NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 S 4.4508 8.3349 115.4107 58.0894 64.3654 172.7100 1 R 4.3531 8.0015 119.9855 53.4486 33.0635 174.5961 2 G 2.8100 8.5554 111.2094 45.2817 0.0000 172.6132 3 I 4.6321 8.4342 121.2359 58.2495 40.6322 173.6243 4 P 4.8598 0.0000 0.0000 61.8994 32.0325 174.5037 5 P 5.1617 0.0000 0.0000 62.7408 32.5234 175.6851 6 K 4.6727 8.4420 122.5357 54.9114 35.3912 175.0027 7 I 4.3052 8.9767 129.8762 61.5650 37.6829 176.3776 8 E 4.5374 8.7901 126.9122 54.8128 31.6356 175.4400 9 A 3.8239 8.0802 121.4457 52.2030 18.8070 176.7653 10 L 4.8463 8.2070 123.9239 52.1694 45.1016 174.5096 11 P 4.5006 0.0000 0.0000 63.0619 32.2474 176.6712 12 S 4.4703 8.7404 116.6804 61.2196 63.9655 174.0607 13 D 5.5160 8.0221 117.0186 52.4544 44.4231 175.0965 14 I 4.8334 8.9662 115.2666 59.3485 41.3932 174.2659 15 S 5.3585 8.5882 118.3002 57.1595 66.5469 173.2138 16 I 4.6090 8.5349 121.5080 59.7158 41.8382 173.6870 17 D 4.8373 8.6655 127.9390 53.5190 42.1897 175.6251 18 E 4.0818 8.0034 123.2472 57.9483 30.0198 177.6573 19 G 3.9335 9.2494 113.6539 45.2228 0.0000 173.2299 20 K 4.5053 7.4694 118.8212 54.7009 35.1376 175.3356 21 V 4.4730 8.0825 121.2896 62.0773 32.6047 174.6186 22 L 4.7293 8.6899 129.6481 53.5004 44.5756 174.9514 23 T 5.1248 8.4437 121.9974 61.6120 71.7625 173.6341 24 V 4.4808 8.6528 124.7785 59.8578 34.3382 174.2690 25 A 5.3482 8.7632 126.4491 50.3627 21.7823 175.1007 26 C 4.8224 9.2347 120.4001 58.0565 35.5118 173.3566 27 A 4.9525 8.7826 127.7490 51.6950 20.2009 175.5313 28 F 5.3533 7.9680 113.2144 56.4382 41.9960 172.7289 29 T 4.6623 9.7282 109.2057 59.6017 72.5292 171.5386 30 G 4.2525 7.8619 107.3500 43.9071 0.0000 172.8491 31 E 4.6469 8.8469 122.9030 53.6776 33.0312 174.0685 32 P 4.7664 0.0000 0.0000 62.0775 32.1625 176.2008 33 T 3.9556 8.5221 116.0165 64.0771 68.6338 172.6051 34 P 4.6378 0.0000 0.0000 62.2062 32.6343 175.7732 35 E 4.1185 9.1494 125.1245 56.1427 30.8397 175.3766 36 V 4.5152 8.2718 126.4897 61.5642 33.4640 174.7519 37 T 4.6638 8.5239 123.9893 61.5984 71.6509 172.8070 38 W 5.3201 8.9092 126.2634 55.2624 31.6698 175.3444 39 S 4.8989 9.3017 117.5599 56.9923 66.8988 172.3210 40 C 4.6271 8.5615 121.6006 57.7432 34.2624 174.2346 41 G 4.0117 9.1279 115.6815 46.8060 0.0000 174.5503 42 G 3.8786 8.4910 105.9709 45.0309 0.0000 174.1041 43 R 4.5063 7.3791 119.0945 53.4431 32.2863 175.2375 44 K 4.2705 8.5727 124.1709 57.1204 32.9154 175.6764 45 I 4.1120 9.1169 128.4279 60.6647 38.3169 174.8465 46 H 4.7202 8.4671 124.1895 54.0988 30.1006 175.3549 47 S 4.5090 8.8158 118.2442 57.5860 60.4094 172.0311 48 Q 4.6305 8.2148 126.1611 53.7052 30.0804 177.1761 49 E 4.2249 8.9674 122.6771 58.8075 30.1999 177.7102 50 Q 4.5451 6.9044 119.4783 52.5283 27.7690 174.1039 51 G 4.0358 7.1783 105.0330 45.8923 0.0000 170.7119 52 R 4.3920 8.2835 116.0492 56.5983 31.9211 176.1995 53 F 5.0096 8.1961 118.6026 56.0455 41.2761 174.5546 54 H 5.0166 9.1672 120.1033 54.0915 32.9276 172.3397 55 I 4.9556 8.8242 123.7677 59.5054 39.8583 174.7513 56 E 4.7735 9.1394 126.4158 54.6097 32.1764 174.6718 57 N 5.6846 9.0245 121.9675 51.9124 41.4449 174.2060 58 T 4.9313 8.8794 114.9637 60.0572 71.4359 173.2245 59 D 4.6016 8.7899 119.7494 57.7326 41.1281 176.8195 60 D 4.0360 7.7781 115.9487 51.0152 41.6559 174.7738 61 L 4.7941 7.0992 119.6514 54.6393 45.7294 173.6983 62 T 5.4418 9.4433 120.6105 60.7349 70.9444 172.4937 63 T 5.0677 9.2004 124.4868 61.7165 72.2791 172.3857 64 L 4.7227 8.6547 128.9123 53.2937 44.1655 174.8700 65 I 4.7738 8.5658 127.3721 59.5524 40.0935 174.5145 66 I 4.3468 8.3997 128.7516 59.6770 