NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 C 5.0182 8.2976 118.1047 56.3518 41.7933 172.4412 4 S 3.9175 7.6548 111.1993 55.3072 66.2223 168.1744 5 V 4.4390 8.7990 119.8986 60.3705 35.3136 174.4399 6 D 5.1248 8.5145 122.6915 52.9274 42.4283 175.6496 7 I 4.8079 8.7331 123.1975 59.2596 41.9197 173.8012 8 Q 5.2554 9.5905 126.7945 54.0756 32.4504 174.6212 9 G 4.4890 9.1543 109.8009 44.5242 0.0000 171.9541 10 N 5.9786 8.1988 121.5860 50.1984 40.4346 174.8384 11 D 4.5274 8.9165 116.9870 56.6708 41.0725 177.1079 12 Q 4.4216 8.1547 117.6048 55.3132 28.9454 175.4005 13 M 3.0410 7.5699 115.5843 56.9213 30.1391 177.1485 14 Q 4.5641 7.7263 115.8813 53.9715 32.2603 175.8386 15 F 5.1926 8.6020 121.3230 57.3940 39.8355 175.1760 16 N 4.8360 8.8442 120.1651 53.3850 37.5820 174.7686 17 T 4.7485 7.8287 114.3661 61.7893 70.7301 173.3015 18 N 5.1808 8.8141 122.5524 53.0240 39.9209 175.1435 19 A 5.3239 8.2653 118.5109 51.9142 22.7909 175.7678 20 I 4.6203 9.4305 124.1035 59.7667 40.1826 174.8644 21 T 5.0867 8.6053 122.4423 61.6794 71.5743 173.5527 22 V 4.0094 8.2859 125.4308 60.5739 33.9783 174.5281 23 D 4.6196 8.8550 130.4591 54.7337 41.6454 177.7200 24 K 4.1098 8.5990 127.4065 56.9732 32.0233 175.9422 25 S 4.3071 8.5884 113.2005 61.9456 62.9157 174.3333 26 C 4.4672 8.2112 121.2995 57.3694 39.4452 174.3404 27 K 4.2972 8.7388 128.1562 57.0390 32.6732 173.5708 28 Q 5.0164 7.9012 115.6953 54.1703 32.0912 174.8321 29 F 4.8117 8.4763 121.2762 56.6967 43.3278 173.2505 30 T 4.7627 7.4741 121.5776 61.5695 71.6063 172.9307 31 V 4.2532 8.4063 126.5554 61.0519 33.8063 174.0701 32 N 4.9372 8.6710 126.0399 51.5552 40.2792 173.3119 33 L 5.0019 8.6695 127.7278 54.0105 44.0931 175.6708 34 S 5.0090 8.9372 119.4733 56.3149 67.4735 173.0305 35 H 6.2468 8.3684 117.1086 53.9437 30.2786 170.5123 36 P 4.5107 0.0000 0.0000 63.2343 33.0165 174.8077 37 G 3.9368 8.2417 106.5749 44.3363 0.0000 172.9806 38 N 4.9385 9.5527 115.1395 52.0381 38.6687 174.2444 39 L 4.4464 8.0238 120.1369 53.0441 43.0607 174.8181 40 P 4.9174 0.0000 0.0000 61.4445 32.7229 177.0573 41 K 3.9365 8.5961 119.3924 59.5076 32.0940 178.2609 42 N 4.4858 8.1711 114.4646 54.3805 37.5900 175.6254 43 V 4.3737 7.2386 117.1568 62.2616 33.6038 175.6439 44 M 4.8799 8.2261 121.0832 54.2174 31.2700 175.5953 45 G 3.9653 8.3510 105.2639 46.5600 0.0000 173.5439 46 H 5.4920 9.2704 120.4039 53.7319 32.2619 172.5096 47 N 5.7068 8.9112 117.6443 50.8819 41.6086 172.4919 48 W 5.3504 9.1488 128.4231 55.6564 33.6624 174.0771 49 V 4.4930 7.8123 126.3356 60.7106 34.7195 173.5723 50 L 4.7853 8.1530 129.1918 53.1212 44.6527 175.2949 51 S 5.2076 8.7522 119.5753 57.1159 67.0941 173.6473 52 T 4.2488 8.5908 109.8827 61.2402 69.1641 174.6938 53 A 4.0233 8.7817 125.1897 55.5427 18.0434 180.2607 54 A 3.9118 7.7759 117.7194 55.0052 18.8479 178.8070 55 D 4.4838 7.8231 116.3129 56.1146 40.9968 178.4050 56 M 3.6975 7.5639 119.7694 58.5345 32.0248 177.7658 57 Q 3.8944 7.9281 119.1666 59.2390 29.1762 178.4820 58 G 3.5539 7.9441 106.1997 47.5388 0.0000 175.6578 59 V 3.6241 7.8042 120.6084 65.8103 31.5145 178.2776 60 V 3.6206 7.9871 118.1313 66.3471 31.4428 178.0555 61 T 3.8304 8.1187 115.6571 66.9520 68.1293 176.5177 62 D 4.5230 8.2402 119.6241 57.0637 41.0558 178.8348 63 G 4.1825 8.2264 107.8398 47.6699 0.0000 175.6675 64 M 4.1902 8.4068 121.4385 58.1305 31.7461 178.7569 65 A 4.1095 7.8736 119.7129 55.0026 18.7150 179.3305 66 S 4.3462 8.2324 113.8034 58.6948 63.2944 175.4678 67 G 4.2551 7.9592 107.9335 44.2777 0.0000 173.7882 68 L 2.7648 8.0609 119.0113 57.9729 41.7669 178.4388 69 D 4.5043 7.8285 114.5866 