NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1483 8.1727 122.0449 56.2459 34.0857 174.0283 2 V 4.6250 8.1449 127.0106 60.5546 32.7226 174.3248 3 F 4.5790 9.8545 128.7382 57.6169 40.1239 174.9909 4 E 4.2279 9.2591 121.1202 55.5780 31.0661 176.6707 5 R 3.3076 8.9575 120.0570 60.7009 29.9666 179.3911 6 C 4.3278 8.0212 115.5791 59.6486 34.5329 175.8694 7 E 3.8875 8.0710 120.8156 59.0899 29.3783 178.3848 8 L 3.2405 7.9191 120.1323 57.8146 42.0102 178.4656 9 A 3.9090 7.7185 120.6673 55.5300 18.2557 179.8479 10 R 3.8459 7.8492 116.1273 59.6698 30.2158 179.5464 11 T 3.8628 7.7136 115.0195 66.5503 68.5259 176.8225 12 L 3.8434 8.2213 121.2849 57.4777 41.5501 179.4562 13 K 3.9021 8.1998 119.6970 59.7455 31.9810 179.0403 14 R 3.9362 8.1489 117.1888 58.8687 29.9553 177.9902 15 L 4.4309 7.4117 116.3003 53.9942 41.7544 176.7703 16 G 3.8473 8.0241 106.8450 47.0907 0.0000 175.0331 17 M 4.0526 7.7011 119.7289 55.8121 32.5196 175.7658 18 D 4.5001 8.0046 117.7571 55.6913 40.5582 175.3990 19 G 3.9124 9.4958 115.3373 45.4606 0.0000 170.9012 20 Y 4.1777 8.1165 121.4279 58.6472 38.8233 176.4252 21 R 3.6060 9.1998 125.9327 57.1133 27.7021 177.3505 22 G 3.8601 8.4283 105.5374 45.2126 0.0000 174.1608 23 I 4.0109 7.5234 122.1276 59.5617 38.0214 175.8685 24 S 4.6621 8.2875 120.0976 57.4964 64.1407 174.7332 25 L 4.1627 8.5595 122.7346 58.7153 41.8550 179.4785 26 A 4.1561 8.1205 119.7744 54.8880 18.2951 179.2756 27 N 4.5003 8.4688 115.9011 56.2811 38.6712 177.6311 28 W 4.2354 8.0197 119.8696 60.0836 29.2011 178.3112 29 M 4.1568 8.5651 118.9573 58.5720 31.4795 178.0455 30 C 3.4165 8.0905 118.3283 59.1414 40.3423 175.1856 31 L 3.9771 8.2530 121.8472 58.0422 41.6401 178.4209 32 A 4.2494 8.3735 120.6417 55.4100 18.1204 179.2328 33 K 2.8212 7.9686 117.6893 59.4059 31.9007 178.6437 34 W 4.2273 7.6446 116.4075 58.4564 29.1960 178.4529 35 E 4.3447 8.5043 119.0432 58.6380 29.0458 177.6774 36 S 4.5465 8.1111 109.9800 56.5133 64.4992 174.1662 37 G 3.0815 8.2579 108.4422 46.9554 0.0000 173.7881 38 Y 3.7353 7.8287 113.2709 58.2367 35.1922 168.4050 39 N 5.2998 7.6786 119.4543 52.2297 39.3579 175.7723 40 T 4.1727 9.0691 117.9736 63.1692 70.0316 175.7447 41 R 4.8484 8.0791 118.3795 55.7649 30.3829 176.0317 42 A 4.4415 7.7810 121.0895 52.9571 19.4788 177.6702 43 T 5.1320 8.3062 110.6528 60.3118 72.7005 173.4469 44 N 4.8548 8.8898 120.3034 52.2053 42.5107 172.9141 45 Y 4.7211 8.7448 126.1760 57.0550 40.5465 173.7498 46 N 4.6978 8.6407 124.9290 51.2517 39.2914 175.6444 47 A 3.5304 8.3313 127.9580 54.4844 18.6363 178.7691 48 G 3.6418 7.7904 104.8005 48.1098 0.0000 174.1377 49 D 4.7237 7.7974 117.8308 51.5140 39.6509 176.3502 50 R 3.8211 7.9092 116.0638 57.0136 27.9143 175.1878 51 S 4.9222 7.4222 110.1466 56.8774 67.0031 173.3014 52 T 5.1360 9.2586 115.9269 61.9679 72.7414 172.8092 53 D 5.4345 9.0984 125.0937 53.1739 43.2237 175.1070 54 Y 4.9726 9.3538 121.3286 57.3219 41.6403 177.6924 55 G 4.3597 8.8251 111.6175 44.5790 0.0000 173.7466 56 I 4.0567 8.2301 116.8525 62.8659 37.7857 177.0126 57 F 4.8362 7.8545 115.5879 56.5073 40.1597 174.9731 58 Q 3.7404 7.8913 118.8824 57.0914 26.3862 174.1053 59 I 4.3430 8.0445 119.0700 61.2094 39.2768 176.8091 60 N 5.3758 9.2212 126.1469 53.1709 38.6536 175.8300 61 S 4.2748 9.4625 121.4031 61.6849 63.7816 176.4360 62 R 3.7533 8.5946 121.1116 58.5887 30.4142 178.0624 63 Y 4.1079 7.4347 112.4723 58.5013 40.2892 177.5785 64 W 4.6354 7.9636 118.7384 57.9896 29.9663 173.6484 65 C 6.1787 7.8601 109.3317 52.5212 39.8216 172.2065 66 N 4.8965 8.8341 118.9646 52.0061 39.7720 174.4601 67 D 4.7517 8.5358 123.2212 52.2506 40.2897 178.4204 68 G 4.0575 8.5778 108.2111 46.2697 0.0000 174.7701 69 K 4.3769 7.9886 116.5122 56.7960 33.5458 176.2926 70 T 4.5313 7.4824 116.4358 61.1642 67.8811 172.9613 71 P 4.2050 0.0000 0.0000 63.8647 31.7569 176.7286 72 G 