NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3973 8.3001 120.3510 55.0936 34.0549 175.8911 2 A 4.6289 7.7787 117.4488 51.1113 19.5760 175.0719 3 R 3.9375 8.2408 118.5073 59.7142 31.1771 174.3204 4 R 4.9590 9.1369 116.1822 55.7450 32.3656 175.2928 5 I 4.8828 8.6419 125.0673 59.2920 40.2803 174.4893 6 L 4.6547 8.7244 130.3275 54.4405 43.2380 175.6888 7 V 4.4902 9.1457 128.4256 61.6636 32.8644 174.9704 8 V 4.5868 8.5513 130.5927 61.7830 32.7333 174.3753 9 E 4.9444 8.7208 128.5441 55.5580 32.9401 175.5563 10 D 4.9562 8.9744 125.7416 53.9629 40.4733 176.4803 11 E 4.3723 8.2861 120.9633 54.7245 30.2141 176.0132 12 A 4.0094 8.6648 127.1786 55.0340 18.4117 177.3398 13 P 4.1768 0.0000 0.0000 66.0690 31.3252 178.6480 14 I 3.7408 7.6666 119.1700 64.0258 37.0496 178.1820 15 R 3.9460 8.4114 120.0790 59.5481 29.9093 178.5067 16 E 4.0139 8.5030 118.6117 59.2179 29.3417 179.0148 17 M 4.0461 7.9668 118.5023 58.6550 32.4047 178.4080 18 V 3.6915 8.2525 118.7206 66.3002 31.7637 177.6472 19 C 4.1432 8.3698 116.6134 62.7826 27.9790 175.7922 20 F 4.3533 8.4233 123.5457 60.8533 38.7517 177.3046 21 V 3.5865 7.9746 116.4028 65.9066 31.5174 177.7751 22 L 4.2326 8.0800 118.6207 57.8705 41.0662 178.8745 23 E 4.1136 8.6435 118.8246 60.0889 29.3388 179.9094 24 Q 3.9853 7.8212 115.2851 57.7339 28.7390 177.3042 25 N 4.8308 8.0879 116.2600 52.6526 39.0104 175.6453 26 G 3.7502 8.0234 108.9077 45.0318 0.0000 173.8555 27 F 4.6429 7.6340 117.5461 57.0097 40.7966 175.6327 28 Q 4.6738 9.2251 120.3377 53.6755 29.6447 173.4285 29 P 5.0210 0.0000 0.0000 62.4216 32.9786 176.1212 30 V 4.5262 8.9668 114.8453 59.7356 35.2374 174.5045 31 E 4.9355 8.8516 123.9237 55.3059 31.3552 175.6714 32 A 4.6556 9.0170 125.2383 50.5744 22.2424 176.4975 33 E 4.6265 9.2806 119.6782 56.3464 31.0769 175.1103 34 D 5.0547 7.5963 118.8764 51.1808 43.7678 175.1822 35 Y 3.8703 8.1813 119.3695 60.9312 38.0430 177.9904 36 D 4.4840 8.1418 119.6686 57.2525 40.9592 178.5543 37 S 4.2684 8.3546 113.0590 60.5582 63.3247 176.2500 38 A 3.9627 7.7389 124.6754 55.2719 17.6812 179.4179 39 V 3.6752 7.6798 116.1700 66.4929 31.2258 177.3464 40 N 4.5418 7.6881 113.7042 55.1539 39.0184 175.7986 41 Q 4.4556 7.9483 117.5937 55.4135 30.6958 176.8523 42 L 4.3319 7.2066 120.5814 53.4660 39.3947 175.1667 43 N 3.3953 6.6734 118.8167 50.4681 40.3994 174.3342 44 E 3.6898 7.6041 119.9464 55.1595 30.1987 174.4374 45 P 4.5222 0.0000 0.0000 62.1195 32.3553 176.2322 46 W 4.5157 8.6134 120.5565 54.9362 29.9198 174.5177 47 P 4.4989 0.0000 0.0000 63.1047 31.2823 176.5591 48 D 4.7073 8.9853 121.5996 55.8620 41.6677 176.3801 49 L 4.5976 7.3646 117.3861 54.2902 45.5420 172.7669 50 I 5.0375 8.5829 126.1318 59.5300 40.3503 174.2957 51 L 5.0080 9.0327 127.3090 52.9914 43.8775 175.1693 52 L 4.8942 8.9571 126.4345 52.8105 44.8034 175.0495 53 D 4.8699 8.9669 127.6546 54.1911 41.1054 176.2592 54 W 4.4155 9.1968 135.0000 59.9951 32.1097 175.3939 55 M 4.5303 8.3384 118.6851 53.6032 34.3754 173.7067 56 L 4.8826 8.7676 125.4734 52.1067 45.8264 173.7012 57 P 4.5588 0.0000 0.0000 63.3384 31.7078 176.2660 58 G 4.2787 9.5535 118.7778 43.7111 0.0000 174.9592 59 G 3.4264 7.4693 103.6486 43.1357 0.0000 172.3534 60 S 4.7661 8.6422 115.8639 56.6703 65.9723 175.4766 61 G 3.6443 9.7561 108.2184 48.2269 0.0000 175.7462 62 I 3.7805 7.7050 122.5729 64.0272 37.1138 177.5926 63 Q 4.4199 7.9456 117.2573 57.8495 29.1521 177.7789 64 F 4.1218 8.0203 124.4956 60.6129 39.3165 177.1808 65 I 3.6756 7.8324 119.3111 64.1250 36.7500 178.1783 66 K 3.9235 7.4923 118.2047 59.7385 31.8923 177.9945 67 H 4.2426 7.9705 118.1762 59.1451 29.2546 177.3161 68 L 3.8177 7.4845 120.6337 57.3245 39.9336 179.1661 69 K 4.1628 8.0497 117.6310 58.2159 31.9705 