NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.8819 8.2893 118.3417 55.6085 33.0335 173.5722 2 K 4.4806 8.5765 117.7628 55.1191 36.6252 172.6975 3 K 4.8151 8.6697 121.2177 54.5009 35.0724 175.7228 4 E 4.6195 8.6729 126.7360 54.2645 32.8636 174.3114 5 F 5.0575 8.7301 124.6262 55.9471 41.6037 174.6661 6 S 5.3162 9.0784 118.8843 56.9374 67.6544 172.9055 7 A 4.9525 8.8614 121.9205 51.2857 23.0926 176.1871 8 G 4.3814 8.7774 106.2596 46.1222 0.0000 171.7659 9 G 4.6591 8.6418 105.4808 45.2279 0.0000 173.5811 10 V 3.9940 8.6680 121.2722 60.8506 32.8602 173.4798 11 L 4.9843 8.1486 130.0085 53.4632 44.0015 174.6889 12 F 5.4983 9.1609 124.9866 55.9077 42.1420 175.0608 13 K 4.4103 9.5574 124.3151 54.7565 34.2273 174.6151 14 D 4.3861 9.6324 127.8420 55.2552 38.0009 174.8564 15 G 4.0259 8.0242 105.5841 45.4677 0.0000 170.7575 16 E 5.4836 7.9117 119.1057 54.4054 33.0719 175.3404 17 V 4.9351 9.0096 122.0689 59.7987 34.7252 174.2810 18 L 4.1539 8.5588 125.6389 54.5662 42.6501 175.8305 19 L 5.1833 8.6487 125.3072 52.9489 46.3948 175.3473 20 I 5.2043 9.0731 113.5606 59.2817 41.7497 173.8873 21 K 4.3187 8.3865 125.1967 54.4168 33.9936 176.1848 22 T 4.3059 8.6823 118.2700 60.2495 69.7072 173.6538 23 P 4.3330 0.0000 0.0000 65.9092 31.3107 177.6202 24 S 4.4072 7.5464 110.7478 58.2935 62.4565 173.7105 25 N 4.0388 8.2693 116.7404 54.2751 36.3107 173.8121 26 V 4.2380 7.2751 117.3215 60.7713 34.1519 174.2181 27 W 4.7758 8.5851 127.8644 56.4962 30.0636 175.4835 28 S 4.1747 9.0829 118.9092 57.3253 65.7921 172.4269 29 F 5.1448 8.3242 118.4566 55.8806 40.2642 174.3859 30 P 5.1680 0.0000 0.0000 62.7336 32.2741 175.2855 31 K 4.9967 8.5653 121.2217 56.5525 35.8040 174.1162 32 G 4.3920 8.2972 105.8554 46.1475 0.0000 172.7687 33 N 5.1991 8.7135 117.7696 52.8141 39.2354 175.4186 34 I 3.9493 8.5944 122.8464 61.3295 39.0519 175.0315 35 E 4.7390 8.9444 125.8870 53.4087 32.0056 174.0652 36 P 4.2739 0.0000 0.0000 64.6050 31.5290 177.1797 37 G 3.9211 8.9127 111.1312 45.3675 0.0000 173.0814 38 E 4.4511 7.6954 119.0766 55.7052 30.5667 177.1628 39 K 4.3801 9.6598 123.0208 54.6588 34.7373 176.4780 40 P 4.2940 0.0000 0.0000 66.4657 30.8805 178.5247 41 E 3.1420 7.8888 117.5882 58.8457 29.4308 179.0519 42 E 3.8905 7.8979 118.1810 59.6121 29.5657 179.2510 43 T 3.9490 7.8747 115.5641 66.4713 68.6209 176.3185 44 A 4.1861 8.1446 122.8517 55.3339 18.4624 179.8363 45 V 3.5394 7.4792 116.1523 66.1219 31.6520 178.1249 46 R 3.9950 7.8495 118.0407 59.7358 29.9856 178.3979 47 E 4.0446 8.5312 118.5646 59.2320 29.3674 179.5448 48 V 3.6428 7.8589 118.2583 65.7044 31.6169 177.9485 49 W 4.7602 8.0819 129.0056 60.2106 30.3707 177.9025 50 E 3.6011 8.2804 117.5075 59.0052 29.2044 178.4505 51 E 4.0507 8.4253 119.6025 57.7981 29.8416 177.5455 52 T 4.3213 7.9798 106.7342 60.1800 70.3090 175.5464 53 G 3.4788 8.3579 110.2337 45.3836 0.0000 173.0514 54 V 4.6697 7.5462 120.0676 61.0241 33.8901 174.3106 55 K 4.8823 9.1561 129.5548 55.1049 33.7517 175.4066 56 G 4.6198 8.7422 113.1960 44.3721 0.0000 170.9098 57 E 4.8151 8.8454 120.4278 54.0312 32.2176 174.9449 58 I 4.3962 8.4674 128.0772 61.6023 37.1869 175.5475 59 L 4.5092 9.0483 128.0648 56.1215 43.4059 175.9319 60 D 4.5419 7.4644 115.6639 53.8190 44.7058 174.0095 61 Y 4.6108 8.8834 123.3678 57.4247 39.1233 174.6303 62 I 3.7629 7.9256 128.6298 61.5999 38.0559 176.4662 63 G 3.5050 5.8478 106.8442 45.4719 0.0000 170.5000 64 E 5.3336 