NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4088 8.3049 118.1864 54.7151 32.6896 174.5693 2 I 3.9762 7.9215 121.0809 59.4685 38.2045 173.6994 3 I 5.0902 8.4182 119.3280 59.1046 41.9200 173.7551 4 E 4.4954 9.4428 123.1480 55.0827 32.5595 174.4987 5 G 4.3278 8.9125 113.1797 44.5899 0.0000 172.8461 6 D 4.8586 8.5733 117.4230 53.0493 39.8793 176.4282 7 G 4.1691 7.8925 105.5257 45.9828 0.0000 173.0899 8 I 5.2499 7.5273 119.4340 59.0426 40.8749 174.3362 9 L 4.8849 8.3068 128.1732 52.7672 44.0401 176.3394 10 D 4.6600 8.7688 121.5525 54.3485 41.4510 176.1079 11 K 4.6093 8.2506 121.2193 54.5964 35.4078 176.1173 12 R 4.1250 8.2031 118.4232 55.8860 30.7216 178.0291 13 S 4.0460 8.7471 117.5067 61.7718 62.9369 176.0450 14 E 4.0905 7.9602 116.5645 58.4220 29.9144 176.9892 15 D 4.4423 7.7812 119.3636 53.9015 41.4713 176.2942 16 A 4.0757 8.4489 125.1990 54.1789 18.9887 177.3842 17 G 4.1940 7.4325 100.2290 44.8276 0.0000 171.4609 18 Y 4.7512 8.4918 117.3105 56.3197 40.2222 175.5354 19 D 5.0439 8.7656 123.5137 54.3477 42.5014 175.0967 20 L 5.1826 9.1125 122.7031 52.9877 44.6730 175.3696 21 L 5.3010 8.5054 121.7768 52.5722 45.1413 175.8159 22 A 4.2818 8.8152 125.1224 52.1624 18.9487 178.2111 23 A 4.3675 9.0754 124.6229 53.3544 19.0968 177.0959 24 K 4.4097 7.4888 112.1930 55.4805 35.2734 174.9138 25 E 4.3412 8.7895 122.6637 56.5405 30.3642 175.9412 26 I 4.7017 8.8257 126.8732 59.7971 41.3969 173.8367 27 H 5.2973 8.8991 122.6142 53.9721 31.3501 173.4480 28 L 4.9350 9.0580 122.9033 52.9892 44.9208 176.5122 29 L 4.7069 9.6064 124.6176 52.8499 43.7303 174.9120 30 P 4.3106 0.0000 0.0000 64.5774 31.4316 177.3588 31 G 3.9721 9.2034 112.1627 45.1540 0.0000 173.1149 32 E 4.3624 8.1856 120.2393 55.7883 30.9822 175.6851 33 V 4.9024 8.3100 122.9264 61.1890 33.9702 174.7785 34 K 4.6749 8.9158 125.5167 54.8399 37.0787 175.6571 35 V 4.4492 8.3511 123.4290 61.7092 32.3362 175.2030 36 I 4.2793 8.7735 131.3393 59.8745 38.2532 174.0748 37 P 4.8451 0.0000 0.0000 63.0721 32.2866 176.7639 38 T 4.5383 8.1195 110.7259 59.9370 70.8855 176.1391 39 G 3.9951 9.0299 109.9808 45.5127 0.0000 173.6112 40 V 4.6501 7.3438 113.2791 59.9062 33.8916 175.2781 41 K 5.1010 8.6837 122.5645 54.8230 36.1091 175.0524 42 L 4.9741 8.2631 121.0455 55.1551 43.7778 174.9302 43 M 4.6176 8.6383 119.9018 53.3265 33.2776 176.2242 44 L 4.1981 8.4963 124.1228 53.4225 42.4083 175.8514 45 P 4.4570 0.0000 0.0000 62.2818 31.9757 176.0459 46 K 4.2454 8.5537 120.6884 58.3447 32.4608 177.3201 47 G 3.8579 9.4604 110.4159 45.1015 0.0000 171.8898 48 Y 5.4942 7.5614 115.2457 56.0095 42.5445 173.9069 49 W 5.4047 9.3587 117.0961 55.2454 32.5425 173.8903 50 G 4.3412 9.5005 107.3863 44.2208 0.0000 171.7700 51 L 5.3080 8.7043 126.3130 53.2244 44.3257 174.8846 52 I 4.9197 8.4636 127.5851 60.0210 38.4849 175.0680 53 I 4.6979 8.7775 126.4934 59.0101 41.9177 174.4202 54 G 4.1185 8.6269 113.8283 45.7513 0.0000 173.7162 55 K 4.3897 8.5603 122.2274 55.5511 33.2703 178.5697 56 S 4.2479 8.7219 118.0717 61.4993 62.6258 176.8690 57 S 4.0959 8.0237 116.8624 61.3355 62.9886 176.0427 58 I 4.0997 7.7626 116.2456 62.9331 37.7516 178.0769 59 G 3.6871 8.6909 108.2393 47.8304 0.0000 175.3102 60 S 4.3396 7.9123 114.4926 59.8577 63.3502 175.5660 61 K 4.3361 7.9210 121.1806 56.3687 32.6089 176.8481 62 G 3.8698 8.4464 108.2135 45.8804 0.0000 172.4641 63 L 5.1784 7.8976 118.5386 52.5569 44.5656 175.3344 64 D 5.0134 9.0368 122.6591 52.4382 44.8493 174.3905 65 V 4.7538 8.2785 122.1958 61.3531 32.9278 