179.0946 70 R 4.0181 7.4855 117.2975 56.8074 30.6213 176.2394 71 E 4.7089 7.0105 118.4584 54.1757 32.1711 177.4216 72 S 4.1289 8.5847 118.9120 61.7003 63.1503 175.7620 73 M 3.8165 7.8623 118.8438 57.0804 31.9913 176.7919 74 T 4.4639 7.3575 106.9803 61.1868 70.7677 176.0936 75 R 4.0432 7.7931 117.8871 57.9970 29.2912 177.0052 76 D 4.6981 7.7376 115.6913 54.0180 41.6563 176.1596 77 I 4.1200 7.5727 122.0932 60.0790 37.6897 174.3859 78 P 4.6267 0.0000 0.0000 63.1139 32.6546 175.3001 79 V 4.8387 9.0961 122.0735 61.2092 34.7987 173.9876 80 V 4.8024 8.7998 128.3273 61.2460 34.0000 174.1108 81 M 4.8457 9.1792 128.7607 55.2740 34.0525 174.7927 82 L 5.2761 9.3591 126.9054 53.9662 43.1893 175.7082 83 T 5.1032 8.9632 114.1871 59.8304 72.3507 174.0585 84 A 4.6233 8.5188 125.2099 50.8355 21.3098 176.8201 85 R 4.4688 8.4480 113.8947 56.8454 31.9573 178.5020 86 G 3.9174 7.6355 108.1344 47.0498 0.0000 176.0993 87 E 3.6466 8.5153 123.1755 58.8516 29.8812 178.3255 88 E 2.7141 7.7973 117.9528 59.3981 29.4754 178.4524 89 E 3.6158 7.4167 116.5772 60.3909 29.3195 179.5095 90 D 4.1706 7.9505 118.6194 57.2883 41.1548 178.7439 91 R 3.9177 7.7566 118.0074 58.2832 30.0144 178.3162 92 V 3.9223 6.8446 117.5178 65.3971 32.1401 176.2398 93 R 4.0481 6.9092 112.9845 56.3386 30.8568 177.6164 94 G 3.9455 8.3822 105.6960 46.2036 0.0000 173.4328 95 L 4.0978 8.5749 120.8257 55.0376 42.0379 178.6672 96 E 3.7051 6.5665 120.8658 56.1660 27.8498 175.5531 97 T 3.9452 7.7557 123.5584 63.4228 75.2479 175.0892 98 G 3.9088 8.5089 109.1629 45.3248 0.0000 173.1552 99 A 4.2628 7.6142 121.7718 52.0406 18.9680 178.0146 100 D 4.5904 8.8947 121.3060 57.0122 41.7512 175.3878 101 D 4.7470 7.6684 116.6040 53.9403 44.7742 173.2069 102 Y 5.5033 8.2487 116.5277 55.3925 41.3149 174.4659 103 I 4.5131 9.1806 121.0117 59.6556 41.7965 173.7379 104 T 5.2279 8.5868 125.2592 61.9846 69.8956 174.6760 105 K 4.1337 9.5177 127.5144 55.4258 32.8100 175.5023 106 P 4.1093 0.0000 0.0000 62.1767 32.3381 175.3761 107 F 5.0014 6.7403 113.9307 54.2588 41.2836 175.0416 108 S 4.6011 8.4905 116.5449 57.1062 65.4389 173.2963 109 P 4.3588 0.0000 0.0000 65.8256 31.1013 178.9976 110 K 3.9663 8.0741 116.8883 60.1540 32.4954 178.5630 111 E 3.9458 8.2354 120.7206 58.6419 29.4888 178.5479 112 L 3.6431 7.9888 120.5131 57.8844 42.0539 179.2325 113 V 3.4787 7.7751 117.9080 65.8976 31.5430 177.5267 114 A 3.9765 8.2837 121.0477 55.4029 18.1410 179.6400 115 R 3.7371 7.9612 116.7360 59.6653 30.2026 178.7535 116 I 3.6310 7.7382 119.6375 64.3397 37.0298 178.6831 117 K 4.0696 8.4148 119.3353 59.1763 31.4646 179.2197 118 A 3.9541 8.1436 121.1981 55.2749 18.4287 179.7685 119 V 3.5475 7.7023 116.6362 66.4805 31.3271 178.2033 120 M 4.2053 7.8547 117.4683 58.0637 32.2573 178.3414 121 R 4.1054 7.9590 116.6696 59.6195 29.2280 179.0649 122 R 4.0621 7.4993 114.7256 58.3229 29.6395 178.4446 123 I 3.8884 7.2145 119.0376 64.1718 37.1799 176.6043 124 S 4.4410 7.6793 119.0830 58.7730 62.8732 173.9380 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 4.40 0.00 1.99 2.16 0.00 0.00 0.00 0.00 0.00 -0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 2 A 7.78 4.63 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 R 8.24 3.94 0.00 1.80 1.89 0.00 3.28 0.00 0.00 3.31 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.64 0.00 4 R 9.14 4.96 0.00 1.82 1.90 0.00 3.08 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 5 I 8.64 4.88 1.80 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 1.11 0.51 0.84 0.00 0.00 6 L 8.72 4.65 0.00 1.82 1.58 0.95 0.56 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 7 V 9.15 4.49 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 0.96 0.00 0.00 0.97 0.00 0.00 8 V 8.55 4.59 