4.0767 8.7510 111.1679 46.3440 0.0000 173.0367 73 A 4.3782 7.0952 121.0691 51.2103 19.8202 177.3723 74 S 4.5839 8.8700 114.3275 56.7241 67.3581 174.6101 75 N 4.8914 8.0255 117.5009 51.9459 37.5375 174.4258 76 A 4.0332 8.5825 125.1660 55.2379 19.1106 178.7566 77 C 4.5559 8.6041 111.0014 57.7408 40.9783 173.1012 78 H 3.9463 7.7030 115.9951 56.9790 26.4023 173.8506 79 L 4.8805 7.4390 116.9393 52.8336 46.2066 176.2584 80 S 4.7707 8.2366 114.6300 57.6233 63.2194 175.8376 81 C 4.1201 8.3745 124.0571 59.0210 38.4633 176.2911 82 S 3.9403 7.9271 115.3206 61.0263 61.7658 175.5604 83 A 4.0470 8.0691 123.1328 54.5460 18.0149 178.5004 84 L 4.4891 7.4577 115.8566 54.8732 41.7140 177.5210 85 L 5.1611 7.6630 117.7200 53.6994 42.2654 176.6988 86 Q 4.3322 7.7653 117.7261 55.5418 29.4080 176.0518 87 D 4.2998 8.4907 119.5516 56.6493 41.1461 176.2902 88 N 4.6420 7.9250 117.6180 52.2978 38.3489 174.9667 89 I 3.9802 8.3512 119.3262 61.6209 37.9456 176.9310 90 A 3.9321 7.8338 123.8425 56.0310 18.0985 179.6168 91 D 4.3191 8.0445 116.2692 57.2641 41.0856 178.6406 92 A 4.0730 7.9371 120.9213 55.2043 18.4111 179.7271 93 V 3.5355 8.2517 117.0055 65.9579 31.4154 178.2071 94 A 3.8941 7.7937 120.2705 55.0212 18.1712 178.7627 95 C 4.2635 8.4537 117.0118 59.5628 37.9550 175.6291 96 A 4.0222 8.1982 122.4132 54.8341 17.5905 179.8551 97 K 3.9749 7.6888 117.0288 59.5840 31.8482 179.4882 98 R 3.9792 7.4256 118.0328 59.2872 29.9587 178.4855 99 V 2.6103 7.5305 118.0711 65.5994 31.2654 177.8726 100 V 3.9952 7.4810 108.0405 62.3359 31.5026 177.1446 101 R 4.4689 7.3606 117.8732 55.3425 30.5587 175.2502 102 D 5.0189 7.0541 119.0384 51.3795 43.5158 175.2756 103 P 4.2076 0.0000 0.0000 66.2668 31.0864 177.7566 104 Q 4.0193 8.1516 117.5042 56.0891 29.9888 177.2801 105 G 3.6725 8.2259 107.4181 45.9625 0.0000 175.9382 106 I 3.5220 7.7550 120.3801 63.2837 37.9268 177.7873 107 R 4.2168 7.2361 117.3724 57.7593 30.0729 177.3620 108 A 3.8975 7.9541 121.5490 54.4676 18.5783 177.7989 109 W 4.6430 8.1245 116.7681 55.6011 29.3090 177.4866 110 V 3.7617 8.7354 124.0072 66.0089 30.8155 177.6191 111 A 4.0246 8.2579 120.0766 54.3155 18.2617 179.2820 112 W 3.9140 8.4328 127.3524 60.6631 29.3615 178.0943 113 R 3.7290 8.3992 117.5045 59.5869 29.3466 178.6523 114 N 4.3930 8.1689 114.8059 55.3793 38.6831 176.7829 115 R 4.1823 7.7844 113.5925 56.0012 30.1949 175.4863 116 C 4.6110 7.8243 116.2739 57.7099 42.7722 174.5669 117 Q 3.3129 6.1013 119.1031 56.5632 28.8673 175.4722 118 N 4.1947 8.6570 123.2559 54.2616 35.9942 174.0659 119 R 4.5179 7.3981 113.6356 54.3236 34.5267 175.1744 120 D 4.5253 8.5482 120.2736 54.1183 40.9314 177.0460 121 V 4.3187 8.2568 120.2264 62.2108 32.1891 177.8550 122 R 3.9830 7.7753 118.5300 59.4164 29.5895 178.0627 123 Q 4.0290 7.9034 115.9022 58.9641 28.5016 177.5334 124 Y 4.5887 7.8607 117.5578 59.5058 38.0550 176.4043 125 V 4.4616 7.6452 112.2068 60.8328 32.7469 174.8272 126 Q 4.1434 8.1262 120.1807 57.0355 28.7649 176.5714 127 G 3.9681 9.0402 111.7083 45.6537 0.0000 174.1518 128 C 4.4742 8.0802 116.5916 56.4219 40.4751 174.1519 129 G 3.8623 7.9355 107.2041 46.6693 0.0000 174.2559 130 V 3.9798 7.1841 114.9529 61.0626 31.7626 176.0470 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 K 8.17 4.15 0.00 2.05 1.59 0.00 1.23 0.00 0.00 0.80 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.90 1.13 7.81 2 V 8.14 4.63 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 0.92 0.00 0.00 0.94 0.00 0.00 3 F 9.85 4.58 0.00 2.85 2.72 0.00 0.00 0.00 0.00 0.00 0.00 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 E 9.26 4.23 0.00 1.92 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 2.33 2.50 0.00 5 R 8.96 3.31 0.00 1.97 1.90 0.00 3.45 0.00 0.00 3.50 7.