174.9072 66 L 4.6257 8.6768 127.6913 53.1102 44.0001 178.8045 67 G 3.5565 9.5551 108.8308 48.1964 0.0000 174.7407 68 G 4.1609 8.8493 114.2452 45.0295 0.0000 171.8309 69 V 4.9663 7.7648 119.4380 61.0437 33.2041 174.8754 70 I 4.4123 8.9326 129.5384 59.6260 39.2616 175.0992 71 D 4.9197 8.6938 127.1746 53.6295 41.7639 177.1497 72 E 4.0285 9.3255 122.4400 59.5775 29.5570 178.2661 73 G 3.8609 8.0388 104.3572 46.0931 0.0000 172.8505 74 Y 4.3172 8.3162 123.0034 57.7305 39.0416 175.4775 75 R 4.2599 7.8606 124.0673 55.6050 32.0508 175.9112 76 G 3.5723 5.7840 106.7983 43.9666 0.0000 172.7479 77 E 4.2733 8.3004 119.7368 55.9558 30.1207 175.8673 78 I 4.2933 8.9400 126.9014 60.8649 38.2864 175.0955 79 G 4.2262 8.7967 114.0930 44.2991 0.0000 172.0807 80 V 4.4520 8.7930 123.5031 60.8562 33.9582 174.6761 81 I 4.5960 8.3612 129.0220 61.2503 38.2042 174.6375 82 M 5.3107 9.0734 127.0873 53.5276 35.6015 175.1137 83 I 5.0399 8.4127 121.7554 59.6266 42.0496 174.4722 84 N 4.8808 8.7032 124.3767 52.7514 38.9850 175.2110 85 V 4.2324 8.3257 118.5746 61.2912 32.4443 176.7089 86 S 4.5358 8.0292 116.3693 57.7071 64.4787 174.0841 87 R 4.5731 8.3777 116.6111 55.6268 29.9587 176.1756 88 K 4.7366 7.5428 116.5286 54.6886 35.3101 176.0963 89 S 4.5202 8.7353 117.3692 58.7641 63.2539 173.1992 90 I 4.8041 8.8720 126.0617 59.8507 41.5923 174.1957 91 T 4.9549 8.5353 121.1970 61.8189 71.0809 173.2805 92 L 4.8058 9.0501 127.3811 53.2966 43.6608 176.3418 93 M 4.5609 9.3565 122.4215 54.2880 33.0307 175.6812 94 E 4.0789 8.6704 120.9674 57.8351 30.2482 176.6568 95 R 3.9453 9.0204 123.2899 57.1833 28.4535 176.0775 96 Q 4.2608 7.7317 119.1868 55.6071 30.5075 175.2331 97 K 4.6878 8.6614 125.3043 56.6744 31.9304 176.5538 98 I 4.3803 8.3982 118.9188 61.4266 39.6919 174.8569 99 A 4.4826 7.3243 122.7258 51.6921 22.6524 174.5472 100 Q 5.0793 8.9388 116.8588 54.2500 33.2189 174.7857 101 L 5.0264 8.8076 124.6644 53.5454 44.4097 174.9445 102 I 4.7969 8.7464 127.6044 59.4811 40.1251 174.7086 103 I 4.4950 8.3356 127.9888 60.5335 37.8179 175.2203 104 L 4.9435 8.0994 126.9434 51.7965 45.3860 174.4879 105 P 4.6532 0.0000 0.0000 63.1007 32.2692 175.4363 106 C 4.7322 8.6682 120.1558 58.8452 29.6067 173.3863 107 K 4.3812 8.4644 122.5838 54.8911 34.1267 174.6212 108 H 4.7907 8.8519 126.2082 54.3588 31.1636 173.4350 109 E 4.6597 8.1631 125.5404 54.3898 32.4669 176.2007 110 V 3.8684 8.1251 115.8231 60.9206 32.6039 175.4686 111 L 4.4722 8.2168 122.4388 53.3114 42.7403 175.9705 112 E 4.5086 8.4830 123.1285 54.1309 31.2315 175.5347 113 Q 4.1857 8.7176 126.1755 55.9679 30.1983 174.4589 114 G 3.7582 8.1305 118.4459 44.6230 0.0000 172.7763 115 K 4.4247 8.4622 125.9254 54.3005 34.4330 176.4082 116 V 3.8391 8.4845 120.7697 61.0996 32.2358 176.7161 117 V 3.9971 8.2926 123.0640 61.7491 31.3887 175.4294 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 8.30 4.41 0.00 2.09 2.32 0.00 0.00 0.00 0.00 0.00 -0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 2 I 7.92 3.98 1.85 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.30 0.89 0.00 0.00 3 I 8.42 5.09 1.81 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 1.16 0.61 0.79 0.00 0.00 4 E 9.44 4.50 0.00 1.97 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 2.17 2.22 0.00 5 G 8.91 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 0.00 0.00 0.00 0.00 6 D 8.57 4.86 0.00 2.76 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 7 G 7.89 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 0.00 0.00 0.00 8 I 