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 0.57 0.00 0.00 0.61 0.00 0.00 9 E 8.72 4.94 0.00 2.13 1.74 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 2.25 2.49 0.00 10 D 8.97 4.96 0.00 2.83 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 11 E 8.29 4.37 0.00 2.18 1.94 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 2.28 2.33 0.00 12 A 8.66 4.01 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 13 P 0.00 4.18 0.00 2.25 2.30 0.00 3.60 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.04 0.00 14 I 7.67 3.74 2.01 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.57 0.98 0.00 0.00 15 R 8.41 3.95 0.00 1.94 2.09 0.00 3.08 0.00 0.00 3.40 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 16 E 8.50 4.01 0.00 2.16 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 2.33 0.00 17 M 7.97 4.05 0.00 2.28 2.15 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.75 0.00 18 V 8.25 3.69 2.29 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 0.99 0.00 0.00 1.18 0.00 0.00 19 C 8.37 4.14 0.00 3.07 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 20 F 8.42 4.35 0.00 3.23 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 21 V 7.97 3.59 2.30 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 0.95 0.00 0.00 1.15 0.00 0.00 22 L 8.08 4.23 0.00 1.93 1.74 0.81 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 23 E 8.64 4.11 0.00 2.06 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 0.00 2.35 2.42 0.00 24 Q 7.82 3.99 0.00 1.88 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.96 0.00 0.00 0.00 0.00 0.00 1.58 1.16 0.00 25 N 8.09 4.83 0.00 3.13 3.06 0.00 0.00 7.18 7.46 0.00 0.00 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 G 8.02 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 27 F 7.63 4.64 0.00 3.03 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 28 Q 9.23 4.67 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.11 7.00 0.00 0.00 0.00 0.00 0.00 2.29 2.29 0.00 29 P 0.00 5.02 0.00 2.10 2.06 0.00 3.74 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.23 0.00 30 V 8.97 4.53 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 0.92 0.00 0.00 31 E 8.85 4.94 0.00 1.84 1.86 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 2.27 2.31 0.00 32 A 9.02 4.66 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 33 E 9.28 4.63 0.00 2.14 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 0.00 2.29 2.23 0.00 34 D 7.60 5.05 0.00 2.91 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 35 Y 8.18 3.87 0.00 3.20 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 36 D 8.14 4.48 0.00 2.86 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 37 S 8.35 4.27 0.00 4.01 3.98 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 38 A 7.74 3.96 0.93 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 39 V 7.68 3.68 2.28 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 1.01 0.00 0.00 1.03 0.00 0.00 40 N 7.69 4.54 0.00 3.01 2.88 0.00 0.00 7.16 6.96 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 41 Q 7.95 4.46 0.00 2.13 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 7.17 0.00 0.00 0.00 0.00 0.00 2.44 2.49 0.00 42 L 7.21 4.33 0.00 1.89 1.85 1.01 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 43 N 6.67 3.40 0.00 2.44 2.55 0.00 0.00 5.75 7.66 0.00 0.00 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 E 7.60 3.69 0.00 2.12 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 2.35 0.00 45 P 0.00 4.52 0.00 2.26 2.06 0.00 3.73 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.98 0.00 46 W 8.61 4.52 0.00 3.33 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 47 P 0.00 4.50 0.00 2.14 2.05 0.00 4.01 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 2.18 2.18 0.00 48 D 8.99 4.71 0.00 2.70 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 49 L 7.36 4.60 0.00 1.67 1.41 0.89 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 50 I 8.58 5.04 1.97 0.00 0.00 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 1.34 0.79 1.02 0.00 0.00 51 L 9.03 5.01 0.00 1.51 1.55 0.83 0.