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.81 0.00 6 C 8.02 4.33 0.00 3.00 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 7 E 8.07 3.89 0.00 2.08 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 0.00 2.69 2.45 0.00 8 L 7.92 3.24 0.00 1.19 1.29 -0.14 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.72 3.91 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 10 R 7.85 3.85 0.00 1.89 1.99 0.00 3.13 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 1.65 1.66 0.00 11 T 7.71 3.86 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 1.22 0.00 0.00 12 L 8.22 3.84 0.00 1.69 1.59 0.96 0.48 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 13 K 8.20 3.90 0.00 1.88 1.93 0.00 1.66 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.15 3.94 0.00 1.98 1.97 0.00 3.20 0.00 0.00 3.22 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.67 0.00 15 L 7.41 4.43 0.00 1.72 1.56 0.85 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 16 G 8.02 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 17 M 7.70 4.05 0.00 1.49 2.02 0.00 0.00 0.00 0.00 0.00 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.25 0.00 18 D 8.00 4.50 0.00 2.67 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 19 G 9.50 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 20 Y 8.12 4.18 0.00 3.34 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 21 R 9.20 3.61 0.00 1.87 1.83 0.00 3.18 0.00 0.00 2.94 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.28 0.00 22 G 8.43 3.86 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 0.00 0.00 0.00 23 I 7.52 4.01 1.63 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 0.88 0.48 -0.24 0.00 0.00 24 S 8.29 4.66 0.00 4.06 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 25 L 8.56 4.16 0.00 2.10 1.81 1.01 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.12 4.16 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 27 N 8.47 4.50 0.00 2.77 2.77 0.00 0.00 6.85 8.02 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 28 W 8.02 4.24 0.00 3.45 2.98 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 29 M 8.57 4.16 0.00 2.09 2.22 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 2.69 2.92 0.00 30 C 8.09 3.42 0.00 3.09 3.32 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 31 L 8.25 3.98 0.00 1.78 1.84 0.63 -0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.37 4.25 1.58 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 0.00 0.00 33 K 7.97 2.82 0.00 1.46 1.63 0.00 0.68 0.00 0.00 1.13 0.00 0.00 2.71 0.00 0.00 2.71 0.00 0.00 0.00 0.00 0.84 0.21 7.81 34 W 7.64 4.23 0.00 3.44 3.27 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 35 E 8.50 4.34 0.00 2.02 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 2.56 2.69 0.00 36 S 8.11 4.55 0.00 4.06 4.17 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 37 G 8.26 3.08 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 0.00 38 Y 7.83 3.74 0.00 3.25 3.06 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 0.00 0.00 0.00 39 N 7.68 5.30 0.00 2.83 2.88 0.00 0.00 6.98 7.10 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 40 T 9.07 4.17 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 1.42 0.00 0.00 41 R 8.08 4.85 0.00 1.83 2.04 0.00 3.12 0.00 0.00 3.24 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.81 0.00 42 A 7.78 4.44 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 43 T 8.31 5.13 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 1.16 0.00 0.00 44 N 8.89 4.85 0.00 2.91 2.83 0.00 0.00 6.83 7.