NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 6 S 4.4082 8.3344 115.2933 58.2836 63.0014 174.2544 7 V 3.6872 9.0815 121.7372 63.5651 32.6525 173.0871 8 L 4.6904 7.4019 119.1328 52.9212 44.4770 176.5749 9 S 4.5699 8.3167 117.4570 57.5971 65.5098 175.1270 10 G 3.6383 8.5448 107.2672 48.3141 0.0000 175.6766 11 K 4.1976 7.9482 122.1363 58.4781 32.2698 178.9351 12 K 4.0042 7.7335 117.8029 59.0949 32.0824 179.1187 13 A 4.0622 8.2751 121.3473 55.0450 18.0185 179.4673 14 D 4.3329 7.7456 116.5686 57.5500 41.2957 178.4639 15 E 4.0892 8.0517 118.7876 59.0354 29.4048 178.9931 16 L 3.8950 7.8782 120.4524 58.3320 42.0460 178.8040 17 E 4.6839 7.8455 116.8129 57.6288 29.4438 178.2611 18 K 4.3971 7.6629 117.1084 55.6620 33.0653 176.0487 19 I 4.5322 7.4807 122.0040 60.1618 38.8735 175.6385 20 R 4.5484 8.8205 126.3875 55.9634 30.8219 177.8167 21 L 3.8490 8.6122 123.1317 57.2680 41.6234 177.9945 22 R 4.7062 7.6985 115.5614 53.3903 34.1366 174.0342 23 P 4.0794 0.0000 0.0000 65.8475 31.5586 178.4783 24 G 3.5639 8.1053 105.7628 48.3670 0.0000 174.1875 25 G 3.9099 6.9834 104.9727 45.4156 0.0000 172.7865 26 K 4.4617 8.2014 115.8697 56.1842 34.1328 177.3692 27 K 4.2149 7.8629 119.2726 56.3126 33.0819 176.2697 28 K 5.1551 8.3349 122.3523 54.2203 36.0955 175.3137 29 Y 4.0877 8.9367 119.1728 58.6580 39.1426 175.7004 30 M 5.3123 8.7974 120.7853 52.6382 36.7053 176.3051 31 L 4.1143 8.5353 119.0143 57.9319 41.5867 179.8251 32 K 4.0272 8.1300 118.3041 60.3370 32.2821 178.7184 33 H 4.4366 8.1984 117.5699 58.5654 28.5898 177.8508 34 V 3.7770 7.8026 119.8770 65.8178 31.5106 178.1643 35 V 3.6094 8.0361 118.1073 65.7892 31.3985 177.8138 36 W 4.1025 8.4930 127.9376 60.3801 30.5292 177.7964 37 A 3.9211 8.6104 120.5962 55.0516 17.7475 179.3860 38 A 3.9348 8.2407 119.4238 55.5513 18.1861 179.7056 39 N 4.1819 8.1595 114.9118 56.2529 38.0363 177.3493 40 E 3.4573 7.7396 120.8517 58.7072 29.4381 178.8529 41 L 4.0897 7.7778 119.3750 57.5401 41.6780 178.6437 42 D 4.2597 7.6683 118.1791 57.6140 40.9299 178.2222 43 R 3.8468 7.0750 117.1552 59.0421 29.8098 177.2879 44 F 5.0639 7.1781 113.7650 56.7853 39.2602 176.5473 45 G 3.9385 8.3174 106.0252 45.9738 0.0000 173.9632 46 L 4.5845 7.9273 118.8626 52.5543 43.6809 176.2348 47 A 4.2368 8.3069 125.0389 51.7526 19.1557 178.7498 48 E 4.1373 8.8053 122.0678 58.9017 29.8511 179.3699 49 S 4.3607 8.0645 114.9653 61.0341 63.0745 176.0488 50 L 4.1152 7.8436 122.2298 57.2482 39.7128 178.7032 51 L 4.2851 7.9668 118.4098 56.5541 41.3794 178.6289 52 E 4.1770 7.9570 118.5195 57.7318 29.7844 175.8072 53 N 4.3739 7.1061 114.1943 49.9140 40.8122 175.2026 54 K 3.7332 8.5095 119.0788 59.8186 31.9839 178.4553 55 E 4.1411 8.1397 118.3236 59.3468 29.5018 179.3561 56 G 4.1807 8.6319 107.4601 47.6472 0.0000 175.5712 57 C 4.2843 8.3131 119.3048 62.5444 28.1540 175.9890 58 Q 3.9726 8.4582 121.2958 59.0606 28.6074 178.4508 59 K 4.0135 8.2772 119.5812 59.4275 32.0833 179.3581 60 I 3.7237 7.8223 120.0133 64.5179 37.0801 178.4474 61 L 4.0806 8.2050 120.2415 57.8919 41.1716 179.8404 62 S 4.2918 7.9847 113.3962 61.3917 63.0799 176.6109 63 V 3.8198 7.5234 114.8329 63.7575 31.7713 178.1032 64 L 4.1389 8.2278 118.7177 57.2031 41.7241 178.8619 65 A 3.7409 8.5453 121.5810 54.7571 18.0931 177.9783 66 P 4.2048 0.0000 0.0000 65.5652 31.7998 177.8513 67 L 4.1690 7.6884 117.2401 55.7814 41.6677 179.0159 68 V 3.4944 7.2553 119.0028 65.5844 31.2430 