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 52 L 8.96 4.89 0.00 1.74 1.56 0.76 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.97 4.87 0.00 2.94 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 54 W 9.20 4.42 0.00 3.66 3.26 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 55 M 8.34 4.53 0.00 1.99 1.57 0.00 0.00 0.00 0.00 0.00 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.54 0.00 56 L 8.77 4.88 0.00 1.82 1.55 1.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 57 P 0.00 4.56 0.00 2.17 1.94 0.00 3.56 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 58 G 9.55 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 0.00 0.00 0.00 0.00 59 G 7.47 3.43 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 0.00 0.00 0.00 60 S 8.64 4.77 0.00 3.48 3.71 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 0.00 0.00 0.00 0.00 61 G 9.76 3.64 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 0.00 0.00 0.00 62 I 7.71 3.78 1.81 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 1.82 0.44 0.96 0.00 0.00 63 Q 7.95 4.42 0.00 2.39 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.80 0.00 0.00 0.00 0.00 0.00 2.45 2.51 0.00 64 F 8.02 4.12 0.00 2.62 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 65 I 7.83 3.68 1.92 0.00 0.00 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 1.50 1.04 0.93 0.00 0.00 66 K 7.49 3.92 0.00 1.99 1.87 0.00 1.82 0.00 0.00 1.65 0.00 0.00 3.19 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.46 1.46 7.81 67 H 7.97 4.24 0.00 3.25 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 L 7.48 3.82 0.00 1.79 1.60 0.96 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 69 K 8.05 4.16 0.00 1.74 1.81 0.00 1.66 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.65 1.60 7.81 70 R 7.49 4.02 0.00 1.84 1.94 0.00 3.09 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 71 E 7.01 4.71 0.00 1.98 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 2.08 2.34 0.00 72 S 8.58 4.13 0.00 3.78 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 73 M 7.86 3.82 0.00 0.71 1.81 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.28 0.00 74 T 7.36 4.46 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 1.41 0.00 0.00 75 R 7.79 4.04 0.00 1.91 2.28 0.00 2.99 0.00 0.00 3.04 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.51 0.00 76 D 7.74 4.70 0.00 2.61 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 77 I 7.57 4.12 1.91 0.00 0.00 1.01 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 0.54 1.04 0.00 0.00 78 P 0.00 4.63 0.00 2.12 2.19 0.00 3.78 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 2.22 1.98 0.00 79 V 9.10 4.84 2.14 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 1.11 0.00 0.00 1.07 0.00 0.00 80 V 8.80 4.80 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 0.84 0.00 0.00 0.90 0.00 0.00 81 M 9.18 4.85 0.00 2.33 2.05 0.00 0.00 0.00 0.00 0.00 2.