 174.1453 48 G 4.0000 8.8247 105.9677 46.6982 0.0000 174.1893 49 Q 4.2871 8.8689 115.7562 59.3204 28.7645 178.4622 50 L 4.0293 7.7450 120.4168 57.7816 41.9486 178.5808 51 A 4.0392 8.2918 120.1722 54.3102 18.3451 178.5935 52 Y 4.1647 8.0755 115.2932 60.1100 38.5461 177.5676 53 E 4.0527 8.1991 120.0580 58.9400 29.7913 178.4704 54 L 3.9876 8.0015 120.6030 58.1995 41.7265 178.6435 55 E 3.8235 7.7653 118.9013 58.9033 29.3504 178.8952 56 K 4.0970 8.0628 118.6825 59.4542 32.1826 178.7645 57 H 4.3679 8.3187 118.2279 59.5442 29.5220 177.4474 58 T 4.0746 7.6791 116.6453 66.5363 68.3730 176.2704 59 K 4.2077 7.6122 118.3634 58.1002 32.2573 178.8210 60 K 3.9309 7.7381 119.3364 57.5825 32.7937 175.9672 61 Y 4.7533 7.5951 115.5419 56.0688 40.2108 176.0434 62 K 4.2912 8.6265 122.5351 58.0082 32.9116 176.2727 63 T 5.2363 7.7720 107.0735 60.0346 72.0666 173.0588 64 I 4.7427 8.6522 121.8870 59.4845 42.3575 173.8557 65 S 5.1942 8.5691 121.2025 56.8140 65.2544 172.5177 66 I 4.8051 8.9423 121.1738 59.1195 41.1189 173.4701 67 E 4.5699 8.7500 121.6128 54.8621 33.2570 175.5512 68 G 4.1014 7.3014 110.1281 46.2943 0.0000 171.6055 69 I 5.0272 7.3949 112.7686 58.7305 40.8615 174.7491 70 L 4.7078 9.4300 127.1816 55.2198 42.7719 176.1056 71 R 5.0415 9.2412 123.9165 55.0907 35.1491 173.8690 72 T 5.4668 8.5511 109.9231 60.8179 72.2996 172.2906 73 Y 5.1169 8.7627 119.2474 55.9933 41.9620 173.0278 74 L 3.9670 7.9122 122.7595 53.3739 43.2126 175.2745 75 E 3.8557 8.6702 128.8464 56.5221 29.7712 175.7403 76 R 3.7921 9.0732 127.6554 58.9676 30.0013 178.1511 77 K 4.5233 8.2517 124.4364 56.5308 32.4870 177.4227 78 S 4.5227 7.5636 111.2361 56.7358 66.7870 176.8829 79 E 3.8374 8.2476 116.3494 56.8564 30.4083 174.4828 80 I 4.2380 7.1668 120.4917 59.8651 39.2747 175.4049 81 W 4.6739 8.6769 126.0542 55.9668 29.2398 175.7398 82 K 4.4752 8.4540 125.5489 55.1616 33.7704 176.0198 83 T 5.0630 8.2876 119.7507 62.6988 70.7345 173.5218 84 T 4.8565 9.1863 119.0150 61.5767 72.1507 171.6736 85 I 4.8396 8.5047 123.6312 59.2820 40.2709 174.6900 86 E 3.3048 8.5169 128.4861 54.5369 30.7108 175.4851 87 I 4.0533 8.6558 129.6630 61.6930 37.3904 175.6461 88 V 4.1263 9.2632 126.3030 63.9824 33.3876 175.9948 89 K 4.4279 7.3711 120.1269 54.9822 35.5145 174.7144 90 I 4.3542 8.0770 127.4489 60.2534 38.6989 175.0961 91 F 4.9124 8.9266 124.3067 55.6057 41.7294 175.1402 92 N 4.5071 8.7501 119.4527 52.3691 39.1228 173.9783 93 P 4.1694 0.0000 0.0000 65.6910 31.1726 176.7775 94 K 4.3697 7.8698 117.9551 56.1412 31.9283 175.6136 95 N 4.9679 8.1646 114.5539 51.4348 41.5789 174.1520 96 E 4.3574 8.3830 122.4633 55.0079 32.0352 173.9384 97 I 3.8216 7.6299 117.9433 58.3043 39.4818 175.9733 98 V 3.4987 8.1304 127.2404 63.5840 31.9712 170.8483 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 8.30 4.41 0.00 2.14 2.08 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.53 0.00 2 L 8.50 3.83 0.00 1.69 1.62 0.94 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 3 N 9.04 4.36 0.00 2.64 2.65 0.00 0.00 6.93 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 4 R 8.36 4.72 0.00 1.70 1.77 0.00 3.04 0.00 0.00 3.01 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.63 0.00 5 V 8.64 4.38 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 0.86 0.00 0.00 0.86 0.00 0.00 6 F 8.82 4.70 0.00 2.95 2.96 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 7 L 8.49 4.82 0.00 1.62 1.33 0.51 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.65 5.10 0.00 1.97 1.75 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 2.38 2.24 0.00 9 G 8.90 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 10 E 9.01 4.96 0.00 2.08 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 2.30 2.50 0.00 11 I 8.54 4.26 1.95 0.00 0.00 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 1.31 0.86 0.97 0.00 0.00 12 E 9.07 4.56 0.00 2.10 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 2.41 2.79 0.00 13 S 7.47 4.71 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 14 S 8.49 4.78 0.00 3.21 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 15 C 7.93 