55.5846 41.3016 176.7698 70 K 4.4335 7.6716 118.5240 55.7799 32.5229 176.0710 71 D 4.4541 8.3943 116.2243 55.2651 39.1911 173.2993 72 Y 4.0950 7.6221 113.6105 59.0785 36.0711 170.3972 73 L 5.0043 7.7178 116.4641 52.4618 45.8792 176.8698 74 K 4.3315 8.4994 123.5151 54.9411 32.7052 174.4083 75 P 4.2064 0.0000 0.0000 64.4561 31.6618 175.5609 76 D 4.3881 8.9066 120.1142 55.1013 38.6043 173.1590 77 D 4.3658 7.7473 120.1693 54.5278 40.9137 177.0305 78 S 4.4602 8.5975 121.3412 59.8240 63.4669 175.3590 79 R 4.0104 8.2765 120.2728 58.1782 30.1225 176.6638 80 V 4.0685 7.4275 117.7722 61.9457 31.1964 175.5580 81 I 4.0338 8.5513 129.8612 64.2488 37.5784 176.6860 82 A 4.8725 7.6534 121.0478 51.3234 22.3651 174.9456 83 H 5.5223 8.5725 114.6091 54.7989 31.5175 173.1838 84 T 4.6691 8.8538 111.7262 60.3527 70.7364 174.0215 85 K 4.4623 9.4065 122.5576 56.2083 33.9434 176.2436 86 L 4.7444 8.8422 123.3572 54.8296 42.7775 175.9362 87 I 4.8228 9.1381 119.1746 59.3036 41.3092 175.2697 88 G 4.4867 9.2918 112.5084 44.2759 0.0000 172.8978 89 S 4.3950 8.1628 114.9483 59.6147 63.1370 174.9403 90 G 4.0198 8.8748 111.8534 45.7674 0.0000 173.8020 91 E 4.4056 7.8255 119.1404 55.9343 30.4674 175.3317 92 K 5.1145 8.0580 117.9955 55.3803 36.4428 175.5043 93 D 4.7545 8.9517 121.2305 53.2696 45.0006 174.1382 94 S 5.3751 8.6734 120.5323 56.7187 66.0501 173.7532 95 V 4.5628 8.4912 121.2485 60.3185 34.6252 174.3947 96 T 5.2418 8.6368 119.5561 61.8230 71.2990 173.2248 97 F 5.0838 8.5989 119.2804 54.9805 42.4357 173.3965 98 D 4.8275 8.8159 119.6765 53.6866 41.4089 177.3851 99 V 3.7780 8.4830 127.9647 65.6462 31.7134 177.8718 100 S 4.3566 8.2571 113.3979 60.1826 62.8763 175.4918 101 K 4.0802 8.0221 120.3509 58.3075 31.9376 176.7907 102 L 4.0961 7.7370 119.8243 53.3893 42.1597 176.2109 103 K 4.5777 9.0869 124.1600 54.3815 33.6280 176.2117 104 E 4.0474 8.7635 121.6358 58.5995 29.6573 177.9812 105 G 3.9291 9.0181 111.4134 45.2699 0.0000 172.9669 106 E 4.0845 7.5793 119.5464 55.2239 30.7319 174.9275 107 Q 4.4053 8.4708 125.4532 54.7277 30.8959 173.6738 108 Y 5.1999 8.4014 124.0720 56.6113 40.9537 174.6818 109 M 5.3518 9.2180 122.6144 53.4628 36.1277 174.5778 110 F 5.0788 8.4408 117.1364 55.3426 41.2606 174.1833 111 F 5.3950 7.8865 113.3302 56.5290 40.6893 172.0467 112 C 5.4514 9.0952 120.8813 57.9674 32.4057 174.6912 113 T 4.2001 9.5487 118.0853 64.3134 68.6550 174.3611 114 P 4.0455 0.0000 0.0000 64.0608 31.6603 175.6557 115 H 5.0343 7.1745 115.5846 53.0600 32.1073 172.7187 116 P 4.6312 0.0000 0.0000 62.4367 29.6235 174.9199 117 M 4.9564 7.5778 121.5205 54.1750 36.2742 175.2854 118 K 4.9906 8.5893 121.2119 56.5834 36.0390 174.1456 119 G 3.4587 7.8750 107.1529 45.9435 0.0000 172.0223 120 T 5.0915 8.2848 109.8449 59.8932 71.3318 173.5564 121 L 5.4675 8.6598 125.4436 53.8327 44.6894 175.7109 122 T 4.8729 8.8440 121.8363 61.5647 72.7955 173.1584 123 L 4.5026 8.5742 125.1926 54.1604 42.6116 176.9209 124 K 4.1993 8.8953 124.6560 56.7369 31.7483 176.4297 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 3 C 8.30 5.02 0.00 2.80 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 S 7.65 3.92 0.00 3.58 3.40 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 5 V 8.80 4.44 2.16 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 0.60 0.00 0.00 0.88 0.00 0.00 6 D 8.51 5.12 0.00 2.51 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 7 I 8.73 4.81 1.62 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 1.26 1.88 0.53 0.00 0.00 8 Q 9.59 5.26 0.00 2.08 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.53 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 