NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 E 4.3584 8.4449 116.7521 55.3460 31.5049 175.1003 5 K 4.3733 8.2414 117.9799 55.1478 33.0459 175.9118 6 T 4.3717 9.3242 113.5554 60.5530 71.5492 175.2513 7 F 4.1071 9.4339 122.8663 61.7214 39.0156 177.2213 8 K 4.0193 8.3297 115.6895 59.2753 31.8761 178.5746 9 Q 4.2002 7.6418 116.8204 57.9107 28.9303 177.7556 10 R 4.1873 7.5534 117.6680 56.4200 30.6898 176.8330 11 R 4.6500 7.0075 116.6255 53.2628 33.5494 175.8365 12 S 4.4345 8.5317 117.2862 57.7172 65.1367 175.4117 13 F 4.1054 8.7477 123.5370 61.7422 39.2958 176.9494 14 E 3.9607 8.3827 117.6337 59.3678 29.2960 179.0335 15 Q 3.9738 7.9879 119.1768 59.3161 29.1634 178.5498 16 R 4.4832 8.2517 120.7580 58.7311 30.0837 179.1774 17 V 3.7959 7.6872 119.5794 65.3464 31.4555 177.7795 18 E 3.9198 8.0897 118.8079 59.2352 28.9651 178.3131 19 D 4.4397 8.2250 119.0324 57.5790 40.9538 179.1597 20 V 3.2881 7.5870 118.5477 65.6112 31.5211 177.9908 21 R 3.8230 7.8670 118.5586 59.2728 29.9189 178.2556 22 L 3.8835 7.9405 119.9290 58.2872 42.1288 178.7059 23 I 3.6918 7.7477 118.5260 64.2746 37.9534 178.0487 24 R 3.9701 8.1426 118.7878 58.6644 29.5820 178.7288 25 E 3.9844 7.6309 118.3413 59.5121 29.8107 178.6129 26 Q 4.1826 7.9652 116.5109 57.5879 30.2826 176.2562 27 H 4.8990 8.3806 117.2715 52.7924 29.2397 172.0460 28 P 4.4659 0.0000 0.0000 64.2403 31.7555 178.1873 29 T 4.5699 7.8947 108.2708 61.1360 69.0953 173.3587 30 K 4.9835 7.7588 120.8387 55.0353 35.0514 175.5224 31 I 4.1076 8.6288 124.3100 58.6785 39.7584 173.1279 32 P 4.8802 0.0000 0.0000 62.5086 32.6060 175.2276 33 V 4.8218 9.3182 125.1623 60.8858 34.8588 174.0761 34 I 4.6740 8.4868 128.4382 59.6549 39.3894 174.5986 35 I 5.0578 8.9395 128.3873 59.6741 39.9914 174.7393 36 E 5.0125 8.9542 125.8475 54.0912 34.0621 175.1462 37 R 2.9226 8.2070 121.7969 55.4412 30.9823 175.5009 38 Y 4.3018 8.3039 127.7086 57.8191 39.2376 177.2053 39 K 3.5481 8.5396 125.4246 59.8064 32.4224 177.9309 40 G 3.4633 5.3800 105.4117 45.8706 0.0000 173.2674 41 E 4.2374 7.8588 122.2856 56.0719 30.0514 176.3660 42 K 4.5449 8.7197 125.4044 56.8664 34.7607 177.9218 43 Q 4.3268 8.3783 116.1854 56.9223 28.7802 181.8240 44 L 4.3728 8.6797 118.6159 53.4434 42.2183 175.3186 45 P 4.5515 0.0000 0.0000 62.7333 32.1050 175.4700 46 V 4.4949 7.9146 117.7391 60.6105 32.7673 175.5953 47 L 4.4581 8.4508 126.1028 54.1510 42.6752 176.7540 48 D 4.4312 8.9790 123.0564 57.2761 41.4289 177.2802 49 K 4.7096 7.8096 117.7737 52.8282 35.2934 177.1876 50 T 5.0792 8.0638 107.4772 60.4044 70.7610 172.9413 51 K 4.7595 7.5389 122.1024 54.7979 33.9977 175.5150 52 F 4.7491 9.4420 123.9842 55.3901 42.8411 174.2025 53 L 4.9589 8.6733 124.5812 53.6122 43.3896 175.1579 54 V 4.3234 8.5454 127.7767 60.2240 33.6821 173.2997 55 P 4.5764 0.0000 0.0000 62.8487 31.7076 177.0861 56 D 4.4666 9.2806 124.2522 55.4424 39.4403 177.6409 57 H 4.5370 7.7680 114.5469 56.7587 29.5662 175.9157 58 V 3.6882 7.3965 121.7560 63.2257 31.8077 175.3675 59 N 5.2509 9.0167 125.4407 51.9772 40.3175 176.0771 60 M 4.1090 8.4599 119.8611 58.3029 31.9198 179.1393 61 S 4.0741 8.1236 113.5139 61.4740 62.5434 176.1582 62 E 3.9490 8.7409 121.5130 59.1113 29.2180 179.0050 63 L 3.8620 7.9448 120.3349 58.2257 42.1232 178.9054 64 I 3.7757 7.8777 119.7526 64.4852 37.0557 178.5497 65 K 3.8064 7.8235 118.7014 59.5526 31.8672 179.3762 66 I 3.6260 7.8652 118.8889 63.9620 37.8318 178.0247 67 I 3.5874 7.6951 120.9220 64.0574 36.8160 178.4700 68 R 3.2645 7.8086 121.6108 59.6162 29.7185 179.9797 69 R 3.8324 7.8336 120.3987 61.4807 29.1985 180.9611 70 R 4.1014 7.9115 118.3584 58.7839 30.1525 178.3139 