4.77 0.00 3.04 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 16 W 8.80 5.22 0.00 3.28 3.30 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 0.00 0.00 0.00 17 S 9.05 4.44 0.00 4.02 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 18 V 8.29 3.65 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 0.80 0.00 0.00 0.93 0.00 0.00 19 K 7.96 4.11 0.00 1.80 1.85 0.00 1.94 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.44 1.42 7.81 20 K 7.69 4.24 0.00 1.76 1.74 0.00 1.40 0.00 0.00 1.26 0.00 0.00 2.13 0.00 0.00 2.45 0.00 0.00 0.00 0.00 0.42 0.59 7.81 21 T 8.45 4.17 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 1.25 0.00 0.00 22 G 8.75 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 23 F 8.58 4.75 0.00 1.59 2.41 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 24 L 8.04 4.78 0.00 1.45 1.42 0.73 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 25 V 8.67 4.49 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 1.11 0.00 0.00 0.65 0.00 0.00 26 T 8.80 5.02 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 1.34 0.00 0.00 27 I 9.23 5.09 1.97 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 1.16 0.62 1.08 0.00 0.00 28 K 9.44 4.83 0.00 1.50 1.49 0.00 1.14 0.00 0.00 1.39 0.00 0.00 2.75 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.97 0.42 7.81 29 Q 9.22 4.91 0.00 2.26 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.53 0.00 0.00 0.00 0.00 0.00 2.35 2.47 0.00 30 M 8.55 5.12 0.00 1.95 1.83 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 31 R 9.47 4.68 0.00 1.87 1.75 0.00 3.02 0.00 0.00 2.75 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.53 0.00 32 F 8.74 4.76 0.00 3.10 2.98 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 0.00 0.00 0.00 0.00 33 F 9.80 4.60 0.00 3.34 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 34 G 8.62 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 35 E 9.58 4.39 0.00 2.17 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 0.00 2.33 2.42 0.00 36 R 7.85 4.86 0.00 1.62 1.59 0.00 3.02 0.00 0.00 3.19 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.63 0.00 37 L 7.79 4.26 0.00 0.27 1.00 0.64 0.47 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 38 F 10.01 4.88 0.00 3.00 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 T 8.62 4.98 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 1.15 0.00 0.00 40 D 10.22 4.88 0.00 2.61 1.90 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 41 Y 8.04 4.81 0.00 2.71 2.75 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 42 Y 9.29 4.88 0.00 2.84 2.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 V 8.66 4.87 2.21 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 1.10 0.00 0.00 0.99 0.00 0.00 44 I 8.65 5.07 1.79 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.09 0.91 0.00 0.00 45 Y 8.47 5.33 0.00 2.95 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 46 A 8.85 4.99 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 47 N 8.66 5.13 0.00 2.85 3.05 0.00 0.00 6.15 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.82 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 0.00 0.00 0.00 49 Q 8.87 4.29 0.00 2.18 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.83 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 50 L 7.75 4.03 0.00 1.84 1.91 0.90 1.00 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 51 A 8.29 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 52 Y 8.08 4.16 0.00 3.28 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 53 E 8.20 4.05 0.00 2.09 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 0.00 2.41 2.41 0.00 54 L 8.00 3.99 0.00 2.01 1.84 0.95 0.80 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 55 E 7.77 3.82 0.00 1.16 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 2.18 1.91 0.00 56 K 8.06 4.10 0.00 2.10 1.89 0.00 1.79 0.00 0.00 1.63 0.00 0.00 2.95 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.52 1.85 7.81 57 H 8.32 4.37 0.00 3.51 3.59 0.00 5.79 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 7.68 4.07 4.58 