NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.3781 8.2549 117.2761 55.9345 31.4533 173.3520 3 H 3.9120 9.2074 120.8487 55.9365 28.1549 173.1966 4 L 4.0192 9.4759 129.9567 55.7811 44.2401 176.0484 5 K 4.4408 9.4117 118.7260 57.2731 34.9438 179.2797 6 S 4.0648 8.3724 113.2478 57.9977 61.7236 174.0853 7 G 3.5909 10.1638 99.5634 44.0659 0.0000 173.8198 8 R 4.3354 8.7446 124.7751 55.6684 27.8640 175.1297 9 K 4.0970 8.2418 121.0439 56.9482 33.3220 177.4351 10 L 4.1303 7.8846 114.6357 54.6241 44.8309 173.8261 11 N 4.6481 8.7637 122.3742 52.7051 41.0395 174.3782 12 R 3.9652 9.8404 119.7509 56.1758 29.1965 175.6755 13 H 4.9867 7.7499 113.2468 54.1151 32.3415 174.6595 14 S 3.4310 8.6575 110.1273 61.4790 63.0883 176.1549 15 S 4.1754 8.8616 117.0586 61.3907 63.0767 176.4592 16 H 4.0873 7.9519 120.7733 59.0303 29.7961 177.0151 17 R 3.4212 8.3879 121.5331 59.1197 29.9354 178.0821 18 L 3.4972 8.1261 120.1528 57.9791 42.0445 178.7223 19 A 3.9463 7.8360 120.6211 54.9765 18.1553 179.0020 20 L 3.8122 7.9086 119.1565 58.8012 42.0540 178.6583 21 Y 4.2155 7.4050 116.2316 61.4325 37.6054 179.2921 22 R 4.3089 7.8720 118.4552 59.3470 29.7803 178.2599 23 N 4.6404 8.3935 114.3474 54.5953 38.6164 176.6677 24 Q 4.1064 7.7871 119.9852 57.6127 29.6840 177.7006 25 A 4.0631 8.3552 121.8792 55.0580 18.4282 179.4994 26 K 3.8624 8.4255 117.4478 59.9933 32.1042 179.6431 27 S 4.1484 7.6969 114.5325 61.6999 62.6631 176.1696 28 L 3.9336 8.3350 121.9142 58.5549 41.7204 178.8707 29 L 4.2300 8.1558 117.9380 57.9469 41.8246 178.8713 30 T 3.9453 7.9484 114.8184 68.6086 68.9864 174.8631 31 H 4.8126 8.6898 124.5398 56.0362 29.3444 175.4693 32 G 4.0774 8.9281 105.1288 48.5206 0.0000 172.7131 33 R 5.2385 8.0873 117.8436 54.1333 32.8639 175.3951 34 I 4.8103 8.5265 121.4681 60.0831 42.3498 174.6205 35 T 4.9701 8.4038 119.3760 62.6838 71.6511 173.0684 36 T 4.7714 8.3439 118.7862 60.6890 72.4878 173.5441 37 T 4.6445 8.5071 109.4803 60.8526 70.0585 175.0172 38 V 3.4899 8.3589 122.0548 66.2804 31.3828 176.4887 39 P 4.1930 0.0000 0.0000 65.6707 31.1965 178.4584 40 K 3.8782 7.6610 116.2050 59.9069 32.0628 177.6087 41 A 4.2113 8.2227 121.3420 53.8736 18.4433 179.5224 42 K 3.8623 8.4763 118.0179 59.2277 32.2522 178.5094 43 E 4.0193 8.2003 119.5284 58.7171 29.7068 177.9250 44 L 3.6326 7.9304 120.8956 58.9932 42.0295 178.3008 45 R 3.6855 8.2967 111.9829 60.3334 29.0117 178.0100 46 G 3.7802 8.1249 104.6588 47.2193 0.0000 174.5290 47 F 4.1656 7.7170 122.4014 61.0297 39.1819 177.5354 48 V 3.2740 7.9367 117.6366 66.5225 31.4967 177.1990 49 D 4.0802 8.2217 117.5936 57.9987 40.6649 178.9727 50 H 3.8358 8.3103 117.9220 59.3871 29.9584 177.0060 51 L 3.8188 6.8727 118.9695 57.8980 41.8120 179.4023 52 I 3.5858 7.6449 119.9129 64.5676 36.8325 178.0698 53 H 3.7638 8.2165 119.2219 58.9145 29.4392 177.2621 54 L 3.9269 7.7191 120.6160 57.0934 41.2324 178.6808 55 A 2.5800 7.1754 119.1381 53.2771 18.3893 179.2745 56 K 3.9453 7.0650 116.8747 58.0799 32.3013 177.7747 57 R 4.3355 6.8594 116.1348 55.3970 31.0479 176.1825 58 G 4.1688 8.2023 105.5567 45.1147 0.0000 172.9999 59 D 4.3923 8.1079 118.9441 53.2651 40.0624 177.1886 60 L 3.8506 9.0157 123.9718 58.9815 41.8779 178.6635 61 H 4.0173 8.4464 117.1437 59.6576 29.6057 176.4944 62 A 4.0218 8.2926 122.1800 54.9783 18.0968 179.5435 63 R 3.4010 7.9543 116.7927 59.6835 30.2298 178.9173 64 R 3.8747 8.3363 118.2605 59.0430 29.8463 178.7967 65 L 3.9215 8.2590 119.7196 57.7315 42.1778 178.5892 66 V 3.8828 8.0686 118.3942 64.8913 