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 8.74 4.72 0.00 2.97 2.87 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 0.00 0.00 0.00 46 N 8.64 4.70 0.00 2.42 2.61 0.00 0.00 6.49 7.56 0.00 0.00 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 A 8.33 3.53 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 48 G 7.79 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 49 D 7.80 4.72 0.00 2.73 2.71 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 50 R 7.91 3.82 0.00 2.04 2.13 0.00 3.37 0.00 0.00 3.40 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.59 0.00 51 S 7.42 4.92 0.00 3.83 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 52 T 9.26 5.14 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 0.61 0.00 0.00 53 D 9.10 5.43 0.00 2.77 2.88 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 54 Y 9.35 4.97 0.00 2.87 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 55 G 8.83 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 0.00 0.00 0.00 0.00 56 I 8.23 4.06 1.71 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 1.06 1.73 0.12 0.00 0.00 57 F 7.85 4.84 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 58 Q 7.89 3.74 0.00 2.61 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.84 0.00 0.00 0.00 0.00 0.00 2.54 2.74 0.00 59 I 8.04 4.34 2.14 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.93 1.16 0.00 0.00 60 N 9.22 5.38 0.00 3.12 3.07 0.00 0.00 6.96 7.15 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 61 S 9.46 4.27 0.00 4.05 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 0.00 62 R 8.59 3.75 0.00 1.56 1.39 0.00 2.50 0.00 0.00 2.81 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 63 Y 7.43 4.11 0.00 1.74 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 0.00 0.00 0.00 64 W 7.96 4.64 0.00 3.59 3.34 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 0.00 0.00 0.00 0.00 65 C 7.86 6.18 0.00 3.12 3.06 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 0.00 0.00 0.00 66 N 8.83 4.90 0.00 2.76 2.67 0.00 0.00 7.14 8.05 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 67 D 8.54 4.75 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 68 G 8.58 4.06 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 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.99 4.38 0.00 1.91 1.93 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.74 7.81 70 T 7.48 4.53 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 1.18 0.00 0.00 71 P 0.00 4.20 0.00 2.16 1.97 0.00 3.74 0.00 0.00 3.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.10 0.00 72 G 8.75 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 0.00 0.00 0.00 73 A 7.10 4.38 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 74 S 8.87 4.58 0.00 3.53 3.58 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 75 N 8.03 4.89 0.00 2.71 2.50 0.00 0.00 6.76 8.73 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 76 A 8.58 4.03 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 77 C 8.60 4.56 0.00 3.27 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 78 H 7.70 3.95 0.00 3.33 3.39 0.00 5.79 0.00 0.00 0.00 0.00 7.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.44 4.88 0.00 1.67 1.50 0.96 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.24 4.77 0.00 3.82 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 81 C 8.37 4.12 0.00 2.30 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 82 S 7.93 3.94 0.00 3.91 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 83 A 8.07 4.05 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 84 L 7.46 4.49 0.00 1.86 1.80 1.00 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.66 5.16 0.00 1.78 1.71 1.13 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.77 4.33 0.00 2.18 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.47 7.12 0.00 0.00 0.00 0.00 0.00 2.37 2.52 0.00 87 D 8.49 4.30 0.00 2.61 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 88 N 7.92 4.64 0.00 2.68 2.76 0.00 0.00 7.01 7.94 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 89 I 8.35 3.98 1.75 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.98 0.97 0.00 0.00 90 A 7.83 3.93 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 91 D 8.04 4.32 0.00 2.74 