175.9302 69 P 4.2445 0.0000 0.0000 65.1018 31.2586 177.0312 70 T 4.5348 7.3380 104.8058 60.9961 68.9564 174.3290 71 G 3.7749 8.0610 111.4784 45.3191 0.0000 175.0010 72 S 4.4279 8.3552 116.9006 57.7901 65.2006 175.2913 73 E 4.0400 8.7252 121.6202 59.7243 29.1591 179.4417 74 N 4.6835 8.2828 116.2062 56.0812 38.6172 177.1201 75 L 4.1229 8.1057 121.5573 58.3310 42.3212 179.2228 76 K 4.0716 8.3167 118.4515 59.6493 31.9407 179.6038 77 S 4.2995 8.6294 115.7557 61.2832 62.7216 176.4978 78 L 4.3833 8.4519 123.2620 58.4427 41.9443 178.2432 79 Y 4.0956 8.4598 119.7209 60.9465 38.8440 177.9412 80 N 4.3975 8.5638 117.2623 56.7296 38.6775 177.6079 81 T 3.9930 8.2081 117.1816 66.6771 68.5293 177.0375 82 V 3.6586 8.0542 120.2135 65.9785 31.4824 177.8758 83 C 3.9949 7.8577 116.7255 62.6357 27.9463 176.1915 84 V 3.4886 7.5553 119.3873 66.1765 31.1065 178.2438 85 I 3.6703 7.8212 119.5081 63.8050 36.7734 178.2875 86 W 4.0494 8.6409 129.8328 60.7139 30.5482 177.7979 87 C 4.0619 8.5209 116.7000 62.9116 27.4152 176.2126 88 I 3.6108 7.6165 121.3149 64.7417 36.4380 178.2732 89 H 4.1897 7.8158 115.7225 58.2505 28.6229 176.8536 90 A 3.8327 7.4371 120.0367 51.2001 18.6131 176.7685 91 E 3.5795 7.3485 115.5997 57.1975 27.5501 174.3683 92 E 4.3697 8.1719 118.8299 54.5081 30.4723 176.3406 93 K 4.1418 8.5751 126.0400 56.1510 32.7286 176.3033 94 V 4.5241 8.0249 118.7335 59.4815 35.4981 175.4751 95 K 4.1569 9.0576 124.2634 58.8049 32.6296 175.8973 96 H 5.6558 7.1747 111.3423 54.4273 31.1617 173.7132 97 T 3.9716 8.6940 112.3743 65.3194 66.9723 175.9280 98 E 4.0776 8.3971 120.4897 59.2990 29.5358 178.6416 99 E 4.0152 8.3418 118.7991 58.8907 29.7679 178.5185 100 A 4.0325 7.7374 121.2317 55.1792 18.4769 179.7802 101 K 3.9707 8.2329 116.9774 59.7256 32.1088 179.6827 102 Q 4.0693 8.1402 118.4445 58.8676 28.6063 178.6600 103 I 3.9093 8.0598 121.0668 64.0455 37.1300 178.5758 104 V 2.8920 7.8541 119.3925 65.6320 31.2813 177.9255 105 Q 3.8816 7.9894 119.4055 59.0407 28.6975 178.0076 106 R 3.8098 7.7783 118.5805 59.8422 30.2017 177.7083 107 H 4.5399 8.0247 114.0673 57.0705 29.0488 176.0835 108 L 4.4938 8.3172 119.1120 54.0208 43.7100 175.6156 109 V 4.5607 7.4725 118.9580 61.0764 32.6774 175.2725 110 V 4.0353 8.9442 129.3466 62.1581 32.9833 174.4041 111 E 4.8906 8.8192 127.8347 55.0131 30.4913 176.6475 112 T 4.4340 8.5398 118.1411 59.6216 68.8133 175.6847 113 G 3.9415 7.7015 121.5572 47.7791 0.0000 174.1540 114 T 4.2532 8.2899 117.2890 61.1211 67.5539 175.2734 115 A 4.2462 7.2694 122.1779 51.4447 22.2786 175.1581 116 E 4.9794 8.8380 123.4844 55.0941 31.3359 175.4809 117 T 4.5793 8.9491 119.9384 60.2560 70.8556 172.4489 118 M 5.0738 8.3521 127.2705 52.1157 33.7566 173.7456 119 P 4.4249 0.0000 0.0000 62.9920 31.5057 176.5466 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 S 8.33 4.41 0.00 3.87 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 7 V 9.08 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 0.88 0.00 0.00 0.95 0.00 0.00 8 L 7.40 4.69 0.00 1.66 1.54 0.90 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 9 S 8.32 4.57 0.00 4.04 4.03 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 10 G 8.54 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 11 K 7.95 4.20 0.00 1.82 1.80 0.00 1.69 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.51 7.81 12 K 7.73 4.00 0.00 1.98 1.77 0.00 1.72 0.00 0.00 1.59 0.00 0.00 2.92 