NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.1804 8.2644 123.6064 51.0496 20.6045 177.9408 3 E 2.9067 7.5526 118.9284 58.6521 29.9812 173.0633 4 E 3.6943 7.7133 118.1401 58.9448 30.5571 177.0082 5 W 4.4708 7.3447 113.1394 57.1859 28.7422 174.6389 6 Y 5.0839 7.6530 122.0499 57.0733 37.8571 174.7616 7 F 4.3985 9.2704 126.3365 56.3712 40.9336 178.0166 8 G 3.5235 5.9209 110.7777 46.9725 0.0000 176.8315 9 K 4.5459 8.5823 119.0630 54.3030 30.3574 175.1883 10 I 4.6250 7.3892 114.5535 58.2741 40.8560 177.1955 11 T 4.1348 8.1038 112.4709 61.2961 70.9012 175.3835 12 R 3.7941 8.8790 122.5911 59.7250 30.0086 178.7950 13 R 3.8412 7.8778 117.6903 59.5742 30.1804 177.9835 14 E 3.9717 8.2696 119.2883 59.1544 29.5271 178.7964 15 S 4.0230 8.1737 114.4508 61.4781 62.8674 176.4615 16 E 3.9066 8.2803 122.1681 59.0012 28.9741 179.1429 17 R 3.8710 7.7631 117.7472 59.4978 30.2081 178.3219 18 L 4.1262 7.7568 117.4538 57.8574 41.5675 178.6306 19 L 4.1184 8.1423 118.9280 57.3969 41.8629 178.4604 20 L 4.3910 8.1219 116.4534 54.7634 41.4546 176.2592 21 N 4.3340 7.8196 118.7547 53.0051 38.9566 173.7863 22 P 4.2679 0.0000 0.0000 66.0047 31.1546 177.1980 23 E 4.1440 8.1348 116.2251 57.7432 29.6596 176.6194 24 N 4.6177 8.0964 118.0408 51.5794 39.4728 173.4994 25 P 4.3814 0.0000 0.0000 62.1997 32.0790 175.6470 26 R 3.9841 8.2684 120.0252 58.3064 30.4712 176.8259 27 G 4.0231 9.1504 113.2514 45.2007 0.0000 173.0912 28 T 4.7537 7.8345 117.6660 63.7479 69.6995 173.4721 29 F 5.6053 9.2497 120.2071 55.6519 42.2635 172.9035 30 L 4.9016 8.8772 117.7165 54.5970 44.0863 174.4286 31 V 5.1729 9.3047 120.8728 61.3595 34.2422 174.6550 32 R 4.9639 9.1416 123.0900 54.2309 33.5862 174.0233 33 E 4.4190 9.0252 119.5856 56.1387 30.2090 177.2127 34 S 4.1881 8.6591 119.1374 58.4232 62.5322 173.9532 35 E 4.1003 9.0571 127.6725 59.7982 29.4338 178.4592 36 T 4.0588 7.7663 106.2457 62.9703 69.7200 174.3561 37 T 4.4045 7.8090 119.1002 60.9864 69.2440 173.3391 38 K 4.1525 8.3599 126.1585 57.7501 32.5380 178.1536 39 G 3.8519 8.8783 110.9764 45.1332 0.0000 173.0065 40 A 4.7906 7.6092 121.3261 50.9538 21.8970 175.5132 41 Y 5.0500 8.8076 116.4993 56.4062 42.0068 174.3980 42 C 5.2420 9.7371 119.8761 57.8735 35.4855 172.2852 43 L 5.0232 9.4494 128.5045 53.9046 43.4756 174.8939 44 S 5.2722 9.1785 123.6931 56.8402 65.4198 173.6471 45 V 5.1502 8.6355 124.0623 61.0450 34.9774 174.6080 46 S 4.8676 9.2155 122.8003 58.2964 64.7503 172.5481 47 D 5.1493 9.2628 121.0384 52.8365 45.3273 173.4091 48 F 5.2952 8.7768 123.4085 56.4349 42.4897 173.5784 49 D 4.8300 7.8773 124.3963 52.1880 44.2770 175.7426 50 N 4.7341 8.6567 122.7870 50.3935 37.6346 173.0083 51 A 4.5282 7.0834 133.3982 52.8922 21.3080 178.3532 52 K 4.0381 8.0543 113.4750 56.7852 33.8081 179.2650 53 G 2.9906 7.9910 107.7705 44.9180 0.0000 173.0507 54 L 4.6688 8.2480 123.8237 55.2706 42.1835 176.3418 55 N 4.8818 8.9242 119.8869 52.0387 41.3665 173.1697 56 V 4.7958 8.1692 118.5669 61.0470 34.2218 174.5122 57 K 4.4832 8.8488 126.8902 55.0071 34.6446 174.8522 58 H 5.1750 8.2740 120.1022 54.1174 31.5872 172.8541 59 Y 4.5664 8.8438 121.0528 55.7093 40.5469 175.0156 60 K 4.5003 8.8297 126.8037 56.4795 33.3389 175.9245 61 I 4.5120 9.0810 129.1862 60.2841 38.6504 175.0183 62 R 4.8272 8.6379 126.9638 54.3414 32.8641 175.2813 63 K 4.7881 8.4140 123.2693 54.6344 33.3337 176.3330 64 L 4.3468 9.1765 128.3725 54.8138 42.3170 178.2127 65 D 4.3320 8.6704 121.9078 57.4502 40.9367 178.0536 66 S 4.1636 7.9607 110.9780 59.2045 62.9943 173.3972 67 G 4.0812 8.3049 111.4638 46.1369 0.0000 174.6070 68 G 3.9051 7.9664 106.0689 46.1754 0.0000 172.1249 69 F 5.8709 9.3849 118.5965 56.0911 42.0817 174.7560 70 Y 5.3297 8.9923 118.6902 56.9457 41.0391 175.0614 71 I 4.2182 9.0839 121.5205 62.9574 38.8946 