31.5255 177.2840 67 L 4.1704 7.8984 118.9105 56.9458 41.8604 178.7920 68 R 4.0637 7.2941 116.9756 60.1448 30.2085 177.5651 69 D 4.5478 7.9057 117.3842 57.3411 41.3830 176.8580 70 L 4.2087 7.6540 119.3545 54.8673 42.1311 177.1843 71 Q 4.3216 8.5302 122.9623 56.4623 30.1377 175.0074 72 D 4.5487 7.7960 118.0238 54.0711 42.3454 176.6533 73 V 3.5101 8.3947 126.0869 66.0486 31.8516 178.0132 74 K 3.8445 8.2060 118.8463 59.6714 31.7118 178.1145 75 L 4.0180 7.8494 119.2616 57.8251 41.9736 178.9568 76 V 3.5898 7.4944 118.1323 66.2291 31.3862 177.7724 77 R 3.9350 8.4182 118.2763 59.0070 29.5621 178.5557 78 K 3.8492 8.3073 119.2846 60.1241 32.0357 178.2853 79 L 3.9788 8.3608 120.9751 58.1442 41.8970 178.4385 80 F 3.9898 9.3776 118.5801 59.5879 40.4140 176.2842 81 D 4.7880 8.0122 119.5332 50.2108 38.1161 175.4780 82 E 5.4567 7.0960 129.5351 56.2400 31.5238 176.4133 83 I 4.3202 6.5422 117.1408 62.5279 39.0678 177.2071 84 A 4.1512 8.4791 121.4056 55.1768 18.1441 177.8961 85 P 4.1939 0.0000 0.0000 65.8094 31.3234 178.6237 86 R 4.0222 7.5117 112.8130 57.6869 30.0808 176.5874 87 Y 4.8190 7.7542 115.1885 57.2664 40.0483 177.6035 88 R 3.3537 7.7814 120.4659 58.8946 30.3545 176.3199 89 D 4.8313 8.0892 114.8143 53.6046 41.3460 175.1812 90 R 4.3790 8.7063 121.5877 54.5854 30.9407 176.3890 91 Q 4.1026 8.4069 127.9534 54.6981 27.5261 175.8977 92 G 3.9389 7.9284 108.0201 45.1031 0.0000 170.7658 93 G 3.8095 8.1797 105.5945 46.7051 0.0000 173.2072 94 Y 4.1163 7.7185 115.1832 58.6523 39.8308 176.4043 95 T 5.0735 7.8411 113.4202 60.0460 70.5737 172.7601 96 R 4.7489 9.0131 127.2150 54.5432 33.7856 174.5981 97 V 5.2654 8.2169 123.3841 60.4946 34.1493 174.1595 98 L 4.9963 8.6005 127.7137 52.6762 45.2016 175.4857 99 K 4.8294 8.5423 121.3157 55.6432 34.2711 175.7920 100 L 4.6107 8.4021 123.4799 53.3561 42.9270 176.7561 101 A 4.0745 8.3934 125.1720 52.9925 19.1640 173.6049 102 E 3.9404 8.7321 125.2671 56.3465 28.8579 175.1156 103 R 4.6021 8.1742 122.0465 54.4657 32.8894 176.0142 104 R 3.9681 8.2327 121.1831 56.5085 30.9600 176.0037 105 R 4.0935 8.8370 126.6842 56.9092 29.4281 176.8232 106 G 5.0981 8.3816 126.5747 45.4285 0.0000 170.6880 107 D 5.2445 8.4983 129.2509 53.2670 40.2575 177.3430 108 G 3.8017 7.5125 106.6351 46.5646 0.0000 172.7197 109 A 4.8290 7.9121 123.0715 49.2747 21.7746 175.8719 110 P 4.4524 0.0000 0.0000 63.4330 32.6433 175.1715 111 L 5.0924 8.5674 120.6748 53.0615 45.3193 175.1609 112 A 5.2949 9.2129 123.7553 50.0221 23.2933 174.6395 113 L 5.1529 9.2629 119.0665 53.9348 44.1728 176.0217 114 V 4.6613 9.2171 120.9001 61.5368 34.1773 174.0315 115 E 5.1510 8.7951 128.7056 53.6524 33.0992 174.5984 116 L 4.8513 8.3950 122.5037 53.4397 42.4835 176.6252 117 V 3.4776 7.8046 124.4666 63.2622 31.7394 175.7183 118 E 4.4292 8.6453 127.8587 56.9831 29.3867 174.8254 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 R 8.25 4.38 0.00 1.92 2.02 0.00 3.04 0.00 0.00 3.22 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.71 0.00 3 H 9.21 3.91 0.00 3.29 3.11 0.00 5.66 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 9.48 4.02 0.00 1.62 1.68 0.93 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 5 K 9.41 4.44 0.00 1.91 1.84 0.00 1.65 0.00 0.00 1.76 0.00 0.00 3.18 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.41 1.40 7.81 6 S 8.37 4.06 0.00 3.99 3.73 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 7 G 10.16 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 8 R 8.74 4.34 0.00 1.90 2.29 0.00 3.39 0.00 0.00 