7.53 5.25 1.84 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 1.29 1.00 0.85 0.00 0.00 9 L 8.31 4.88 0.00 1.64 1.59 0.94 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 10 D 8.77 4.66 0.00 2.70 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 11 K 8.25 4.61 0.00 1.58 1.43 0.00 1.10 0.00 0.00 0.61 0.00 0.00 2.48 0.00 0.00 2.33 0.00 0.00 0.00 0.00 0.64 1.08 7.81 12 R 8.20 4.13 0.00 1.99 1.92 0.00 3.23 0.00 0.00 3.38 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.61 0.00 13 S 8.75 4.05 0.00 3.82 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 14 E 7.96 4.09 0.00 2.03 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 2.24 2.29 0.00 15 D 7.78 4.44 0.00 2.66 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 16 A 8.45 4.08 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 17 G 7.43 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 0.00 0.00 0.00 0.00 18 Y 8.49 4.75 0.00 3.00 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 19 D 8.77 5.04 0.00 2.64 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 20 L 9.11 5.18 0.00 1.81 1.55 0.94 0.45 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 21 L 8.51 5.30 0.00 1.63 1.53 0.93 0.65 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 22 A 8.82 4.28 1.34 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 0.00 0.00 23 A 9.08 4.37 1.29 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 0.00 0.00 24 K 7.49 4.41 0.00 1.72 1.75 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.87 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.28 1.39 7.81 25 E 8.79 4.34 0.00 1.99 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 0.00 2.10 2.43 0.00 26 I 8.83 4.70 1.84 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 1.42 0.96 0.91 0.00 0.00 27 H 8.90 5.30 0.00 2.98 3.20 0.00 5.84 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 L 9.06 4.94 0.00 1.52 1.54 0.92 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 29 L 9.61 4.71 0.00 1.64 1.59 0.92 0.93 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 30 P 0.00 4.31 0.00 2.04 2.15 0.00 3.70 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 2.03 2.07 0.00 31 G 9.20 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 32 E 8.19 4.36 0.00 2.19 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 2.32 2.26 0.00 33 V 8.31 4.90 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 0.93 0.00 0.00 34 K 8.92 4.67 0.00 1.71 1.62 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.38 7.81 35 V 8.35 4.45 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 0.81 0.00 0.00 0.94 0.00 0.00 36 I 8.77 4.28 1.88 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 1.29 0.37 0.91 0.00 0.00 37 P 0.00 4.85 0.00 2.12 2.18 0.00 3.65 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.97 0.00 38 T 8.12 4.54 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 1.27 0.00 0.00 39 G 9.03 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 0.00 0.00 0.00 40 V 7.34 4.65 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 0.75 0.00 0.00 0.93 0.00 0.00 41 K 8.68 5.10 0.00 1.63 1.57 0.00 1.61 0.00 0.00 1.76 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.31 7.81 42 L 8.26 4.97 0.00 1.62 1.54 0.95 0.47 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 43 M 8.64 4.62 0.00 1.87 2.03 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.45 0.00 44 L 8.50 4.20 0.00 1.72 1.69 1.09 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 45 P 0.00 4.46 0.00 