8.6363 119.0282 54.4310 32.7644 175.3459 65 I 4.9413 8.6458 118.8986 59.5625 41.2959 173.7372 66 H 5.0886 8.0828 117.3644 54.6609 31.6850 171.6731 67 Y 4.8285 7.4812 114.9284 56.5231 41.2817 172.9942 68 W 5.4565 9.2323 120.7587 56.3861 31.2623 174.9725 69 Y 4.9884 8.6205 118.4452 56.9713 41.1299 172.9892 70 T 5.0425 8.8225 116.6823 61.8809 71.4707 174.2897 71 L 4.4622 8.3669 126.4794 54.2825 43.9799 175.8365 72 K 3.6750 9.6372 128.1532 57.5081 30.2212 176.5367 73 G 3.9767 8.7160 105.7858 44.5246 0.0000 173.5349 74 E 4.6155 7.6136 120.9765 54.1372 31.7679 174.7190 75 R 4.7259 8.4328 124.6498 56.1130 31.7719 175.2277 76 I 4.8245 9.0464 124.9281 59.3455 40.4106 174.2206 77 F 3.7804 8.4731 129.9868 56.2841 40.5561 174.0924 78 K 4.5628 7.7994 128.5284 54.4270 34.6230 174.7575 79 T 4.6104 7.8778 116.6200 59.6150 71.9294 172.8223 80 V 4.5490 8.5993 124.8993 60.9675 34.5596 174.0781 81 K 4.8921 8.7445 127.6401 55.4086 34.0361 175.1622 82 Y 5.1360 8.8996 122.2127 56.4125 40.9960 174.3856 83 Y 5.0738 8.6382 119.7698 55.8790 42.2934 174.5620 84 L 4.6128 9.1879 125.9357 55.3661 43.3694 175.6714 85 M 6.1500 9.6407 125.2781 52.4682 36.7506 174.3575 86 K 5.2272 8.3878 118.5062 54.9033 36.1854 174.8311 87 Y 4.4619 9.0913 124.6148 59.1181 39.3493 175.2365 88 K 4.3119 7.6600 123.4434 56.4570 34.4606 175.9762 89 E 4.2542 6.7206 114.3120 56.9557 32.6510 174.6975 90 G 4.5015 9.7077 105.8717 45.1287 0.0000 172.1487 91 E 5.0182 8.2050 116.7628 53.3044 33.3252 174.0539 92 P 4.3666 0.0000 0.0000 63.7446 31.8061 176.4004 93 R 4.5444 9.0944 124.8446 53.2866 32.9400 173.4129 94 P 4.5201 0.0000 0.0000 62.8223 31.8904 176.9257 95 S 4.3947 8.3307 118.0430 57.1998 64.0488 174.5636 96 W 4.3874 8.3117 116.0315 58.2005 28.0303 176.7497 97 E 3.7870 6.9520 118.0354 57.1926 29.3003 176.8289 98 V 4.4028 6.8766 111.5245 58.9323 34.8791 176.0385 99 K 4.0982 8.7639 123.3282 59.5803 32.5401 176.5261 100 D 4.5083 7.4062 116.2459 53.5825 44.7412 174.6988 101 A 5.1470 8.4941 123.6473 50.5452 21.7289 175.3686 102 K 4.4112 9.0387 122.8280 55.1541 36.2887 175.1344 103 F 4.7573 8.3233 124.0225 57.2961 40.0171 175.0508 104 F 5.0535 9.1398 120.5509 54.8947 43.3100 172.9113 105 P 4.8245 0.0000 0.0000 62.5928 32.2160 177.2291 106 I 4.0474 8.6695 123.7490 64.9317 36.8592 178.4536 107 K 3.9217 8.1243 118.3668 59.6768 32.0733 177.9301 108 E 3.9614 8.0966 118.7521 59.0259 29.5414 178.3304 109 A 3.6982 8.2918 121.1288 54.9782 18.1954 179.4137 110 K 3.9560 7.8940 115.8784 60.0371 32.2597 179.2438 111 K 4.0967 7.7898 116.7647 59.2014 32.1954 178.9356 112 L 3.8652 7.0482 117.1583 56.5368 41.8480 178.2558 113 L 3.8476 6.8354 118.1092 55.0754 41.6573 175.7343 114 K 4.1785 7.7117 119.9960 57.8129 34.6583 176.5952 115 Y 4.2601 6.8676 114.2707 58.6494 39.0463 177.7718 116 K 4.0836 9.1292 124.5683 59.4874 32.1388 179.5067 117 G 3.6860 8.1659 105.5380 48.0636 0.0000 175.3818 118 D 4.5321 8.2119 121.3732 56.9719 40.9001 178.9147 119 K 4.1515 8.2142 119.0923 59.4256 31.9420 179.3421 120 E 4.0355 8.5105 119.0647 59.3893 29.4134 179.3754 121 I 3.6439 7.8284 119.8958 64.3019 37.1039 178.2253 122 F 4.4178 8.6949 121.7842 61.2788 39.3871 176.5542 123 E 3.7952 8.4276 118.8794 59.3234 29.4617 178.7998 124 K 3.8487 8.2122 118.1769 59.4782 32.0933 178.9003 125 A 3.9751 8.4282 121.0927 55.3547 18.0567 179.6042 126 L 3.6814 7.7950 116.2486 57.7480 42.0128 179.6423 127 K 4.4821 7.6932 119.1901 59.1096 