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.90 2.80 0.00 82 L 9.36 5.28 0.00 1.74 1.78 1.07 nan 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 83 T 8.96 5.10 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 1.22 0.00 0.00 84 A 8.52 4.62 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 85 R 8.45 4.47 0.00 1.92 1.94 0.00 3.08 0.00 0.00 3.22 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.60 0.00 86 G 7.64 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 87 E 8.52 3.65 0.00 2.00 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 2.29 2.45 0.00 88 E 7.80 2.71 0.00 1.91 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 2.09 2.24 0.00 89 E 7.42 3.62 0.00 2.14 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 2.37 2.54 0.00 90 D 7.95 4.17 0.00 2.54 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 91 R 7.76 3.92 0.00 1.83 1.38 0.00 3.50 0.00 0.00 3.55 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.61 0.00 92 V 6.84 3.92 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 0.76 0.00 0.00 1.13 0.00 0.00 93 R 6.91 4.05 0.00 1.78 1.60 0.00 3.01 0.00 0.00 3.12 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.56 0.00 94 G 8.38 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 0.00 0.00 0.00 95 L 8.57 4.10 0.00 1.90 1.80 0.94 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 0.00 0.00 0.00 0.00 0.00 0.00 96 E 6.57 3.71 0.00 2.22 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 0.00 2.38 2.61 0.00 97 T 7.76 3.95 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 1.35 0.00 0.00 98 G 8.51 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 99 A 7.61 4.26 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 0.00 100 D 8.89 4.59 0.00 2.66 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 0.00 101 D 7.67 4.75 0.00 2.70 2.45 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 0.00 102 Y 8.25 5.50 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 0.00 103 I 9.18 4.51 1.64 0.00 0.00 0.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 1.28 0.54 0.00 0.00 104 T 8.59 5.23 4.36 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 1.28 0.00 0.00 105 K 9.52 4.13 0.00 1.62 1.63 0.00 1.70 0.00 0.00 1.80 0.00 0.00 3.16 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.27 1.63 7.81 106 P 0.00 4.11 0.00 2.03 1.89 0.00 3.68 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.89 0.00 107 F 6.74 5.00 0.00 3.11 3.23 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 0.00 108 S 8.49 4.60 0.00 4.13 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 0.00 109 P 0.00 4.36 0.00 2.24 2.24 0.00 3.67 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 110 K 8.07 3.97 0.00 2.00 2.10 0.00 1.53 0.00 0.00 1.77 0.00 0.00 2.93 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.52 7.81 111 E 8.24 3.95 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 2.34 2.23 0.00 112 L 7.99 3.64 0.00 1.56 1.78 0.50 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.78 3.48 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 1.23 0.00 0.00 1.02 0.00 0.00 114 A 8.28 3.98 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 R 7.96 3.74 0.00 1.94 1.95 0.00 2.91 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 1.48 1.65 0.00 116 I 7.74 3.63 1.72 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.49 0.65 0.00 0.00 117 K 8.41 4.07 0.00 1.91 1.90 0.00 1.84 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.63 1.70 7.81 118 A 8.14 3.95 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 V 7.70 3.55 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 1.02 0.00 0.00 0.93 0.00 0.00 120 M 7.85 4.21 0.00 2.11 2.33 0.00 0.00 0.00 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.58 0.00 121 R 7.96 4.11 0.00 2.06 2.33 0.00 2.77 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 1.86 1.66 0.00 122 R 7.50 4.06 0.00 2.00 2.11 0.00 3.07 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.74 0.00 123 I 7.21 3.89 1.88 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 1.72 0.81 0.91 0.00 0.00 124 S 7.68 4.44 0.00 4.01 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