2.29 2.16 0.00 3.69 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.79 0.00 46 K 8.55 4.25 0.00 1.84 1.86 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.62 1.49 7.81 47 G 9.46 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 48 Y 7.56 5.49 0.00 3.01 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 49 W 9.36 5.40 0.00 3.60 3.10 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 50 G 9.50 4.34 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 0.00 0.00 0.00 51 L 8.70 5.31 0.00 1.22 1.23 1.19 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 52 I 8.46 4.92 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 1.14 0.75 0.93 0.00 0.00 53 I 8.78 4.70 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 1.77 0.91 0.00 0.00 54 G 8.63 4.12 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 0.00 0.00 0.00 55 K 8.56 4.39 0.00 1.84 1.73 0.00 1.68 0.00 0.00 1.87 0.00 0.00 2.93 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.52 1.43 7.81 56 S 8.72 4.25 0.00 4.04 4.12 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 57 S 8.02 4.10 0.00 4.04 4.05 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 0.00 0.00 0.00 58 I 7.76 4.10 1.87 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 1.67 0.92 0.94 0.00 0.00 59 G 8.69 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 60 S 7.91 4.34 0.00 4.06 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 61 K 7.92 4.34 0.00 1.96 1.89 0.00 1.60 0.00 0.00 1.91 0.00 0.00 3.12 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.49 7.81 62 G 8.45 3.87 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 0.00 0.00 0.00 63 L 7.90 5.18 0.00 1.79 1.56 0.92 0.87 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 64 D 9.04 5.01 0.00 2.76 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.28 4.75 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 0.88 0.00 0.00 0.97 0.00 0.00 66 L 8.68 4.63 0.00 1.53 1.55 0.93 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 67 G 9.56 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 68 G 8.85 4.16 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 0.00 69 V 7.76 4.97 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 0.78 0.00 0.00 0.92 0.00 0.00 70 I 8.93 4.41 1.98 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 1.28 0.95 1.03 0.00 0.00 71 D 8.69 4.92 0.00 2.68 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 72 E 9.33 4.03 0.00 2.31 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 0.00 2.37 2.43 0.00 73 G 8.04 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 74 Y 8.32 4.32 0.00 2.87 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 75 R 7.86 4.26 0.00 1.61 1.74 0.00 3.36 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.45 0.00 76 G 5.78 3.57 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 0.00 0.00 0.00 77 E 8.30 4.27 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 2.34 2.50 0.00 78 I 8.94 4.29 1.93 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.78 0.95 0.00 0.00 79 G 8.80 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 0.00 0.00 0.00 0.00 80 V 8.79 4.45 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 1.00 0.00 0.00 0.95 0.00 0.00 81 I 8.36 4.60 2.05 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 1.34 0.42 0.91 0.00 0.00 82 M 9.07 5.31 0.00 1.92 1.91 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.48 0.00 83 I 8.41 5.04 1.87 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.65 0.94 0.00 0.00 