31.7970 179.4524 128 L 4.1308 8.0144 119.1190 57.6125 41.5020 179.3384 129 K 3.8578 8.2825 120.0753 59.6807 31.4132 178.2582 130 E 3.9290 7.9749 118.6635 59.1935 29.2315 179.2173 131 K 3.9111 7.6062 118.8640 59.9069 32.4506 178.1105 132 F 4.4175 7.9580 116.2869 58.1804 39.5370 175.8516 133 K 4.2249 8.0607 122.0069 56.5211 32.9158 175.8311 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 M 8.29 4.88 0.00 2.15 2.47 0.00 0.00 0.00 0.00 0.00 -0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.61 0.00 2 K 8.58 4.48 0.00 1.79 1.92 0.00 1.26 0.00 0.00 1.61 0.00 0.00 2.80 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.30 1.40 7.81 3 K 8.67 4.82 0.00 1.66 1.57 0.00 1.64 0.00 0.00 1.39 0.00 0.00 2.13 0.00 0.00 2.89 0.00 0.00 0.00 0.00 0.46 1.25 7.81 4 E 8.67 4.62 0.00 1.88 1.51 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 2.12 2.23 0.00 5 F 8.73 5.06 0.00 2.96 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 6 S 9.08 5.32 0.00 3.59 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 7 A 8.86 4.95 1.32 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 0.00 0.00 8 G 8.78 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 0.00 0.00 0.00 0.00 9 G 8.64 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 0.00 0.00 0.00 0.00 10 V 8.67 3.99 1.89 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 0.70 0.00 0.00 -0.03 0.00 0.00 11 L 8.15 4.98 0.00 1.83 1.58 1.09 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 12 F 9.16 5.50 0.00 3.11 2.99 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 13 K 9.56 4.41 0.00 1.39 0.74 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.13 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.83 0.93 7.81 14 D 9.63 4.39 0.00 2.70 2.60 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 15 G 8.02 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 0.00 0.00 0.00 16 E 7.91 5.48 0.00 1.94 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 0.00 2.25 2.31 0.00 17 V 9.01 4.94 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 0.89 0.00 0.00 0.85 0.00 0.00 18 L 8.56 4.15 0.00 1.14 1.51 0.38 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 19 L 8.65 5.18 0.00 1.93 1.73 0.68 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 20 I 9.07 5.20 1.82 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 1.11 1.19 0.89 0.00 0.00 21 K 8.39 4.32 0.00 0.79 0.93 0.00 0.80 0.00 0.00 1.26 0.00 0.00 2.86 0.00 0.00 2.90 0.00 0.00 0.00 0.00 0.79 0.36 7.81 22 T 8.68 4.31 4.15 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 0.00 0.00 0.00 1.16 0.00 0.00 23 P 0.00 4.33 0.00 2.01 2.15 0.00 3.57 0.00 0.00 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.06 0.00 24 S 7.55 4.41 0.00 3.88 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 25 N 8.27 4.04 0.00 2.74 2.84 0.00 0.00 6.65 7.72 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 26 V 7.28 4.24 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 0.41 0.00 0.00 0.85 0.00 0.00 27 W 8.59 4.78 0.00 2.99 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 28 S 9.08 4.17 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 29 F 8.32 5.14 0.00 2.96 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 30 P 0.00 5.17 0.00 2.17 2.22 0.00 4.28 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 2.34 1.87 0.00 31 K 8.57 5.00 0.00 1.68 1.87 0.00 1.60 0.00 0.00 1.91 0.00 0.00 3.07 