NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 K 4.3309 8.3149 120.0032 56.1004 33.9712 175.0334 7 L 4.1912 8.2267 118.9126 53.3783 42.0755 175.1242 8 H 5.0971 9.1506 116.8528 53.8241 32.5640 172.6869 9 K 4.5575 8.6541 119.8529 56.3032 33.1431 176.0783 10 E 5.0208 9.1383 122.7960 53.7326 33.8125 173.6473 11 P 5.0047 0.0000 0.0000 63.2112 32.4484 174.9495 12 A 4.9980 8.4061 121.5196 51.3101 23.1246 175.5132 13 T 4.6288 8.5915 115.0848 61.2386 72.1958 173.8650 14 L 4.1559 8.7458 128.3606 56.1206 42.2229 175.6950 15 I 4.3383 8.4721 126.2686 62.3065 38.6718 175.7684 16 K 4.5372 8.1441 120.7865 55.3807 36.0452 173.9660 17 A 4.6565 8.6859 130.1507 51.6817 19.7484 176.8713 18 I 4.2163 8.2482 122.9940 62.7327 39.0782 174.9343 19 D 4.5631 7.5142 117.0552 53.2223 43.7686 175.1881 20 G 3.8454 8.8761 108.3206 48.0258 0.0000 173.9392 21 D 4.9049 8.0819 116.1754 52.5042 40.4911 174.9721 22 V 4.9677 7.6255 118.9238 61.5680 35.0869 174.5934 23 V 4.9818 8.6670 119.7274 59.6583 36.3109 174.3703 24 K 5.0632 9.1444 124.6866 55.3364 33.6708 175.7839 25 L 5.2983 9.2050 124.5994 52.9647 46.3392 175.5034 26 M 4.8042 9.3236 122.4117 55.2160 33.4428 174.3307 27 Y 5.0389 9.1983 128.3350 56.0345 41.9111 175.7029 28 K 3.7744 9.4607 127.5769 57.5317 29.7606 175.8006 29 G 3.9168 8.3210 102.9511 45.4925 0.0000 172.8575 30 Q 4.7729 7.9260 121.3431 53.0241 32.0435 172.8559 31 P 4.9723 0.0000 0.0000 63.2823 32.1694 175.2936 32 M 4.8913 9.2823 122.6638 54.3754 36.4950 173.3853 33 T 4.7948 8.4709 121.2233 62.6592 70.7402 173.5182 34 F 5.1295 9.4850 124.9281 55.6036 42.3328 174.1170 35 R 4.9755 8.9433 124.0087 54.3546 31.9971 175.2168 36 L 4.3084 8.6209 127.4666 54.6304 42.1577 177.2340 37 L 3.9363 8.6815 124.7918 55.6434 42.8631 178.0574 38 L 3.7985 8.8976 120.5829 55.1711 39.3078 174.0488 39 V 4.9788 7.3290 110.5490 59.6238 35.5139 174.7249 40 D 5.0505 9.2504 124.3906 52.8695 42.9874 175.6076 41 T 4.8217 8.4245 114.1397 59.0644 70.7024 173.0801 42 P 4.4708 0.0000 0.0000 63.1074 32.2203 175.1628 43 E 4.7454 9.7562 119.7095 55.0093 32.3757 176.8871 44 T 4.5560 8.5587 109.4712 62.0804 70.3961 175.4341 45 K 4.6000 7.8128 120.9682 55.6190 32.6551 175.9284 46 H 4.4562 8.3569 119.7907 55.2196 30.9394 173.4189 47 P 4.2107 0.0000 0.0000 65.6905 31.2957 177.6454 48 K 4.2541 8.0568 114.8332 57.6613 32.7946 177.7449 49 K 4.2348 8.4337 118.3697 56.1075 34.3241 177.2356 50 G 3.8953 7.9735 106.3657 45.3603 0.0000 176.0703 51 V 4.4936 8.2665 130.0266 61.3527 31.1860 173.8608 52 E 4.3609 9.2662 128.6256 54.8349 31.4948 176.1125 53 K 3.9983 8.2906 122.5006 58.2961 32.4983 176.5255 54 Y 4.5580 8.1960 123.2119 59.4036 35.8865 171.0979 55 G 3.6681 8.1937 107.8892 47.4988 0.0000 174.2157 56 P 4.2767 0.0000 0.0000 64.8892 31.3423 178.6507 57 E 3.9875 8.1807 116.7138 59.4413 29.5559 179.0079 58 A 3.9945 8.5312 121.1249 55.3051 18.5635 179.6566 59 S 4.1363 8.4354 111.5997 61.4992 62.4436 176.2681 60 A 4.0755 8.5759 124.0174 54.7896 18.0519 179.4696 61 F 3.9610 8.3509 119.4020 61.8218 39.5254 177.4307 62 T 3.9411 8.0884 115.3662 66.4837 68.2483 176.3784 63 K 3.8827 7.9252 120.9140 59.5775 32.2739 178.8698 64 K 3.8905 8.0918 118.6734 59.6262 31.7258 178.9545 65 M 3.8504 7.5625 117.1899 58.7663 32.0147 178.3143 66 V 3.8445 7.9075 112.2231 63.8555 31.6476 178.4790 67 E 3.9781 8.4847 118.1839 59.0451 29.4303 177.3926 68 N 4.6383 8.0101 113.5896 53.0200 38.8080 175.0684 69 A 4.5472 7.2848 