38.8397 175.2181 67 M 4.2823 8.5670 127.4989 54.3895 32.9269 176.0333 68 D 4.3431 8.3306 118.4273 55.1468 39.7713 173.8059 69 V 3.8398 7.8395 120.1861 63.3317 32.7275 175.0011 70 Q 4.8618 8.9475 126.1033 53.7737 31.0461 176.6433 71 K 3.9545 8.5573 120.9225 59.3859 32.2881 178.1615 72 Q 4.3550 7.9605 114.0741 56.8196 29.1379 176.2921 73 D 4.7153 8.1626 119.0658 56.6567 41.2531 177.3128 74 G 3.8506 7.5877 107.2123 45.0967 0.0000 174.3799 75 G 3.7952 7.3095 106.9188 44.7632 0.0000 170.4909 76 L 4.9462 8.0032 122.9105 53.9125 43.7185 175.6052 77 Y 5.0279 9.2237 124.9810 56.8439 40.5026 174.8890 78 T 4.9980 9.5007 121.1606 61.6960 71.7294 172.7935 79 L 4.1396 8.5125 129.3904 53.3815 43.6147 175.2347 80 S 5.1320 8.5671 120.8334 56.4125 66.3893 172.9434 81 L 5.0422 8.9133 122.5750 53.0256 45.1628 175.7883 82 G 4.4595 8.5097 108.4026 45.0793 0.0000 171.7711 83 N 5.0345 8.5932 121.3021 51.2349 40.2392 174.4880 84 E 3.9548 8.5946 116.0694 57.9684 29.3831 177.2769 85 F 4.8378 9.8047 116.7193 56.2484 40.7607 175.9806 86 G 3.9178 6.3414 107.9264 45.5280 0.0000 171.3058 87 S 5.1504 7.7766 113.5179 57.5476 66.4979 172.4756 88 D 4.8726 8.7033 118.3323 53.4672 44.7802 173.8240 89 S 5.1503 8.3428 115.7076 57.2698 66.1064 172.9433 90 A 4.8614 8.8508 122.1179 50.7629 22.8121 175.1104 91 T 5.2369 8.5512 109.8741 59.8012 71.7321 173.7558 92 V 4.6747 8.7921 122.7224 60.0342 35.0372 173.9682 93 N 4.9414 9.2339 123.5232 52.6397 40.3240 173.7555 94 I 4.6262 8.5973 128.8559 60.5957 38.7438 174.6185 95 H 5.1721 9.4867 125.3993 54.1933 31.0242 174.0207 96 I 4.7429 8.2972 123.5276 59.9310 38.5363 175.9493 97 R 4.2324 8.8745 125.3076 56.4260 30.1783 176.4745 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 0 S 8.33 4.45 0.00 3.98 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 1 R 8.00 4.35 0.00 1.77 1.68 0.00 3.15 0.00 0.00 3.15 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 1.62 0.00 2 G 8.56 2.81 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 3 I 8.43 4.63 1.97 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 1.22 0.78 0.92 0.00 0.00 4 P 0.00 4.86 0.00 2.09 2.29 0.00 3.51 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 2.01 2.12 0.00 5 P 0.00 5.16 0.00 2.04 2.06 0.00 3.34 0.00 0.00 4.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.81 0.00 6 K 8.44 4.67 0.00 1.86 1.69 0.00 1.81 0.00 0.00 1.83 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.41 1.55 7.81 7 I 8.98 4.31 1.86 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.58 0.92 0.00 0.00 8 E 8.79 4.54 0.00 1.92 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 2.34 2.31 0.00 9 A 8.08 3.82 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 10 L 8.21 4.85 0.00 1.58 1.54 1.12 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 11 P 0.00 4.50 0.00 2.13 2.01 0.00 3.81 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 2.07 2.15 0.00 12 S 8.74 4.47 0.00 3.81 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 13 D 8.02 5.52 0.00 2.53 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 14 I 8.97 4.83 1.86 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.91 0.93 0.00 0.00 15 S 8.59 5.36 0.00 3.73 3.77 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 16 I 8.53 4.61 1.82 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.38 0.87 0.00 0.00 17 D 8.67 4.84 0.00 2.63 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 18 E 8.00 4.08 0.00 1.95 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 2.32 2.42 0.00 19 G 9.25 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 20 K 7.47 4.51 0.00 1.71 1.69 