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.41 7.81 13 A 8.28 4.06 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 14 D 7.75 4.33 0.00 2.81 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 15 E 8.05 4.09 0.00 2.08 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 2.59 2.42 0.00 16 L 7.88 3.89 0.00 1.88 1.89 1.06 0.97 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 17 E 7.85 4.68 0.00 2.18 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 2.51 2.36 0.00 18 K 7.66 4.40 0.00 1.89 1.86 0.00 1.69 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.72 7.81 19 I 7.48 4.53 2.07 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 1.41 0.86 0.97 0.00 0.00 20 R 8.82 4.55 0.00 1.87 2.01 0.00 3.18 0.00 0.00 3.26 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.65 0.00 21 L 8.61 3.85 0.00 1.35 1.46 0.70 -0.55 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 22 R 7.70 4.71 0.00 1.76 1.71 0.00 3.10 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.55 0.00 23 P 0.00 4.08 0.00 1.94 1.93 0.00 3.61 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.71 0.00 24 G 8.11 3.56 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 0.00 0.00 0.00 25 G 6.98 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 26 K 8.20 4.46 0.00 1.72 1.83 0.00 1.75 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.34 1.41 7.81 27 K 7.86 4.21 0.00 1.64 1.65 0.00 1.54 0.00 0.00 1.76 0.00 0.00 2.81 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.49 1.44 7.81 28 K 8.33 5.16 0.00 1.62 1.92 0.00 1.77 0.00 0.00 1.97 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.64 7.81 29 Y 8.94 4.09 0.00 3.19 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 30 M 8.80 5.31 0.00 2.00 1.92 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 2.58 2.70 0.00 31 L 8.54 4.11 0.00 1.76 1.76 0.96 0.71 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 32 K 8.13 4.03 0.00 1.95 2.06 0.00 1.37 0.00 0.00 1.74 0.00 0.00 2.81 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.38 1.22 7.81 33 H 8.20 4.44 0.00 3.68 3.64 0.00 5.81 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 34 V 7.80 3.78 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 1.16 0.00 0.00 1.02 0.00 0.00 35 V 8.04 3.61 2.17 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 0.98 0.00 0.00 1.01 0.00 0.00 36 W 8.49 4.10 0.00 3.56 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 37 A 8.61 3.92 1.60 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 0.00 0.00 0.00 0.00 0.00 0.00 38 A 8.24 3.93 1.41 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 0.00 0.00 0.00 0.00 0.00 0.00 39 N 8.16 4.18 0.00 2.68 2.70 0.00 0.00 6.70 7.12 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 40 E 7.74 3.46 0.00 1.16 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 2.09 0.00 41 L 7.78 4.09 0.00 1.91 1.87 0.94 0.91 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 42 D 7.67 4.26 0.00 2.62 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 43 R 7.07 3.85 0.00 1.48 1.58 0.00 2.72 0.00 0.00 2.25 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.38 0.00 44 F 7.18 5.06 0.00 3.09 2.93 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 45 G 8.32 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 46 L 7.93 4.58 0.00 1.82 1.63 0.99 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 47 A 8.31 4.24 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 