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 92 A 7.94 4.07 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 93 V 8.25 3.54 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 0.72 0.00 0.00 0.87 0.00 0.00 94 A 7.79 3.89 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 95 C 8.45 4.26 0.00 3.08 3.29 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 96 A 8.20 4.02 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 97 K 7.69 3.97 0.00 1.73 1.46 0.00 1.19 0.00 0.00 0.61 0.00 0.00 2.17 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.30 1.05 7.81 98 R 7.43 3.98 0.00 1.84 2.21 0.00 3.48 0.00 0.00 3.29 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 2.04 0.00 99 V 7.53 2.61 1.90 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 -0.41 0.00 0.00 -0.37 0.00 0.00 100 V 7.48 4.00 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 1.11 0.00 0.00 1.41 0.00 0.00 101 R 7.36 4.47 0.00 2.04 2.01 0.00 3.22 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 2.00 0.00 102 D 7.05 5.02 0.00 3.07 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.21 0.00 2.19 2.20 0.00 3.84 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 1.99 2.03 0.00 104 Q 8.15 4.02 0.00 2.08 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.82 0.00 0.00 0.00 0.00 0.00 2.43 2.32 0.00 105 G 8.23 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 0.00 106 I 7.76 3.52 0.97 0.00 0.00 -0.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.13 -0.49 0.00 0.00 107 R 7.24 4.22 0.00 2.03 2.02 0.00 3.22 0.00 0.00 3.27 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.50 0.00 108 A 7.95 3.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.12 4.64 0.00 3.55 3.13 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 0.00 110 V 8.74 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 1.17 0.00 0.00 1.00 0.00 0.00 111 A 8.26 4.02 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 0.00 112 W 8.43 3.91 0.00 3.50 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 0.00 113 R 8.40 3.73 0.00 2.19 2.00 0.00 3.47 0.00 0.00 3.56 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 2.11 0.00 114 N 8.17 4.39 0.00 2.52 2.70 0.00 0.00 6.95 8.24 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 0.00 115 R 7.78 4.18 0.00 0.97 1.07 0.00 2.73 0.00 0.00 2.87 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.50 0.00 116 C 7.82 4.61 0.00 1.73 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 0.00 117 Q 6.10 3.31 0.00 0.93 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 6.82 0.00 0.00 0.00 0.00 0.00 2.19 2.23 0.00 118 N 8.66 4.19 0.00 2.77 2.80 0.00 0.00 6.89 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 0.00 119 R 7.40 4.52 0.00 1.77 1.71 0.00 3.24 0.00 0.00 3.04 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.41 0.00 120 D 8.55 4.53 0.00 2.59 2.56 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.26 4.32 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 0.99 0.00 0.00 1.05 0.00 0.00 122 R 7.78 3.98 0.00 2.09 1.94 0.00 3.10 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 123 Q 7.90 4.03 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.88 0.00 0.00 0.00 0.00 0.00 2.09 1.48 0.00 124 Y 7.86 4.59 0.00 3.19 3.08 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 0.00 125 V 7.65 4.46 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 0.88 0.00 0.00 1.05 0.00 0.00 126 Q 8.13 4.14 0.00 2.04 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.62 0.00 0.00 0.00 0.00 0.00 2.50 2.29 0.00 127 G 9.04 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 0.00 128 C 8.08 4.47 0.00 3.00 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 0.00 129 G 7.94 3.86 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 0.00 0.00 0.00 130 V 7.18 3.98 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 0.75 0.00 0.00 0.96 0.00 0.00