71 L 4.2105 7.5736 115.7521 53.9441 42.0494 176.5762 72 Q 3.4706 7.8947 117.2749 56.7913 26.7984 173.7431 73 L 4.4132 7.6315 116.2870 53.8472 43.1313 176.6714 74 N 4.6771 8.2550 117.8742 52.0168 39.7733 176.3811 75 A 3.9657 8.5167 123.6550 55.3624 18.5076 178.9910 76 N 4.5013 8.0366 111.6773 55.3418 38.9924 175.2303 77 Q 4.3558 7.9105 117.7241 54.2459 29.9109 175.3726 78 A 4.0587 8.4609 124.2119 52.1947 18.9695 176.7128 79 F 4.8629 7.7891 124.2514 56.7337 42.7821 173.5653 80 F 4.5973 8.4316 123.6099 55.4866 43.7358 173.2854 81 L 4.8134 8.4491 124.5229 53.4618 44.1919 174.5957 82 L 5.1699 9.0899 127.2025 52.9315 44.6540 175.7594 83 V 4.4955 8.5542 123.1565 61.5456 34.1890 175.3075 84 N 4.2665 10.1444 125.5064 54.2200 36.1551 175.3133 85 G 3.9744 8.6853 106.0666 45.1122 0.0000 173.6979 86 H 4.9727 7.6493 115.1504 53.2661 31.0443 173.5078 87 S 4.7696 8.4789 117.7490 59.0870 63.6537 173.3038 88 M 4.5376 8.4972 123.0955 54.2918 32.9430 176.5047 89 V 3.9248 8.3578 117.1615 60.7842 32.9474 177.4416 90 S 4.5074 8.7071 119.8163 58.7542 60.1567 172.6737 91 V 4.6931 7.6539 117.8595 58.7658 36.6676 175.3667 92 S 4.4704 8.6782 113.6374 59.4738 63.6233 174.5859 93 T 4.0629 7.7975 118.9584 63.4217 69.3233 172.2774 94 P 4.8008 0.0000 0.0000 61.9270 32.4007 177.3112 95 I 3.7763 8.6490 122.1020 64.1508 37.8439 178.6011 96 S 4.1753 7.7836 114.0561 61.4467 62.7945 176.4117 97 E 4.0686 8.3318 122.2336 59.0229 29.2728 179.2714 98 V 3.6520 7.7942 117.9312 66.0668 31.7850 177.2329 99 Y 4.1608 8.4378 119.6460 60.8236 38.4405 177.7205 100 E 3.9002 8.1114 118.7926 58.5906 29.8189 177.9918 101 S 4.6432 7.8480 111.4054 58.3804 64.1915 174.3788 102 E 4.6487 8.3460 119.9366 55.4577 30.9624 176.3884 103 R 4.0634 7.4489 115.4902 55.9592 30.0792 176.0576 104 D 4.7847 9.1937 119.6459 53.6247 42.0731 177.2512 105 E 4.2006 8.8076 121.5829 58.9996 29.6476 177.9867 106 D 4.1838 9.1811 117.9168 53.6199 39.9244 177.5388 107 G 3.9243 8.1320 108.5725 45.4007 0.0000 174.1564 108 F 4.6404 8.7837 118.3442 56.8623 40.9622 174.4662 109 L 5.0483 8.5322 122.8828 53.9673 43.6261 174.6746 110 Y 5.1887 8.8588 123.9817 57.0262 39.8962 175.0269 111 M 5.2121 9.3010 121.8874 54.0065 37.1936 174.5267 112 V 5.6827 8.9753 113.5897 58.7059 36.6348 174.1591 113 Y 5.2699 7.9490 119.8647 55.6096 41.4405 174.0228 114 A 5.0812 8.8914 121.8200 50.3384 23.5684 177.5596 115 S 5.0362 9.2936 113.5388 58.8555 62.7843 176.4958 116 Q 4.6866 8.6196 115.6921 53.5281 32.0806 174.1301 117 E 4.1864 8.6684 120.8901 56.1864 30.4698 175.8781 118 T 4.7957 7.8723 111.8740 59.8331 71.2641 173.6565 119 F 4.8029 8.2319 120.2259 55.9361 42.3744 174.5237 120 G 4.0015 7.9356 110.4866 45.8327 0.0000 171.7870 121 T 4.6007 8.1998 113.0531 59.2300 70.5157 173.4987 122 A 4.1828 8.4760 125.2435 52.4716 18.3638 177.4719 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 4 E 8.44 4.36 0.00 2.01 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 2.13 1.91 0.00 5 K 8.24 4.37 0.00 1.82 1.75 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.48 7.81 6 T 9.32 4.37 4.46 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 0.00 0.00 0.00 1.26 0.00 0.00 7 F 9.43 4.11 0.00 3.14 3.24 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 8 K 8.33 4.02 0.00 1.79 1.89 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.88 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.59 1.57 7.81 9 Q 7.64 4.20 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.96 0.00 0.00 0.00 0.00 0.00 2.36 2.39 0.00 10 R 7.55 4.19 0.00 1.66 1.90 0.00 3.10 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.93 0.00 11 R 7.01 4.65 0.00 