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.58 1.46 7.81 32 G 8.30 4.39 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 0.00 0.00 0.00 33 N 8.71 5.20 0.00 2.63 2.79 0.00 0.00 6.86 7.45 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 34 I 8.59 3.95 1.90 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 1.20 0.72 0.98 0.00 0.00 35 E 8.94 4.74 0.00 2.26 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 2.28 2.40 0.00 36 P 0.00 4.27 0.00 2.03 2.01 0.00 3.72 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.10 0.00 37 G 8.91 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 38 E 7.70 4.45 0.00 2.03 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 0.00 2.30 2.36 0.00 39 K 9.66 4.38 0.00 1.63 1.65 0.00 1.63 0.00 0.00 1.65 0.00 0.00 2.92 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.36 1.52 7.81 40 P 0.00 4.29 0.00 2.55 2.40 0.00 3.65 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 2.11 2.10 0.00 41 E 7.89 3.14 0.00 1.86 1.73 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 2.13 1.59 0.00 42 E 7.90 3.89 0.00 2.10 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 2.33 2.32 0.00 43 T 7.87 3.95 4.39 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 1.27 0.00 0.00 44 A 8.14 4.19 1.48 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 0.00 0.00 45 V 7.48 3.54 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 0.96 0.00 0.00 0.91 0.00 0.00 46 R 7.85 4.00 0.00 1.98 2.08 0.00 3.28 0.00 0.00 3.20 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.79 0.00 47 E 8.53 4.04 0.00 2.13 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 0.00 2.44 2.54 0.00 48 V 7.86 3.64 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 1.12 0.00 0.00 1.10 0.00 0.00 49 W 8.08 4.76 0.00 3.46 3.44 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 0.00 50 E 8.28 3.60 0.00 1.99 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 2.35 2.69 0.00 51 E 8.43 4.05 0.00 2.02 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 2.20 2.16 0.00 52 T 7.98 4.32 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 1.16 0.00 0.00 53 G 8.36 3.48 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 0.00 0.00 0.00 54 V 7.55 4.67 2.19 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 1.36 0.00 0.00 1.07 0.00 0.00 55 K 9.16 4.88 0.00 1.87 1.61 0.00 1.34 0.00 0.00 1.51 0.00 0.00 2.71 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.27 1.24 7.81 56 G 8.74 4.62 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 0.00 0.00 0.00 57 E 8.85 4.82 0.00 2.07 1.93 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 2.21 2.32 0.00 58 I 8.47 4.40 1.83 0.00 0.00 0.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.60 0.96 0.00 0.00 59 L 9.05 4.51 0.00 1.16 0.86 0.85 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 60 D 7.46 4.54 0.00 2.72 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 61 Y 8.88 4.61 0.00 3.13 2.94 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 62 I 7.93 3.76 1.69 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.60 0.81 0.00 0.00 63 G 5.85 3.51 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 0.00 0.00 0.00 64 E 8.64 5.33 0.00 2.10 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 2.24 2.41 0.00 65 I 8.65 4.94 1.97 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.55 1.05 0.00 0.00 66 H 8.08 5.09 0.00 2.50 3.05 0.00 5.76 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 