9 G 9.15 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 N 8.20 5.98 0.00 2.90 2.99 0.00 0.00 6.88 7.52 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 11 D 8.92 4.53 0.00 2.72 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 12 Q 8.15 4.42 0.00 2.16 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 13 M 7.57 3.04 0.00 2.01 2.06 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.19 0.00 14 Q 7.73 4.56 0.00 2.20 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.80 7.07 0.00 0.00 0.00 0.00 0.00 2.33 2.52 0.00 15 F 8.60 5.19 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 16 N 8.84 4.84 0.00 2.91 3.00 0.00 0.00 6.61 7.39 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 17 T 7.83 4.75 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 1.28 0.00 0.00 18 N 8.81 5.18 0.00 2.43 2.76 0.00 0.00 6.31 7.25 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 19 A 8.27 5.32 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 20 I 9.43 4.62 2.02 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 1.19 0.77 0.95 0.00 0.00 21 T 8.61 5.09 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 1.25 0.00 0.00 22 V 8.29 4.01 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 0.52 0.00 0.00 -0.08 0.00 0.00 23 D 8.85 4.62 0.00 2.74 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.60 4.11 0.00 1.82 1.71 0.00 1.87 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.36 1.03 7.81 25 S 8.59 4.31 0.00 3.94 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 26 C 8.21 4.47 0.00 3.05 3.28 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 27 K 8.74 4.30 0.00 1.45 1.80 0.00 1.73 0.00 0.00 1.87 0.00 0.00 2.80 0.00 0.00 2.74 0.00 0.00 0.00 0.00 1.42 1.00 7.81 28 Q 7.90 5.02 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.68 0.00 0.00 0.00 0.00 0.00 2.13 2.19 0.00 29 F 8.48 4.81 0.00 2.66 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 0.00 0.00 0.00 30 T 7.47 4.76 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 0.99 0.00 0.00 31 V 8.41 4.25 1.20 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 -0.19 0.00 0.00 0.08 0.00 0.00 32 N 8.67 4.94 0.00 2.64 2.62 0.00 0.00 6.20 7.60 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 33 L 8.67 5.00 0.00 1.72 1.70 1.23 1.20 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 34 S 8.94 5.01 0.00 3.91 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 35 H 8.37 6.25 0.00 3.26 3.28 0.00 5.73 0.00 0.00 0.00 0.00 6.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 P 0.00 4.51 0.00 2.16 2.01 0.00 3.85 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.34 2.15 0.00 37 G 8.24 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 38 N 9.55 4.94 0.00 2.72 2.88 0.00 0.00 6.92 7.92 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 39 L 8.02 4.45 0.00 1.89 1.62 0.93 0.83 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 40 P 0.00 4.92 0.00 2.22 2.18 0.00 3.70 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 1.95 0.00 41 K 8.60 3.94 0.00 1.82 1.86 0.00 1.96 0.00 0.00 2.03 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.53 1.48 7.81 42 N 8.17 4.49 0.00 2.89 2.95 0.00 0.00 5.82 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 43 V 7.24 4.37 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 0.77 0.00 0.00 0.95 0.00 0.00 44 M 8.23 4.88 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.55 0.00 45 G 8.35 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 46 H 9.27 5.49 0.00 3.17 3.25 0.00 5.56 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.91 5.71 