121.3574 51.4607 19.5201 178.4474 70 K 4.1901 8.8104 120.3792 58.7255 32.6663 178.3260 71 K 4.7167 8.4560 117.3446 54.5748 36.5034 175.6514 72 I 5.1077 8.4071 124.3372 59.6395 40.2291 174.3782 73 E 5.1713 9.0842 124.4341 54.7023 33.7917 175.1192 74 V 4.6962 8.9753 115.4271 59.5347 35.4368 174.7451 75 E 4.9254 8.7567 123.6016 54.4943 32.2082 175.0044 76 F 4.6467 8.8862 125.7623 57.5939 40.1566 175.6498 77 D 4.9594 8.4638 120.5154 53.4035 43.2090 175.7876 78 K 4.3518 9.0642 117.3192 57.6526 33.1967 178.4272 79 G 4.1989 8.5254 110.5596 44.6124 0.0000 173.6957 80 Q 4.0403 8.6811 122.6172 56.6012 29.3181 176.5844 81 R 4.5950 8.5037 119.5816 56.3481 31.0523 175.9515 82 T 5.0826 7.4403 107.2704 59.7536 72.0787 173.3800 83 D 4.8052 8.4539 123.2075 51.7532 41.7646 176.8690 84 K 3.9546 8.3628 116.8443 59.1831 32.6580 176.8914 85 Y 4.2728 8.0864 116.1591 57.7738 38.1521 176.2612 86 G 3.9309 8.2548 108.5487 45.2187 0.0000 173.8432 87 R 4.2952 8.4901 120.1716 55.1235 31.5336 176.4670 88 G 3.4675 8.2970 111.1551 46.6178 0.0000 172.2955 89 L 5.3477 8.8192 124.3494 53.3058 43.1210 175.5743 90 A 4.3685 8.3143 124.7310 51.1033 23.6277 174.0260 91 Y 4.8099 8.6265 117.4424 57.0887 39.8991 175.1579 92 I 4.8590 8.7656 124.5410 59.6641 40.3351 174.0545 93 Y 5.1217 9.0488 123.9785 56.0573 40.9509 174.4337 94 A 4.9532 9.0565 126.1769 50.2698 21.3907 176.3372 95 D 4.2972 9.5520 125.2054 55.7458 39.0016 175.3704 96 G 3.9628 8.2568 104.2465 45.4951 0.0000 173.1952 97 K 4.5162 7.9467 120.5477 54.6445 33.7140 175.3827 98 M 3.9719 8.5255 123.7280 55.0429 33.0897 176.8548 99 V 3.6386 8.6587 127.3294 66.1390 31.2863 177.6769 100 N 4.2970 7.9829 115.7266 56.4543 38.4600 176.8425 101 E 3.8975 8.0613 119.8799 58.9990 29.9232 178.4015 102 A 4.0717 8.0590 120.9955 55.1630 18.4133 179.5027 103 L 3.4489 7.9435 117.4793 57.8972 41.6715 180.0574 104 V 3.7554 7.4657 117.5434 65.9432 31.2648 178.0868 105 R 3.9397 8.2366 117.9867 59.0791 29.9891 177.6129 106 Q 4.2897 7.7122 115.0017 55.2476 29.1545 176.1461 107 G 3.9097 7.9912 108.8158 46.6720 0.0000 174.5933 108 L 4.6562 7.8658 116.6793 53.7647 42.4205 176.1234 109 A 4.6684 7.5424 118.7291 50.9667 22.1392 176.1859 110 K 4.8915 8.6957 119.3151 54.4550 35.0686 176.3039 111 V 4.1944 8.9806 123.9857 63.1502 32.0566 176.0188 112 A 4.5323 8.8278 130.4886 50.7578 20.1498 176.2420 113 Y 4.1147 8.5319 119.9517 57.7884 39.3365 175.0818 114 V 3.9245 7.0993 125.7461 61.0469 33.4828 174.6528 115 Y 4.5097 7.8960 124.0035 55.7509 38.6623 175.4741 116 K 4.4033 8.4304 124.5863 56.0749 32.7357 175.1198 117 P 4.7846 0.0000 0.0000 63.1955 31.9188 176.9998 118 N 4.9096 8.0786 118.3869 52.6196 36.9902 175.0764 119 N 5.1334 7.7215 112.9825 53.0258 39.0838 177.5619 120 T 3.8537 8.5991 118.4390 67.2519 68.7291 174.9418 121 H 4.8892 7.9271 116.9896 55.6784 29.2950 176.5120 122 E 3.9669 8.3028 123.3111 59.6214 29.3956 178.8228 123 Q 3.9879 8.0238 117.6192 59.2358 28.9418 178.0753 124 H 4.2720 8.1861 118.8068 59.2414 29.8936 177.2049 125 L 3.9369 8.0177 120.9171 57.7889 41.3946 179.6556 126 R 3.9289 8.2246 118.1505 58.9821 30.0352 179.2574 127 K 3.9168 8.1606 118.3133 59.7482 32.0752 179.6194 128 S 4.1318 7.9247 115.0748 61.4242 62.6438 176.4354 129 E 3.9058 8.5848 122.4067 59.1666 29.3727 178.7341 130 A 3.7835 8.1140 120.9851 54.9180 18.2634 179.4841 131 Q 3.7951 7.9652 117.8139 59.2825 29.2015 178.2176 132 A 3.9836 8.1343 121.9085 54.9073 18.3458 179.8513 