1.24 1.60 0.00 2.99 0.00 0.00 2.45 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.23 0.00 12 S 8.53 4.43 0.00 4.14 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 13 F 8.75 4.11 0.00 3.20 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 14 E 8.38 3.96 0.00 2.15 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 2.48 2.57 0.00 15 Q 7.99 3.97 0.00 2.14 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.81 0.00 0.00 0.00 0.00 0.00 2.35 2.40 0.00 16 R 8.25 4.48 0.00 2.07 2.36 0.00 3.78 0.00 0.00 3.23 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.58 0.00 17 V 7.69 3.80 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 1.22 0.00 0.00 0.35 0.00 0.00 18 E 8.09 3.92 0.00 2.15 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 0.00 2.31 2.40 0.00 19 D 8.22 4.44 0.00 3.22 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 20 V 7.59 3.29 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 0.81 0.00 0.00 -0.07 0.00 0.00 21 R 7.87 3.82 0.00 2.01 2.02 0.00 3.14 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.62 0.00 22 L 7.94 3.88 0.00 1.80 1.79 1.00 0.84 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 23 I 7.75 3.69 1.99 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.31 0.88 0.00 0.00 24 R 8.14 3.97 0.00 1.90 1.93 0.00 3.24 0.00 0.00 2.91 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 25 E 7.63 3.98 0.00 2.11 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 2.29 2.33 0.00 26 Q 7.97 4.18 0.00 1.87 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.94 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 27 H 8.38 4.90 0.00 3.15 3.13 0.00 5.62 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 P 0.00 4.47 0.00 2.16 2.17 0.00 3.33 0.00 0.00 4.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.91 0.00 29 T 7.89 4.57 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 1.21 0.00 0.00 30 K 7.76 4.98 0.00 1.72 1.67 0.00 1.62 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.45 7.81 31 I 8.63 4.11 1.72 0.00 0.00 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.95 0.52 0.00 0.00 32 P 0.00 4.88 0.00 2.15 2.13 0.00 3.10 0.00 0.00 3.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.70 0.00 33 V 9.32 4.82 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 0.95 0.00 0.00 1.00 0.00 0.00 34 I 8.49 4.67 1.15 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 0.12 -0.36 0.67 0.00 0.00 35 I 8.94 5.06 1.82 0.00 0.00 0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 1.22 1.07 0.00 0.00 36 E 8.95 5.01 0.00 1.92 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 0.00 2.30 2.31 0.00 37 R 8.21 2.92 0.00 1.48 1.64 0.00 3.41 0.00 0.00 3.46 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.33 0.00 38 Y 8.30 4.30 0.00 3.00 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 39 K 8.54 3.55 0.00 1.66 1.74 0.00 1.47 0.00 0.00 1.61 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.77 0.78 7.81 40 G 5.38 3.46 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 E 7.86 4.24 0.00 2.07 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 0.00 2.46 2.41 0.00 42 K 8.72 4.54 0.00 1.74 1.79 0.00 1.79 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.49 1.31 7.81 43 Q 8.38 4.33 0.00 2.07 2.00 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 2.24 1.94 0.00 44 L 8.68 4.37 0.00 1.89 1.91 1.31 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.55 0.00 2.23 2.11 0.00 3.84 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.97 0.00 46 V 7.91 4.49 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 1.06 0.00 0.00 0.99 0.00 0.00 47 L 8.45 4.46 0.00 