7.48 4.83 0.00 3.07 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 68 W 9.23 5.46 0.00 3.32 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 69 Y 8.62 4.99 0.00 3.15 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 70 T 8.82 5.04 4.32 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 1.26 0.00 0.00 71 L 8.37 4.46 0.00 1.92 1.51 1.06 0.48 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 72 K 9.64 3.67 0.00 1.96 1.90 0.00 1.86 0.00 0.00 1.73 0.00 0.00 2.82 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.33 1.44 7.81 73 G 8.72 3.98 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 0.00 0.00 0.00 74 E 7.61 4.62 0.00 1.97 1.78 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 2.23 2.26 0.00 75 R 8.43 4.73 0.00 1.91 2.03 0.00 2.83 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.65 0.00 76 I 9.05 4.82 0.76 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.79 0.67 0.00 0.00 77 F 8.47 3.78 0.00 1.51 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 0.00 0.00 0.00 0.00 78 K 7.80 4.56 0.00 1.60 0.74 0.00 1.61 0.00 0.00 1.39 0.00 0.00 2.74 0.00 0.00 2.85 0.00 0.00 0.00 0.00 0.85 1.07 7.81 79 T 7.88 4.61 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 0.75 0.00 0.00 80 V 8.60 4.55 1.93 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 0.22 0.00 0.00 0.77 0.00 0.00 81 K 8.74 4.89 0.00 1.86 1.76 0.00 1.74 0.00 0.00 1.71 0.00 0.00 2.75 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.56 1.48 7.81 82 Y 8.90 5.14 0.00 2.78 2.60 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 83 Y 8.64 5.07 0.00 2.97 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 84 L 9.19 4.61 0.00 1.67 1.54 1.18 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 85 M 9.64 6.15 0.00 2.03 1.98 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.35 0.00 86 K 8.39 5.23 0.00 1.90 1.96 0.00 1.60 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.47 7.81 87 Y 9.09 4.46 0.00 3.28 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 88 K 7.66 4.31 0.00 1.67 1.61 0.00 1.84 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.28 1.29 7.81 89 E 6.72 4.25 0.00 1.95 1.89 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 2.08 2.04 0.00 90 G 9.71 4.50 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 0.00 0.00 0.00 0.00 0.00 0.00 91 E 8.21 5.02 0.00 1.87 1.88 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 2.33 2.38 0.00 92 P 0.00 4.37 0.00 2.19 1.88 0.00 3.84 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.11 0.00 93 R 9.09 4.54 0.00 1.54 1.82 0.00 3.16 0.00 0.00 3.26 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.69 0.00 94 P 0.00 4.52 0.00 2.15 1.98 0.00 3.74 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 95 S 8.33 4.39 0.00 3.77 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 96 W 8.31 4.39 0.00 3.53 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 97 E 6.95 3.79 0.00 1.38 1.59 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 1.47 1.47 0.00 98 V 6.88 4.40 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 0.60 0.00 0.00 0.86 0.00 0.00 99 K 8.76 4.10 0.00 1.42 1.72 0.00 1.79 0.00 0.00 1.56 0.00 0.00 2.68 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.38 1.26 7.81 100 D 7.41 4.51 0.00 2.67 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 0.00 0.00 0.00 101 A 8.49 5.15 1.14 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 