133 K 3.4317 7.5566 117.2258 59.1961 31.7689 179.4012 134 K 3.8584 7.5555 118.7852 59.4383 32.2382 177.9439 135 E 4.1752 8.2590 115.6695 55.6370 30.2772 176.4487 136 K 4.0737 7.8034 118.0563 57.2426 30.6034 175.2451 137 L 4.4152 8.1388 117.9846 55.1831 44.7078 178.1167 138 N 3.7698 9.4428 119.6196 54.1932 37.8414 176.4935 139 I 2.9768 5.4200 126.9706 64.2518 37.7244 176.8064 140 W 4.8035 7.9810 118.1669 56.4096 29.2466 176.4454 141 S 4.4168 8.0479 119.7435 58.5146 62.6817 173.9505 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 6 K 8.31 4.33 0.00 1.91 1.94 0.00 1.56 0.00 0.00 1.72 0.00 0.00 2.95 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.32 1.49 7.81 7 L 8.23 4.19 0.00 1.82 1.77 1.09 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 8 H 9.15 5.10 0.00 3.13 3.24 0.00 5.52 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 9 K 8.65 4.56 0.00 1.58 1.68 0.00 1.42 0.00 0.00 1.35 0.00 0.00 2.33 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.03 1.23 7.81 10 E 9.14 5.02 0.00 2.10 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.28 0.00 11 P 0.00 5.00 0.00 2.11 2.07 0.00 3.85 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.01 0.00 12 A 8.41 5.00 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 13 T 8.59 4.63 4.27 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 1.23 0.00 0.00 14 L 8.75 4.16 0.00 1.63 1.58 0.91 1.03 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 15 I 8.47 4.34 2.03 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 1.27 0.78 0.94 0.00 0.00 16 K 8.14 4.54 0.00 1.82 1.61 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.84 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.34 1.38 7.81 17 A 8.69 4.66 1.25 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 0.00 0.00 18 I 8.25 4.22 2.01 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 1.19 0.69 0.91 0.00 0.00 19 D 7.51 4.56 0.00 2.63 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 20 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 21 D 8.08 4.90 0.00 2.80 2.86 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 0.00 0.00 0.00 22 V 7.63 4.97 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 1.04 0.00 0.00 0.93 0.00 0.00 23 V 8.67 4.98 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 0.66 0.00 0.00 0.92 0.00 0.00 24 K 9.14 5.06 0.00 1.86 1.79 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.87 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.45 7.81 25 L 9.20 5.30 0.00 1.65 1.53 0.38 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.32 4.80 0.00 2.15 2.01 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.56 0.00 27 Y 9.20 5.04 0.00 3.23 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 K 9.46 3.77 0.00 1.31 1.56 0.00 1.69 0.00 0.00 1.57 0.00 0.00 2.46 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.01 0.21 7.81 29 G 8.32 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 30 Q 7.93 4.77 0.00 2.29 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.95 0.00 0.00 0.00 0.00 0.00 2.27 2.34 0.00 31 P 0.00 4.97 0.00 2.16 2.10 0.00 3.83 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 32 M 9.28 4.89 0.00 2.22 2.02 0.00 0.00 0.00 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.13 0.00 33 T 8.47 4.79 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 1.23 0.00 0.00 34 F 9.48 5.13 0.00 3.00 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 35 