3.29 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.42 0.00 9 K 8.24 4.10 0.00 1.87 1.83 0.00 1.62 0.00 0.00 1.71 0.00 0.00 3.11 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.54 1.50 7.81 10 L 7.88 4.13 0.00 1.58 1.54 0.92 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.76 4.65 0.00 2.64 2.67 0.00 0.00 7.38 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 12 R 9.84 3.97 0.00 1.80 1.81 0.00 2.88 0.00 0.00 2.57 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.40 0.00 13 H 7.75 4.99 0.00 3.35 3.41 0.00 5.69 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 14 S 8.66 3.43 0.00 4.06 3.95 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 15 S 8.86 4.18 0.00 4.08 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 16 H 7.95 4.09 0.00 2.86 3.00 0.00 5.87 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 17 R 8.39 3.42 0.00 1.73 1.94 0.00 2.97 0.00 0.00 2.87 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.67 0.00 18 L 8.13 3.50 0.00 1.53 1.66 0.92 1.35 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 19 A 7.84 3.95 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 20 L 7.91 3.81 0.00 1.53 1.52 0.91 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.40 4.22 0.00 2.37 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 22 R 7.87 4.31 0.00 2.12 2.11 0.00 3.17 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.01 0.00 23 N 8.39 4.64 0.00 2.91 2.88 0.00 0.00 6.95 7.35 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 24 Q 7.79 4.11 0.00 2.26 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.59 0.00 25 A 8.36 4.06 1.56 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 0.00 0.00 0.00 0.00 0.00 0.00 26 K 8.43 3.86 0.00 1.92 1.94 0.00 1.72 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.52 1.75 7.81 27 S 7.70 4.15 0.00 3.93 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 28 L 8.34 3.93 0.00 1.78 2.00 0.95 1.34 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 29 L 8.16 4.23 0.00 1.91 1.74 0.96 0.81 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 30 T 7.95 3.95 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 1.01 0.00 0.00 31 H 8.69 4.81 0.00 3.16 3.17 0.00 5.60 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.93 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 33 R 8.09 5.24 0.00 1.68 1.85 0.00 3.24 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.71 0.00 34 I 8.53 4.81 1.89 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 1.27 1.32 0.93 0.00 0.00 35 T 8.40 4.97 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 1.25 0.00 0.00 36 T 8.34 4.77 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 37 T 8.51 4.64 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 1.21 0.00 0.00 38 V 8.36 3.49 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 1.11 0.00 0.00 0.93 0.00 0.00 39 P 0.00 4.19 0.00 2.20 2.09 0.00 3.63 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.15 0.00 40 K 7.66 3.88 0.00 1.74 1.98 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.74 1.53 7.81 41 A 8.22 4.21 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 42 K 8.48 3.86 0.00 1.82 1.90 0.00 1.70 0.00 0.00 1.62 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.67 7.81 43 E 8.20 4.02 0.00 2.16 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 2.26 1.99 0.00 44 L 7.93 3.63 0.00 1.79 1.91 0.95 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 45 R 8.30 3.69 0.00 2.07 2.07 0.00 3.07 0.00 0.00 3.33 8.