176.1775 72 T 4.8426 7.7731 109.8221 59.5660 70.7321 175.2083 73 S 3.7505 9.0262 120.1732 61.9489 62.8689 175.8480 74 R 4.1043 7.8576 115.5809 56.8469 30.2511 176.2571 75 T 4.1889 7.8609 114.6044 61.8263 70.3294 173.1803 76 Q 4.8290 7.9439 124.7696 53.9236 31.6171 175.3608 77 F 4.8689 9.1231 118.4898 55.8793 42.4897 176.2252 78 S 4.7120 8.8318 116.5463 59.1916 63.9152 174.3934 79 S 4.9405 7.7622 115.2820 56.3706 66.5938 174.8920 80 L 3.5464 7.7947 122.9881 57.8834 41.2951 179.8502 81 Q 4.1528 8.0608 117.0788 59.1436 28.6842 178.1721 82 Q 3.9794 8.0300 121.3359 58.7143 29.1140 177.6592 83 L 2.4400 7.5312 121.4143 57.5748 42.0599 179.1761 84 V 3.1248 7.5358 118.0165 65.7875 30.2920 177.7962 85 A 3.9336 7.8020 120.5143 55.1273 18.1529 179.1136 86 Y 3.8246 7.7674 117.9928 61.0979 39.0502 177.3255 87 Y 4.9591 7.5595 117.3073 59.0944 37.8560 177.5887 88 S 4.3106 7.6158 116.9796 59.3890 63.0041 174.5749 89 K 4.1515 6.8525 122.0327 57.0797 33.4510 176.1530 90 H 4.7249 7.6466 114.9825 53.6146 32.2526 174.2496 91 A 3.8324 8.8020 127.1473 54.6169 18.9179 177.5129 92 D 4.4215 9.1464 112.8577 55.5561 39.6110 173.1768 93 G 4.1815 8.2953 106.7581 46.0931 0.0000 174.2718 94 L 4.0032 8.1928 120.0348 53.7602 42.2710 177.7513 95 C 4.0411 8.7720 115.8495 61.3791 29.6512 173.5049 96 H 4.3832 7.0736 116.1088 55.1059 32.8960 173.5192 97 R 4.0956 8.1248 124.2692 56.0546 30.4287 175.9401 98 L 4.2057 8.3723 123.8444 56.3894 42.4762 175.0174 99 T 4.4055 9.3700 112.6987 62.0787 70.4757 176.2694 100 N 4.7628 9.4562 115.1021 52.5499 40.9218 175.2796 101 V 3.4517 8.2670 121.9686 62.3198 32.5594 175.3177 102 C 4.2075 8.2861 128.6579 58.7939 31.8403 171.7482 103 P 4.3083 0.0000 0.0000 64.2749 31.6937 176.3781 104 T 3.5761 8.5915 110.8427 61.9406 68.7195 171.5435 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 8.26 4.18 1.68 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 0.00 0.00 0.00 0.00 0.00 0.00 3 E 7.55 2.91 0.00 1.94 1.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.21 0.00 4 E 7.71 3.69 0.00 1.83 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 2.29 2.35 0.00 5 W 7.34 4.47 0.00 3.43 3.05 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 6 Y 7.65 5.08 0.00 2.54 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 7 F 9.27 4.40 0.00 2.91 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 8 G 5.92 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 0.00 0.00 0.00 9 K 8.58 4.55 0.00 1.77 1.79 0.00 1.71 0.00 0.00 1.77 0.00 0.00 3.08 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.61 1.52 7.81 10 I 7.39 4.63 1.90 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 1.51 0.67 1.08 0.00 0.00 11 T 8.10 4.13 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 12 R 8.88 3.79 0.00 1.78 1.91 0.00 3.01 0.00 0.00 2.98 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.31 0.00 13 R 7.88 3.84 0.00 1.89 1.89 0.00 3.22 0.00 0.00 3.26 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.68 0.00 14 E 8.27 3.97 0.00 2.13 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 2.33 2.37 0.00 15 S 8.17 4.02 0.00 4.00 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 16 E 8.28 3.91 0.00 2.21 2.03 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 2.36 2.60 0.00 17 R 7.76 3.87 0.00 1.90 2.08 0.00 3.26 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 18 L 7.76 4.13 0.00 1.73 1.64 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.14 4.12 0.00 1.69 1.67 0.88 0.81 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 20 L 8.12 4.39 0.00 1.83 1.68 0.88 0.98 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 21 N 7.82 4.33 0.00 2.87 2.72 0.00 0.00 6.93 7.59 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 22 P 0.00 4.27 0.00 2.23 2.22 0.00 3.83 