R 8.94 4.98 0.00 1.90 1.80 0.00 3.34 0.00 0.00 3.17 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 36 L 8.62 4.31 0.00 1.57 1.59 0.93 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 37 L 8.68 3.94 0.00 1.06 1.21 0.39 0.61 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 38 L 8.90 3.80 0.00 2.02 1.88 1.11 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 39 V 7.33 4.98 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 0.76 0.00 0.00 0.94 0.00 0.00 40 D 9.25 5.05 0.00 2.55 2.57 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.42 4.82 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 1.22 0.00 0.00 42 P 0.00 4.47 0.00 2.33 2.22 0.00 3.72 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.00 0.00 43 E 9.76 4.75 0.00 2.02 1.99 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 2.22 2.38 0.00 44 T 8.56 4.56 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 1.24 0.00 0.00 45 K 7.81 4.60 0.00 1.71 1.77 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.32 1.37 7.81 46 H 8.36 4.46 0.00 3.16 3.32 0.00 5.61 0.00 0.00 0.00 0.00 6.75 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 4.21 0.00 2.00 2.05 0.00 3.03 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.99 0.00 48 K 8.06 4.25 0.00 1.78 1.89 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.58 7.81 49 K 8.43 4.23 0.00 1.40 1.71 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.04 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 1.40 7.81 50 G 7.97 3.90 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 0.00 0.00 0.00 51 V 8.27 4.49 2.06 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 0.80 0.00 0.00 0.97 0.00 0.00 52 E 9.27 4.36 0.00 1.90 1.82 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 2.25 2.47 0.00 53 K 8.29 4.00 0.00 1.67 1.70 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.76 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.07 0.94 7.81 54 Y 8.20 4.56 0.00 3.18 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 55 G 8.19 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.28 0.00 2.16 2.11 0.00 3.58 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.16 0.00 57 E 8.18 3.99 0.00 2.38 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 0.00 2.55 2.51 0.00 58 A 8.53 3.99 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 59 S 8.44 4.14 0.00 4.07 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 60 A 8.58 4.08 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 61 F 8.35 3.96 0.00 3.21 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.09 3.94 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 1.24 0.00 0.00 63 K 7.93 3.88 0.00 1.93 2.03 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.01 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.58 7.81 64 K 8.09 3.89 0.00 1.75 1.73 0.00 1.71 0.00 0.00 1.54 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.56 1.55 7.81 65 M 7.56 3.85 0.00 2.00 1.79 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.51 0.00 66 V 7.91 3.84 2.06 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 0.81 0.00 0.00 1.02 0.00 0.00 67 E 8.48 3.98 0.00 2.01 1.99 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 2.34 2.33 0.00 68 N 8.01 4.64 0.00 2.82 2.80 0.00 0.00 6.99 7.07 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 69 A 7.28 4.55 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 70 K 8.81 4.19 0.00 1.95 1.88 0.00 