1.90 1.85 1.23 1.09 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 48 D 8.98 4.43 0.00 2.65 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 49 K 7.81 4.71 0.00 1.77 1.51 0.00 1.80 0.00 0.00 1.76 0.00 0.00 2.95 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.23 0.95 7.81 50 T 8.06 5.08 4.38 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 1.31 0.00 0.00 51 K 7.54 4.76 0.00 1.42 1.58 0.00 1.69 0.00 0.00 1.83 0.00 0.00 2.81 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.87 1.08 7.81 52 F 9.44 4.75 0.00 2.90 2.91 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 53 L 8.67 4.96 0.00 1.57 1.53 0.89 0.70 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 54 V 8.55 4.32 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 0.86 0.00 0.00 0.95 0.00 0.00 55 P 0.00 4.58 0.00 1.84 1.89 0.00 3.59 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.06 0.00 56 D 9.28 4.47 0.00 2.86 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 57 H 7.77 4.54 0.00 3.28 3.47 0.00 5.54 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 V 7.40 3.69 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 1.07 0.00 0.00 0.81 0.00 0.00 59 N 9.02 5.25 0.00 3.21 2.96 0.00 0.00 6.62 7.19 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 60 M 8.46 4.11 0.00 2.10 2.18 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.65 2.86 0.00 61 S 8.12 4.07 0.00 3.92 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 62 E 8.74 3.95 0.00 2.15 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 2.32 2.52 0.00 63 L 7.94 3.86 0.00 1.74 1.78 0.81 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 64 I 7.88 3.78 2.09 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 1.68 0.61 0.98 0.00 0.00 65 K 7.82 3.81 0.00 1.92 1.78 0.00 1.63 0.00 0.00 1.53 0.00 0.00 2.89 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.39 1.53 7.81 66 I 7.87 3.63 1.82 0.00 0.00 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 1.48 1.51 0.93 0.00 0.00 67 I 7.70 3.59 1.76 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.66 0.69 0.00 0.00 68 R 7.81 3.26 0.00 1.80 1.68 0.00 2.93 0.00 0.00 3.02 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.80 0.00 69 R 7.83 3.83 0.00 1.82 1.94 0.00 3.28 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.54 0.00 70 R 7.91 4.10 0.00 1.83 2.03 0.00 3.35 0.00 0.00 3.24 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.88 0.00 71 L 7.57 4.21 0.00 1.47 1.57 0.29 0.70 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 72 Q 7.89 3.47 0.00 2.14 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.83 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 73 L 7.63 4.41 0.00 1.45 1.49 0.78 0.81 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 74 N 8.26 4.68 0.00 2.72 2.69 0.00 0.00 6.78 7.91 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 75 A 8.52 3.97 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 76 N 8.04 4.50 0.00 2.70 2.89 0.00 0.00 6.90 7.69 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 77 Q 7.91 4.36 0.00 2.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.82 0.00 0.00 0.00 0.00 0.00 2.36 2.28 0.00 78 A 8.46 4.06 1.36 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 0.00 0.00 0.00 79 F 7.79 4.86 0.00 2.83 2.67 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 80 F 8.43 4.60 0.00 2.88 2.74 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 0.00 0.00 0.00 81 L 8.45 4.81 0.00 1.71 1.53 1.13 0.71 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 82 L 9.09 5.17 0.00 1.51 1.50 0.92 0.40 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 83 V 8.55 