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 2.01 2.02 0.00 23 E 8.13 4.14 0.00 2.23 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 0.00 2.35 2.43 0.00 24 N 8.10 4.62 0.00 2.80 2.76 0.00 0.00 6.97 7.58 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 25 P 0.00 4.38 0.00 2.22 2.18 0.00 3.72 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 2.10 1.98 0.00 26 R 8.27 3.98 0.00 1.74 1.76 0.00 3.26 0.00 0.00 3.20 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 1.64 0.00 27 G 9.15 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 0.00 0.00 0.00 28 T 7.83 4.75 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 1.23 0.00 0.00 29 F 9.25 5.61 0.00 3.07 3.04 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 30 L 8.88 4.90 0.00 1.38 1.16 0.76 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 31 V 9.30 5.17 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 1.28 0.00 0.00 0.99 0.00 0.00 32 R 9.14 4.96 0.00 1.98 1.96 0.00 3.01 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.63 0.00 33 E 9.03 4.42 0.00 1.83 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 2.31 2.41 0.00 34 S 8.66 4.19 0.00 3.85 3.99 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 35 E 9.06 4.10 0.00 1.97 1.97 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 2.29 2.27 0.00 36 T 7.77 4.06 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 1.19 0.00 0.00 37 T 7.81 4.40 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 38 K 8.36 4.15 0.00 1.73 1.73 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.43 1.43 7.81 39 G 8.88 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 7.61 4.79 1.30 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 0.00 0.00 41 Y 8.81 5.05 0.00 3.07 3.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 C 9.74 5.24 0.00 2.95 2.76 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 43 L 9.45 5.02 0.00 1.75 1.61 0.97 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 44 S 9.18 5.27 0.00 3.77 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 45 V 8.64 5.15 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 1.15 0.00 0.00 1.04 0.00 0.00 46 S 9.22 4.87 0.00 3.92 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 47 D 9.26 5.15 0.00 2.77 2.48 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 48 F 8.78 5.30 0.00 3.02 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 49 D 7.88 4.83 0.00 2.57 2.40 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 50 N 8.66 4.73 0.00 2.88 2.83 0.00 0.00 6.94 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 51 A 7.08 4.53 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 K 8.05 4.04 0.00 1.60 1.72 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.34 1.41 7.81 53 G 7.99 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 0.00 0.00 0.00 54 L 8.25 4.67 0.00 1.53 1.64 1.18 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 55 N 8.92 4.88 0.00 2.75 2.79 0.00 0.00 5.99 7.50 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 56 V 8.17 4.80 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 0.62 0.00 0.00 0.89 0.00 0.00 57 K 8.85 4.48 0.00 1.62 1.20 0.00 1.57 0.00 0.00 1.55 0.00 0.00 2.89 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.58 7.81 58 H 8.27 5.17 0.00 2.86 3.10 0.00 5.64 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 59 Y 8.84 4.57 0.00 2.82 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 60 K 8.83 4.50 0.00 1.78 1.74 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.88 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.49 7.81 61 I 9.08 4.51 2.09 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 1.09 0.00 0.00 62 R 8.64 4.83 0.00 0.67 1.64 0.00 3.06 0.00 0.00 3.10 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.34 0.00 63 K 8.41 4.79 0.00 1.83 1.73 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.20 0.86 7.81 64 L 9.18 4.35 0.00 1.74 1.58 0.72 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 65 D 8.67 4.33 0.00 2.67 2.