0.00 1.65 0.00 0.00 1.55 0.00 0.00 2.80 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.47 1.48 7.81 21 V 8.08 4.47 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 0.67 0.00 0.00 0.87 0.00 0.00 22 L 8.69 4.73 0.00 1.66 1.30 0.84 0.78 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 23 T 8.44 5.12 4.19 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 1.16 0.00 0.00 24 V 8.65 4.48 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 0.59 0.00 0.00 1.03 0.00 0.00 25 A 8.76 5.35 1.26 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 26 C 9.23 4.82 0.00 3.19 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 27 A 8.78 4.95 1.21 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 0.00 0.00 28 F 7.97 5.35 0.00 3.20 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 29 T 9.73 4.66 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 1.26 0.00 0.00 30 G 7.86 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 0.00 0.00 0.00 0.00 31 E 8.85 4.65 0.00 1.95 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 2.25 2.41 0.00 32 P 0.00 4.77 0.00 2.09 2.05 0.00 3.89 0.00 0.00 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.23 0.00 33 T 8.52 3.96 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 1.35 0.00 0.00 34 P 0.00 4.64 0.00 1.65 1.88 0.00 3.92 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 35 E 9.15 4.12 0.00 1.99 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 2.27 2.24 0.00 36 V 8.27 4.52 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 0.83 0.00 0.00 0.66 0.00 0.00 37 T 8.52 4.66 4.14 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 1.19 0.00 0.00 38 W 8.91 5.32 0.00 3.35 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 39 S 9.30 4.90 0.00 3.81 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 40 C 8.56 4.63 0.00 1.66 2.32 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 41 G 9.13 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.49 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 0.00 0.00 0.00 43 R 7.38 4.51 0.00 1.92 1.75 0.00 3.09 0.00 0.00 3.05 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.64 0.00 44 K 8.57 4.27 0.00 1.70 1.60 0.00 1.73 0.00 0.00 1.66 0.00 0.00 2.89 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.14 1.58 7.81 45 I 9.12 4.11 1.99 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.20 0.87 0.00 0.00 46 H 8.47 4.72 0.00 3.00 3.22 0.00 5.70 0.00 0.00 0.00 0.00 6.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 S 8.82 4.51 0.00 3.90 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 48 Q 8.21 4.63 0.00 2.17 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.49 6.67 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 49 E 8.97 4.22 0.00 1.99 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 2.40 0.00 50 Q 6.90 4.55 0.00 2.24 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.74 0.00 0.00 0.00 0.00 0.00 2.32 2.29 0.00 51 G 7.18 4.04 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 0.00 0.00 0.00 52 R 8.28 4.39 0.00 1.72 1.94 0.00 3.25 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 53 F 8.20 5.01 0.00 2.95 2.96 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 54 H 9.17 5.02 0.00 3.00 3.14 0.00 5.55 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 55 I 8.82 4.96 1.97 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.63 1.13 0.00 0.00 56 E 9.14 4.77 0.00 1.95 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.27 0.00 57 N 9.02 5.68 0.00 2.68 2.87 0.00 0.00 6.98 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 T 8.88 4.93 