0.00 2.95 3.04 0.00 0.00 5.54 8.88 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 48 W 9.15 5.35 0.00 3.46 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 49 V 7.81 4.49 0.98 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 0.56 0.00 0.00 0.86 0.00 0.00 50 L 8.15 4.79 0.00 1.02 1.20 0.89 -0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 0.00 0.00 0.00 0.00 0.00 0.00 51 S 8.75 5.21 0.00 4.12 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 52 T 8.59 4.25 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 1.14 0.00 0.00 53 A 8.78 4.02 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 54 A 7.78 3.91 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 55 D 7.82 4.48 0.00 2.82 2.75 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 56 M 7.56 3.70 0.00 1.78 1.62 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.90 0.00 57 Q 7.93 3.89 0.00 2.05 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.68 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 58 G 7.94 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.80 3.62 2.38 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 1.20 0.00 0.00 1.07 0.00 0.00 60 V 7.99 3.62 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 1.06 0.00 0.00 0.81 0.00 0.00 61 T 8.12 3.83 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 1.20 0.00 0.00 62 D 8.24 4.52 0.00 2.75 2.75 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 63 G 8.23 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 64 M 8.41 4.19 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.83 0.00 65 A 7.87 4.11 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 66 S 8.23 4.35 0.00 4.09 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 67 G 7.96 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 0.00 0.00 0.00 0.00 68 L 8.06 2.76 0.00 1.43 1.49 0.77 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 69 D 7.83 4.50 0.00 2.64 2.65 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 0.00 0.00 0.00 0.00 70 K 7.67 4.43 0.00 1.96 1.90 0.00 1.93 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.42 0.99 7.81 71 D 8.39 4.45 0.00 2.84 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 72 Y 7.62 4.09 0.00 3.18 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 73 L 7.72 5.00 0.00 1.71 1.45 0.79 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.50 4.33 0.00 1.81 1.86 0.00 1.79 0.00 0.00 1.79 0.00 0.00 3.10 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.44 7.81 75 P 0.00 4.21 0.00 2.09 2.00 0.00 3.88 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 2.04 2.13 0.00 76 D 8.91 4.39 0.00 2.84 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 77 D 7.75 4.37 0.00 2.85 2.59 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 78 S 8.60 4.46 0.00 4.04 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 79 R 8.28 4.01 0.00 1.99 2.15 0.00 3.17 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 80 V 7.43 4.07 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 0.81 0.00 0.00 0.95 0.00 0.00 81 I 8.55 4.03 1.74 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 1.15 0.65 0.63 0.00 0.00 82 A 7.65 4.87 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 83 H 8.57 5.52 0.00 3.14 3.23 0.00 5.72 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 T 8.85 4.67 4.48 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 1.32 0.00 0.00 85 K 9.41 4.46 0.00 1.79 1.93 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.93 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.68 1.44 7.81 86 L 8.84 4.74 0.00 1.84 1.65 1.17 