1.65 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.48 7.81 71 K 8.46 4.72 0.00 1.67 1.64 0.00 1.61 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.34 1.39 7.81 72 I 8.41 5.11 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.11 0.85 0.00 0.00 73 E 9.08 5.17 0.00 1.90 1.81 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 2.21 2.25 0.00 74 V 8.98 4.70 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 0.58 0.00 0.00 75 E 8.76 4.93 0.00 2.24 2.19 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 2.47 2.53 0.00 76 F 8.89 4.65 0.00 3.01 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 77 D 8.46 4.96 0.00 2.69 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 78 K 9.06 4.35 0.00 1.79 1.88 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.07 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.50 1.45 7.81 79 G 8.53 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.68 4.04 0.00 2.02 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.79 0.00 0.00 0.00 0.00 0.00 2.33 2.43 0.00 81 R 8.50 4.59 0.00 1.63 1.54 0.00 2.79 0.00 0.00 2.54 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.63 0.00 82 T 7.44 5.08 4.20 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 83 D 8.45 4.81 0.00 2.94 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 84 K 8.36 3.95 0.00 1.60 1.78 0.00 1.25 0.00 0.00 1.51 0.00 0.00 2.98 0.00 0.00 3.08 0.00 0.00 0.00 0.00 0.99 0.36 7.81 85 Y 8.09 4.27 0.00 3.16 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 86 G 8.25 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 87 R 8.49 4.30 0.00 2.11 1.83 0.00 3.13 0.00 0.00 3.16 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.63 0.00 88 G 8.30 3.47 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 0.00 89 L 8.82 5.35 0.00 1.56 1.62 0.93 0.60 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 90 A 8.31 4.37 0.85 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 91 Y 8.63 4.81 0.00 2.92 2.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 92 I 8.77 4.86 1.76 0.00 0.00 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.79 0.80 0.00 0.00 93 Y 9.05 5.12 0.00 2.88 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 94 A 9.06 4.95 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 95 D 9.55 4.30 0.00 2.80 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 96 G 8.26 3.96 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 0.00 0.00 0.00 97 K 7.95 4.52 0.00 2.00 1.76 0.00 1.86 0.00 0.00 1.58 0.00 0.00 2.97 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.40 1.43 7.81 98 M 8.53 3.97 0.00 1.88 1.57 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 2.43 0.00 99 V 8.66 3.64 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 1.04 0.00 0.00 0.94 0.00 0.00 100 N 7.98 4.30 0.00 2.88 2.90 0.00 0.00 6.78 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 0.00 101 E 8.06 3.90 0.00 1.89 1.88 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 2.24 2.06 0.00 102 A 8.06 4.07 1.