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.65 0.00 46 G 8.12 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 47 F 7.72 4.17 0.00 2.88 3.14 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 48 V 7.94 3.27 2.17 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 1.01 0.00 0.00 1.06 0.00 0.00 49 D 8.22 4.08 0.00 2.90 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 50 H 8.31 3.84 0.00 3.17 3.28 0.00 5.79 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 6.87 3.82 0.00 1.52 1.60 0.58 0.76 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 52 I 7.64 3.59 1.26 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 1.37 0.96 0.20 0.00 0.00 53 H 8.22 3.76 0.00 2.84 3.22 0.00 5.58 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 54 L 7.72 3.93 0.00 1.84 1.66 0.60 0.69 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 55 A 7.18 2.58 0.78 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 56 K 7.07 3.95 0.00 1.69 1.76 0.00 1.89 0.00 0.00 1.42 0.00 0.00 3.03 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.48 1.37 7.81 57 R 6.86 4.34 0.00 1.92 1.86 0.00 3.11 0.00 0.00 3.24 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.53 0.00 58 G 8.20 4.17 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 0.00 0.00 0.00 59 D 8.11 4.39 0.00 2.92 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 60 L 9.02 3.85 0.00 1.75 1.77 0.92 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 61 H 8.45 4.02 0.00 3.28 3.59 0.00 5.92 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 8.29 4.02 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 0.00 0.00 0.00 0.00 0.00 0.00 63 R 7.95 3.40 0.00 1.79 1.97 0.00 3.04 0.00 0.00 3.19 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.81 0.00 64 R 8.34 3.87 0.00 1.96 1.93 0.00 3.19 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.73 0.00 65 L 8.26 3.92 0.00 1.66 1.76 0.87 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 66 V 8.07 3.88 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 1.03 0.00 0.00 1.05 0.00 0.00 67 L 7.90 4.17 0.00 1.89 1.75 0.84 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 68 R 7.29 4.06 0.00 2.08 1.98 0.00 3.23 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 69 D 7.91 4.55 0.00 2.64 2.82 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 70 L 7.65 4.21 0.00 1.58 1.62 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 71 Q 8.53 4.32 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.94 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 72 D 7.80 4.55 0.00 2.75 2.51 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 0.00 0.00 0.00 73 V 8.39 3.51 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 0.97 0.00 0.00 0.90 0.00 0.00 74 K 8.21 3.84 0.00 1.89 1.81 0.00 1.64 0.00 0.00 1.74 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.51 1.58 7.81 75 L 7.85 4.02 0.00 2.06 1.64 0.95 0.83 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 76 V 7.49 3.59 2.17 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 0.49 0.00 0.00 0.83 0.00 0.00 77 R 8.42 3.94 0.00 2.03 1.92 0.00 3.20 0.00 0.00 3.06 7.