48 E 8.81 4.14 0.00 2.21 2.21 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 2.35 2.36 0.00 49 S 8.06 4.36 0.00 4.07 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 50 L 7.84 4.12 0.00 1.86 1.90 0.94 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.97 4.29 0.00 1.84 1.76 0.97 0.94 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 52 E 7.96 4.18 0.00 2.05 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 2.35 2.37 0.00 53 N 7.11 4.37 0.00 2.79 2.75 0.00 0.00 6.41 6.82 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 54 K 8.51 3.73 0.00 1.60 1.74 0.00 1.20 0.00 0.00 1.44 0.00 0.00 2.86 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 0.71 7.81 55 E 8.14 4.14 0.00 2.23 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 0.00 2.41 2.46 0.00 56 G 8.63 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 57 C 8.31 4.28 0.00 3.39 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 58 Q 8.46 3.97 0.00 2.49 2.36 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 2.38 2.40 0.00 59 K 8.28 4.01 0.00 2.06 1.87 0.00 1.75 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.48 1.72 7.81 60 I 7.82 3.72 2.05 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.89 0.96 0.00 0.00 61 L 8.20 4.08 0.00 1.95 1.68 0.53 0.86 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 62 S 7.98 4.29 0.00 4.04 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 63 V 7.52 3.82 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 0.85 0.00 0.00 1.02 0.00 0.00 64 L 8.23 4.14 0.00 2.07 1.94 0.86 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 65 A 8.55 3.74 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 66 P 0.00 4.20 0.00 2.19 2.16 0.00 3.76 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 2.04 2.02 0.00 67 L 7.69 4.17 0.00 1.70 1.61 0.73 0.49 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 68 V 7.26 3.49 1.83 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 0.83 0.00 0.00 0.24 0.00 0.00 69 P 0.00 4.24 0.00 2.02 2.07 0.00 3.69 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 1.96 2.00 0.00 70 T 7.34 4.53 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 1.18 0.00 0.00 71 G 8.06 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 0.00 0.00 0.00 72 S 8.36 4.43 0.00 4.14 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 0.00 73 E 8.73 4.04 0.00 2.06 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 2.43 2.37 0.00 74 N 8.28 4.68 0.00 2.98 3.29 0.00 0.00 6.79 6.74 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 75 L 8.11 4.12 0.00 1.81 1.94 0.86 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 76 K 8.32 4.07 0.00 2.04 1.92 0.00 1.79 0.00 0.00 1.84 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.49 7.81 77 S 8.63 4.30 0.00 4.26 3.84 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 78 L 8.45 4.38 0.00 2.11 2.12 1.05 1.07 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 79 Y 8.46 4.10 0.00 3.07 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 80 N 8.56 4.40 0.00 3.09 2.99 0.00 0.00 7.08 6.34 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 81 T 8.21 3.99 4.63 0.00 0.00 0.00 0.00 0.00 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 82 V 8.05 3.66 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 1.10 0.00 0.00 1.07 0.00 0.00 83 C 7.86 3.99 0.00 3.14 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 84 V 