0.00 0.00 102 K 9.04 4.41 0.00 1.87 1.23 0.00 1.54 0.00 0.00 1.07 0.00 0.00 2.79 0.00 0.00 2.58 0.00 0.00 0.00 0.00 0.55 1.17 7.81 103 F 8.32 4.76 0.00 2.84 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 0.00 104 F 9.14 5.05 0.00 2.83 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 0.00 105 P 0.00 4.82 0.00 2.24 2.03 0.00 3.93 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 2.17 2.40 0.00 106 I 8.67 4.05 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.14 1.05 0.00 0.00 107 K 8.12 3.92 0.00 1.76 1.89 0.00 1.68 0.00 0.00 1.64 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.44 1.57 7.81 108 E 8.10 3.96 0.00 2.08 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 2.05 2.26 0.00 109 A 8.29 3.70 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 0.00 110 K 7.89 3.96 0.00 1.98 2.01 0.00 1.78 0.00 0.00 1.78 0.00 0.00 3.00 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.90 2.08 7.81 111 K 7.79 4.10 0.00 1.59 1.77 0.00 1.70 0.00 0.00 1.67 0.00 0.00 3.15 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.40 1.48 7.81 112 L 7.05 3.87 0.00 1.31 1.26 -0.75 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 113 L 6.84 3.85 0.00 1.46 1.47 0.67 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 114 K 7.71 4.18 0.00 1.11 1.23 0.00 1.46 0.00 0.00 1.42 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.16 1.22 7.81 115 Y 6.87 4.26 0.00 3.15 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 0.00 116 K 9.13 4.08 0.00 1.82 1.93 0.00 1.72 0.00 0.00 1.85 0.00 0.00 2.98 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.58 1.51 7.81 117 G 8.17 3.69 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 0.00 0.00 0.00 118 D 8.21 4.53 0.00 2.86 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 0.00 119 K 8.21 4.15 0.00 2.01 1.94 0.00 1.69 0.00 0.00 1.80 0.00 0.00 3.12 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.68 7.81 120 E 8.51 4.04 0.00 2.22 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 2.37 2.68 0.00 121 I 7.83 3.64 2.00 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.81 0.48 0.00 0.00 122 F 8.69 4.42 0.00 3.42 3.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 E 8.43 3.80 0.00 2.18 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 0.00 2.29 2.34 0.00 124 K 8.21 3.85 0.00 1.95 1.80 0.00 1.68 0.00 0.00 1.59 0.00 0.00 2.96 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.67 7.81 125 A 8.43 3.98 1.44 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 0.00 0.00 0.00 126 L 7.80 3.68 0.00 1.54 1.54 0.49 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 127 K 7.69 4.48 0.00 1.98 1.84 0.00 1.66 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.42 1.52 7.81 128 L 8.01 4.13 0.00 1.79 1.73 0.88 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 129 K 8.28 3.86 0.00 1.58 1.72 0.00 0.61 0.00 0.00 1.01 0.00 0.00 2.34 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.17 1.08 7.81 130 E 7.97 3.93 0.00 2.23 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 2.49 0.00 131 K 7.61 3.91 0.00 1.74 1.98 0.00 1.95 0.00 0.00 1.67 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.72 1.92 7.81 132 F 7.96 4.42 0.00 3.13 3.19 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 0.00 133 K 8.06 4.22 0.00 1.76 1.64 0.00 1.67 0.00 0.00 1.75 0.00 0.00 3.12 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.42 1.43 7.81