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 78 K 8.31 3.85 0.00 1.90 2.09 0.00 1.64 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.48 1.73 7.81 79 L 8.36 3.98 0.00 2.03 2.09 1.08 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 80 F 9.38 3.99 0.00 3.02 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 81 D 8.01 4.79 0.00 2.83 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 82 E 7.10 5.46 0.00 1.98 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 2.05 2.11 0.00 83 I 6.54 4.32 2.10 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 1.73 1.07 1.14 0.00 0.00 84 A 8.48 4.15 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 85 P 0.00 4.19 0.00 2.14 2.10 0.00 3.62 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.24 0.00 86 R 7.51 4.02 0.00 1.12 1.71 0.00 2.99 0.00 0.00 3.40 7.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.72 0.00 87 Y 7.75 4.82 0.00 3.27 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 88 R 7.78 3.35 0.00 1.86 1.98 0.00 3.38 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 89 D 8.09 4.83 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 90 R 8.71 4.38 0.00 1.69 1.83 0.00 2.85 0.00 0.00 3.07 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.40 0.00 91 Q 8.41 4.10 0.00 2.03 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.41 0.00 0.00 0.00 0.00 0.00 2.35 2.38 0.00 92 G 7.93 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 93 G 8.18 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 94 Y 7.72 4.12 0.00 2.66 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 0.00 0.00 0.00 0.00 95 T 7.84 5.07 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 1.29 0.00 0.00 96 R 9.01 4.75 0.00 1.88 1.72 0.00 3.10 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 1.51 1.53 0.00 97 V 8.22 5.27 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 0.81 0.00 0.00 0.93 0.00 0.00 98 L 8.60 5.00 0.00 1.61 1.51 0.93 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.54 4.83 0.00 1.75 1.80 0.00 1.58 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.34 1.40 7.81 100 L 8.40 4.61 0.00 1.57 1.63 0.92 0.62 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 0.00 101 A 8.39 4.07 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 0.00 102 E 8.73 3.94 0.00 2.17 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 0.00 2.18 2.31 0.00 103 R 8.17 4.60 0.00 1.69 1.97 0.00 3.21 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.61 0.00 104 R 8.23 3.97 0.00 1.86 2.00 0.00 3.09 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.61 0.00 105 R 8.84 4.09 0.00 1.74 1.90 0.00 3.42 0.00 0.00 3.23 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 106 G 8.38 5.10 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 0.00 107 D 8.50 5.24 0.00 2.84 2.79 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 0.00 108 G 7.51 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 0.00 109 A 7.91 4.83 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 0.00 110 P 0.00 4.45 0.00 2.12 2.21 0.00 3.64 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 2.08 2.02 0.00 111 L 8.57 5.09 0.00 1.58 1.57 0.92 0.70 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 0.00 112 A 9.21 5.29 1.18 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 0.00 113 L 9.26 5.15 0.00 1.78 1.75 0.93 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.22 4.66 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 0.95 0.00 0.00 0.94 0.00 0.00 115 E 8.80 5.15 0.00 2.11 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 2.25 2.13 0.00 116 L 8.39 4.85 0.00 1.69 1.85 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 117 V 7.80 3.48 2.17 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 0.73 0.00 0.00 0.97 0.00 0.00 118 E 8.65 4.43 0.00 2.14 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 2.10 2.26 0.00