84 N 8.70 4.88 0.00 2.81 2.89 0.00 0.00 7.22 7.04 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 85 V 8.33 4.23 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 0.74 0.00 0.00 0.98 0.00 0.00 86 S 8.03 4.54 0.00 4.02 3.90 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 0.00 0.00 0.00 0.00 87 R 8.38 4.57 0.00 1.81 1.97 0.00 3.31 0.00 0.00 3.28 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 88 K 7.54 4.74 0.00 1.69 1.73 0.00 1.63 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.32 1.49 7.81 89 S 8.74 4.52 0.00 3.91 3.81 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 90 I 8.87 4.80 1.88 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 1.23 0.76 0.91 0.00 0.00 91 T 8.54 4.95 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 1.13 0.00 0.00 92 L 9.05 4.81 0.00 1.70 1.56 0.91 0.77 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 93 M 9.36 4.56 0.00 2.05 2.18 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.67 0.00 94 E 8.67 4.08 0.00 1.94 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 0.00 2.29 2.48 0.00 95 R 9.02 3.95 0.00 1.96 2.01 0.00 3.21 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.55 0.00 96 Q 7.73 4.26 0.00 2.31 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.02 7.00 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 97 K 8.66 4.69 0.00 1.69 1.76 0.00 1.77 0.00 0.00 1.85 0.00 0.00 3.02 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.45 1.44 7.81 98 I 8.40 4.38 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.63 0.91 0.00 0.00 99 A 7.32 4.48 1.29 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 0.00 0.00 100 Q 8.94 5.08 0.00 1.95 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.77 6.72 0.00 0.00 0.00 0.00 0.00 2.47 2.27 0.00 101 L 8.81 5.03 0.00 1.80 1.62 0.94 0.84 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 0.00 102 I 8.75 4.80 1.75 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 1.22 0.47 0.84 0.00 0.00 103 I 8.34 4.49 1.77 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 1.32 0.57 0.75 0.00 0.00 104 L 8.10 4.94 0.00 0.27 1.26 0.50 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.65 0.00 2.05 2.00 0.00 3.81 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.07 0.00 106 C 8.67 4.73 0.00 2.98 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 0.00 107 K 8.46 4.38 0.00 1.65 1.65 0.00 1.64 0.00 0.00 1.63 0.00 0.00 3.05 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.44 7.81 108 H 8.85 4.79 0.00 3.13 3.18 0.00 5.72 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 E 8.16 4.66 0.00 1.86 1.72 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 2.15 2.19 0.00 110 V 8.13 3.87 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 0.72 0.00 0.00 0.92 0.00 0.00 111 L 8.22 4.47 0.00 1.58 1.58 0.87 0.83 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 0.00 112 E 8.48 4.51 0.00 1.90 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 2.19 2.23 0.00 113 Q 8.72 4.19 0.00 1.98 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.41 0.00 114 G 8.13 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 0.00 0.00 0.00 115 K 8.46 4.42 0.00 1.64 1.66 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.86 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.30 1.48 7.81 116 V 8.48 3.84 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 0.77 0.00 0.00 0.92 0.00 0.00 117 V 8.29 4.00 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 0.71 0.00 0.00 0.93 0.00 0.00