7.56 3.49 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 0.42 0.00 0.00 0.71 0.00 0.00 85 I 7.82 3.67 1.90 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.86 0.90 0.00 0.00 86 W 8.64 4.05 0.00 3.42 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 87 C 8.52 4.06 0.00 3.25 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 88 I 7.62 3.61 1.84 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.77 0.00 0.00 89 H 7.82 4.19 0.00 3.01 3.13 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 7.44 3.83 0.16 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 0.00 0.00 91 E 7.35 3.58 0.00 1.98 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 2.16 2.15 0.00 92 E 8.17 4.37 0.00 2.02 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 2.28 2.44 0.00 93 K 8.58 4.14 0.00 1.68 1.72 0.00 1.59 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.41 1.51 7.81 94 V 8.02 4.52 2.07 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 0.82 0.00 0.00 0.91 0.00 0.00 95 K 9.06 4.16 0.00 1.79 1.66 0.00 1.68 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.43 1.38 7.81 96 H 7.17 5.66 0.00 3.41 3.44 0.00 5.68 0.00 0.00 0.00 0.00 6.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 T 8.69 3.97 4.45 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 98 E 8.40 4.08 0.00 2.12 2.05 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 2.41 2.32 0.00 99 E 8.34 4.02 0.00 1.90 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 0.00 2.38 2.37 0.00 100 A 7.74 4.03 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 0.00 101 K 8.23 3.97 0.00 2.06 1.97 0.00 1.99 0.00 0.00 1.86 0.00 0.00 3.05 0.00 0.00 3.24 0.00 0.00 0.00 0.00 1.61 1.70 7.81 102 Q 8.14 4.07 0.00 2.30 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.53 0.00 103 I 8.06 3.91 2.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.79 1.27 0.00 0.00 104 V 7.85 2.89 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 0.74 0.00 0.00 0.42 0.00 0.00 105 Q 7.99 3.88 0.00 2.37 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.56 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 106 R 7.78 3.81 0.00 1.83 2.10 0.00 3.28 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.60 0.00 107 H 8.02 4.54 0.00 3.13 3.47 0.00 5.65 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 L 8.32 4.49 0.00 1.50 1.51 0.09 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 109 V 7.47 4.56 2.17 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 0.77 0.00 0.00 0.90 0.00 0.00 110 V 8.94 4.04 2.07 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 0.97 0.00 0.00 0.92 0.00 0.00 111 E 8.82 4.89 0.00 1.86 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 2.21 2.26 0.00 112 T 8.54 4.43 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 1.20 0.00 0.00 113 G 7.70 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 0.00 114 T 8.29 4.25 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 1.20 0.00 0.00 115 A 7.27 4.25 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 0.00 116 E 8.84 4.98 0.00 1.81 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 2.27 2.25 0.00 117 T 8.95 4.58 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 1.26 0.00 0.00 118 M 8.35 5.07 0.00 2.03 1.94 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.33 0.00 119 P 0.00 4.42 0.00 2.08 1.97 0.00 3.90 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.08 0.00