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 L 7.94 3.45 0.00 1.83 1.61 0.98 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.47 3.76 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 1.08 0.00 0.00 0.96 0.00 0.00 105 R 8.24 3.94 0.00 2.01 2.07 0.00 3.34 0.00 0.00 3.21 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.71 4.29 0.00 1.85 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.25 0.00 0.00 0.00 0.00 0.00 2.39 2.11 0.00 107 G 7.99 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 0.00 108 L 7.87 4.66 0.00 1.23 1.46 0.50 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.54 4.67 1.13 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 0.00 0.00 110 K 8.70 4.89 0.00 1.71 1.80 0.00 1.63 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.66 1.16 7.81 111 V 8.98 4.19 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 0.78 0.00 0.00 0.96 0.00 0.00 112 A 8.83 4.53 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 0.00 113 Y 8.53 4.11 0.00 2.81 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 0.00 114 V 7.10 3.92 1.81 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 0.80 0.00 0.00 0.87 0.00 0.00 115 Y 7.90 4.51 0.00 3.01 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 0.00 116 K 8.43 4.40 0.00 1.75 1.76 0.00 1.74 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.44 1.40 7.81 117 P 0.00 4.78 0.00 2.20 2.14 0.00 3.79 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 118 N 8.08 4.91 0.00 2.94 2.86 0.00 0.00 6.61 7.98 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 0.00 119 N 7.72 5.13 0.00 2.81 2.94 0.00 0.00 6.11 7.22 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 0.00 120 T 8.60 3.85 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 1.07 0.00 0.00 121 H 7.93 4.89 0.00 2.86 3.09 0.00 5.62 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.30 3.97 0.00 2.14 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 0.00 2.31 2.35 0.00 123 Q 8.02 3.99 0.00 2.11 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.68 0.00 0.00 0.00 0.00 0.00 2.45 2.36 0.00 124 H 8.19 4.27 0.00 3.17 3.28 0.00 5.69 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 0.00 125 L 8.02 3.94 0.00 1.92 1.70 1.01 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.22 3.93 0.00 2.05 1.96 0.00 3.12 0.00 0.00 3.16 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 127 K 8.16 3.92 0.00 1.99 1.86 0.00 1.80 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.45 1.48 7.81 128 S 7.92 4.13 0.00 3.95 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 0.00 129 E 8.58 3.91 0.00 2.03 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 2.12 2.54 0.00 130 A 8.11 3.78 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 0.00 131 Q 7.97 3.80 0.00 2.17 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.33 2.48 0.00 132 A 8.13 3.98 1.52 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 0.00 133 K 7.56 3.43 0.00 1.36 1.19 0.00 0.94 0.00 0.00 0.61 0.00 0.00 2.55 0.00 0.00 2.70 0.00 0.00 0.00 0.00 0.30 0.90 7.81 134 K 7.56 3.86 0.00 1.87 1.88 0.00 1.76 0.00 0.00 1.66 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.40 1.42 7.81 135 E 8.26 4.18 0.00 1.97 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 0.00 2.33 2.51 0.00 136 K 7.80 4.07 0.00 1.89 1.89 0.00 1.72 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.57 7.81 137 L 8.14 4.42 0.00 1.81 1.71 0.96 0.56 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 0.00 138 N 9.44 3.77 0.00 2.69 1.68 0.00 0.00 7.14 7.24 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 0.00 139 I 5.42 2.98 1.41 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.81 -0.07 -0.79 0.00 0.00 140 W 7.98 4.80 0.00 3.34 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 0.00 141 S 8.05 4.42 0.00 4.02 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