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 1.38 0.00 0.00 59 K 7.61 4.21 0.00 1.85 1.88 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.17 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.81 1.62 7.81 60 K 7.74 3.93 0.00 1.85 1.12 0.00 1.43 0.00 0.00 1.57 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.94 1.28 7.81 61 Y 7.60 4.75 0.00 2.83 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 62 K 8.63 4.29 0.00 1.84 1.87 0.00 1.70 0.00 0.00 2.16 0.00 0.00 2.99 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.54 1.47 7.81 63 T 7.77 5.24 4.39 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 1.27 0.00 0.00 64 I 8.65 4.74 1.90 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 1.01 1.08 0.93 0.00 0.00 65 S 8.57 5.19 0.00 3.93 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 66 I 8.94 4.81 1.81 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.75 0.82 0.00 0.00 67 E 8.75 4.57 0.00 1.97 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.88 0.00 68 G 7.30 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 69 I 7.39 5.03 1.88 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.86 0.88 0.00 0.00 70 L 9.43 4.71 0.00 1.60 1.60 0.99 1.01 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 71 R 9.24 5.04 0.00 1.97 1.90 0.00 3.16 0.00 0.00 3.38 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.64 0.00 72 T 8.55 5.47 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 73 Y 8.76 5.12 0.00 3.06 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 74 L 7.91 3.97 0.00 0.27 0.99 0.51 0.45 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 75 E 8.67 3.86 0.00 1.98 1.77 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 2.34 2.43 0.00 76 R 9.07 3.79 0.00 1.87 1.70 0.00 3.14 0.00 0.00 3.22 7.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.56 0.00 77 K 8.25 4.52 0.00 1.67 1.77 0.00 1.62 0.00 0.00 1.68 0.00 0.00 3.05 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.40 1.50 7.81 78 S 7.56 4.52 0.00 3.92 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 79 E 8.25 3.84 0.00 2.20 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 0.00 2.15 2.23 0.00 80 I 7.17 4.24 1.78 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.60 0.87 0.00 0.00 81 W 8.68 4.67 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 82 K 8.45 4.48 0.00 0.79 1.51 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.78 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.23 1.19 7.81 83 T 8.29 5.06 4.30 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 0.00 0.00 1.35 0.00 0.00 84 T 9.19 4.86 4.54 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 1.82 0.00 0.00 85 I 8.50 4.84 1.79 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 1.02 0.45 0.75 0.00 0.00 86 E 8.52 3.30 0.00 1.61 1.58 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 2.05 1.95 0.00 87 I 8.66 4.05 1.72 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 0.95 0.60 0.83 0.00 0.00 88 V 9.26 4.13 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 0.68 0.00 0.00 0.81 0.00 0.00 89 K 7.37 4.43 0.00 1.63 1.18 0.00 1.66 0.00 0.00 1.33 0.00 0.00 3.03 0.00 0.00 2.69 0.00 0.00 0.00 0.00 0.82 1.25 7.81 90 I 8.08 4.35 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 1.27 0.45 0.77 0.00 0.00 91 F 8.93 4.91 0.00 3.06 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 92 N 8.75 4.51 0.00 2.78 2.73 0.00 0.00 6.61 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 93 P 0.00 4.17 0.00 2.03 1.85 0.00 3.56 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.44 0.00 94 K 7.87 4.37 0.00 1.70 1.99 0.00 1.64 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.46 1.46 7.81 95 N 8.16 4.97 0.00 2.84 2.62 0.00 0.00 6.79 7.21 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 96 E 8.38 4.36 0.00 1.85 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 97 I 7.63 3.82 1.54 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 0.90 0.47 0.42 0.00 0.00 98 V 8.13 3.50 1.96 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 0.61 0.00 0.00 0.83 0.00 0.00