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 1.24 0.00 0.00 59 D 8.79 4.60 0.00 2.65 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 60 D 7.78 4.04 0.00 2.47 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 61 L 7.10 4.79 0.00 1.61 1.44 0.93 0.60 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 62 T 9.44 5.44 4.66 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 0.00 0.00 0.00 1.69 0.00 0.00 63 T 9.20 5.07 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 1.19 0.00 0.00 64 L 8.65 4.72 0.00 0.27 0.65 0.66 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 65 I 8.57 4.77 1.83 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.63 0.83 0.00 0.00 66 I 8.40 4.35 1.56 0.00 0.00 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.48 0.04 0.00 0.00 67 M 8.57 4.28 0.00 1.84 1.92 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.41 0.00 68 D 8.33 4.34 0.00 2.81 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.84 3.84 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 0.87 0.00 0.00 0.90 0.00 0.00 70 Q 8.95 4.86 0.00 2.16 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.89 6.55 0.00 0.00 0.00 0.00 0.00 2.45 2.45 0.00 71 K 8.56 3.95 0.00 1.85 1.83 0.00 1.62 0.00 0.00 1.89 0.00 0.00 3.06 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.53 1.52 7.81 72 Q 7.96 4.35 0.00 2.23 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.90 0.00 0.00 0.00 0.00 0.00 2.38 2.36 0.00 73 D 8.16 4.72 0.00 2.95 2.96 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 74 G 7.59 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 75 G 7.31 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 76 L 8.00 4.95 0.00 1.80 1.57 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 77 Y 9.22 5.03 0.00 3.23 3.21 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 78 T 9.50 5.00 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 1.14 0.00 0.00 79 L 8.51 4.14 0.00 0.27 1.00 -0.06 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.57 5.13 0.00 3.77 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 81 L 8.91 5.04 0.00 1.38 1.34 0.66 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 82 G 8.51 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 0.00 0.00 0.00 0.00 83 N 8.59 5.03 0.00 3.00 2.97 0.00 0.00 6.66 6.97 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 84 E 8.59 3.95 0.00 1.25 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 2.10 2.19 0.00 85 F 9.80 4.84 0.00 3.12 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 6.34 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 S 7.78 5.15 0.00 3.86 3.76 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 88 D 8.70 4.87 0.00 2.95 2.42 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 89 S 8.34 5.15 0.00 3.77 3.68 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 90 A 8.85 4.86 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 91 T 8.55 5.24 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 1.22 0.00 0.00 92 V 8.79 4.67 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.02 0.00 0.00 93 N 9.23 4.94 0.00 2.81 2.93 0.00 0.00 6.94 7.97 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 94 I 8.60 4.63 1.87 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.84 0.78 0.00 0.00 95 H 9.49 5.17 0.00 3.02 3.21 0.00 5.60 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 96 I 8.30 4.74 1.90 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 1.39 0.96 0.97 0.00 0.00 97 R 8.87 4.23 0.00 1.87 1.82 0.00 3.35 0.00 0.00 3.20 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.58 0.00