4.50 2.02 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 1.07 0.00 0.00 0.95 0.00 0.00 84 N 10.14 4.27 0.00 2.84 2.89 0.00 0.00 7.36 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 85 G 8.69 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 0.00 0.00 0.00 86 H 7.65 4.97 0.00 3.28 3.33 0.00 5.27 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 S 8.48 4.77 0.00 3.80 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 88 M 8.50 4.54 0.00 1.93 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.58 0.00 89 V 8.36 3.92 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 0.68 0.00 0.00 0.96 0.00 0.00 90 S 8.71 4.51 0.00 3.90 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 91 V 7.65 4.69 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 0.80 0.00 0.00 0.99 0.00 0.00 92 S 8.68 4.47 0.00 3.88 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 93 T 7.80 4.06 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 1.29 0.00 0.00 94 P 0.00 4.80 0.00 2.20 1.98 0.00 3.63 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.08 0.00 95 I 8.65 3.78 1.94 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 1.56 1.52 0.99 0.00 0.00 96 S 7.78 4.18 0.00 4.18 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 97 E 8.33 4.07 0.00 2.21 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 0.00 2.36 2.34 0.00 98 V 7.79 3.65 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 1.08 0.00 0.00 0.97 0.00 0.00 99 Y 8.44 4.16 0.00 3.16 3.17 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 0.00 100 E 8.11 3.90 0.00 2.27 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 2.35 2.37 0.00 101 S 7.85 4.64 0.00 4.09 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 0.00 102 E 8.35 4.65 0.00 2.01 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 2.37 2.39 0.00 103 R 7.45 4.06 0.00 1.78 1.37 0.00 2.54 0.00 0.00 2.25 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.36 0.00 104 D 9.19 4.78 0.00 3.11 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 0.00 105 E 8.81 4.20 0.00 2.31 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 0.00 2.39 2.38 0.00 106 D 9.18 4.18 0.00 2.69 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 0.00 107 G 8.13 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 0.00 108 F 8.78 4.64 0.00 3.00 2.39 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 0.00 109 L 8.53 5.05 0.00 2.16 1.69 1.04 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 110 Y 8.86 5.19 0.00 2.92 2.92 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 0.00 111 M 9.30 5.21 0.00 1.93 1.92 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 112 V 8.98 5.68 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 0.83 0.00 0.00 0.94 0.00 0.00 113 Y 7.95 5.27 0.00 2.75 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 0.00 114 A 8.89 5.08 1.29 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 0.00 0.00 0.00 0.00 0.00 0.00 115 S 9.29 5.04 0.00 4.10 3.42 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 8.62 4.69 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.09 7.09 0.00 0.00 0.00 0.00 0.00 2.34 2.65 0.00 117 E 8.67 4.19 0.00 1.81 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 1.47 1.84 0.00 118 T 7.87 4.80 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 1.24 0.00 0.00 119 F 8.23 4.80 0.00 2.96 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.94 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 0.00 121 T 8.20 4.60 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 1.23 0.00 0.00 122 A 8.48 4.18 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