1.00 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 87 I 9.14 4.82 1.94 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.91 0.98 0.00 0.00 88 G 9.29 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.16 4.40 0.00 4.00 3.79 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 90 G 8.87 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 91 E 7.83 4.41 0.00 2.21 1.91 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 2.33 2.28 0.00 92 K 8.06 5.11 0.00 1.57 1.63 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.86 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.43 7.81 93 D 8.95 4.75 0.00 2.80 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 94 S 8.67 5.38 0.00 3.69 3.61 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.49 4.56 2.24 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 0.99 0.00 0.00 1.10 0.00 0.00 96 T 8.64 5.24 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 1.11 0.00 0.00 97 F 8.60 5.08 0.00 3.06 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 98 D 8.82 4.83 0.00 2.75 2.68 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 99 V 8.48 3.78 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 0.94 0.00 0.00 0.77 0.00 0.00 100 S 8.26 4.36 0.00 4.06 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 0.00 101 K 8.02 4.08 0.00 2.19 1.91 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.47 1.28 7.81 102 L 7.74 4.10 0.00 1.71 1.48 0.93 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 103 K 9.09 4.58 0.00 1.90 1.78 0.00 1.71 0.00 0.00 1.65 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.55 1.62 7.81 104 E 8.76 4.05 0.00 1.98 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 2.36 2.31 0.00 105 G 9.02 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 0.00 106 E 7.58 4.08 0.00 1.84 1.71 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 1.89 1.47 0.00 107 Q 8.47 4.41 0.00 2.01 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.55 0.00 0.00 0.00 0.00 0.00 2.19 2.25 0.00 108 Y 8.40 5.20 0.00 3.21 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 0.00 109 M 9.22 5.35 0.00 1.90 1.99 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.56 0.00 110 F 8.44 5.08 0.00 1.73 2.58 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 0.00 0.00 0.00 0.00 111 F 7.89 5.39 0.00 3.12 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 0.00 112 C 9.10 5.45 0.00 3.19 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 0.00 113 T 9.55 4.20 4.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 114 P 0.00 4.05 0.00 1.65 1.28 0.00 3.73 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.94 0.00 115 H 7.17 5.03 0.00 3.27 3.14 0.00 5.67 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 P 0.00 4.63 0.00 2.15 2.07 0.00 3.72 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 117 M 7.58 4.96 0.00 1.35 1.65 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 118 K 8.59 4.99 0.00 1.75 1.76 0.00 1.51 0.00 0.00 1.63 0.00 0.00 2.73 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.35 7.81 119 G 7.88 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 0.00 120 T 8.28 5.09 4.29 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 1.19 0.00 0.00 121 L 8.66 5.47 0.00 2.01 1.75 1.19 0.96 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 0.00 122 T 8.84 4.87 4.29 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 1.25 0.00 0.00 123 L 8.57 4.50 0.00 1.57 1.62 0.97 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 124 K 8.90 4.20 0.00 1.81 1.69 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.41 7.81