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 66 S 7.96 4.16 0.00 3.94 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 67 G 8.30 4.08 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 0.00 68 G 7.97 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 F 9.38 5.87 0.00 3.10 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 70 Y 8.99 5.33 0.00 3.39 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 71 I 9.08 4.22 1.95 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.69 0.92 0.00 0.00 72 T 7.77 4.84 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 1.33 0.00 0.00 73 S 9.03 3.75 0.00 3.87 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 74 R 7.86 4.10 0.00 1.79 1.93 0.00 3.13 0.00 0.00 3.22 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 75 T 7.86 4.19 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 0.61 0.00 0.00 76 Q 7.94 4.83 0.00 1.83 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.77 0.00 0.00 0.00 0.00 0.00 2.11 2.15 0.00 77 F 9.12 4.87 0.00 3.15 3.05 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 78 S 8.83 4.71 0.00 4.05 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 79 S 7.76 4.94 0.00 4.07 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 80 L 7.79 3.55 0.00 1.53 1.61 0.29 0.19 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 81 Q 8.06 4.15 0.00 2.39 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.92 0.00 0.00 0.00 0.00 0.00 2.48 2.44 0.00 82 Q 8.03 3.98 0.00 2.25 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.47 0.00 83 L 7.53 2.44 0.00 1.13 1.41 0.94 0.70 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 84 V 7.54 3.12 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 0.35 0.00 0.00 -0.31 0.00 0.00 85 A 7.80 3.93 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 Y 7.77 3.82 0.00 3.12 2.64 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 7.56 4.96 0.00 2.82 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 88 S 7.62 4.31 0.00 3.89 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 89 K 6.85 4.15 0.00 1.80 1.43 0.00 1.27 0.00 0.00 1.33 0.00 0.00 2.87 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.20 1.36 7.81 90 H 7.65 4.72 0.00 2.59 2.93 0.00 5.67 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 A 8.80 3.83 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 92 D 9.15 4.42 0.00 2.76 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 93 G 8.30 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 0.00 0.00 0.00 0.00 94 L 8.19 4.00 0.00 1.71 1.45 -0.13 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 95 C 8.77 4.04 0.00 3.39 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 96 H 7.07 4.38 0.00 3.17 3.16 0.00 5.76 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 R 8.12 4.10 0.00 1.68 1.63 0.00 3.18 0.00 0.00 3.13 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.54 0.00 98 L 8.37 4.21 0.00 1.14 0.40 0.13 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 99 T 9.37 4.41 4.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 100 N 9.46 4.76 0.00 2.76 2.81 0.00 0.00 6.47 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 0.00 101 V 8.27 3.45 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 0.00 0.00 1.04 0.00 0.00 102 C 8.29 4.21 0.00 2.90 2.52 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 0.00 103 P 0.00 4.31 0.00 2.11 2.00 0.00 3.75 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 2.05 2.10 0.00 104 T 8.59 3.58 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 1.23 0.00 0.00