NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 L 4.3911 8.1849 122.4965 55.1903 42.3810 175.5984 2 Q 4.5953 8.6080 125.3569 53.7732 31.9669 173.1798 3 R 5.1923 8.5747 118.3279 55.0370 34.2293 174.8324 4 T 4.7192 8.7374 115.1620 60.5743 71.9985 171.8825 5 L 5.1410 8.5094 127.7699 53.5142 44.1063 175.1036 6 V 4.9352 8.8485 126.5615 61.1353 34.3163 173.9747 7 L 4.9114 8.7731 127.4748 53.0561 44.4388 175.5916 8 I 4.6317 8.5774 124.9896 59.7386 38.4907 175.8407 9 K 4.3490 9.0067 127.7824 55.3040 33.2117 176.9205 10 P 4.7409 0.0000 0.0000 65.2634 30.5758 178.7276 11 D 4.6276 8.5407 117.2413 56.2006 39.3735 178.3175 12 A 4.0717 8.2094 122.5155 54.9460 18.1486 179.5630 13 F 4.1374 8.3020 116.0405 60.4699 39.0328 177.4462 14 E 4.0772 8.2667 117.9625 58.8080 29.5150 178.1593 15 R 4.4232 7.8403 114.7589 54.8773 30.8166 176.1518 16 S 3.7610 7.7268 113.6814 60.2393 60.9132 172.4667 17 L 4.6403 8.1283 116.9011 54.6358 42.4235 179.2024 18 V 3.3227 7.6912 120.5681 66.1336 31.3710 177.9059 19 A 4.0106 7.8169 119.9983 54.7663 18.1941 178.7771 20 E 3.8488 8.1752 117.5119 59.6779 29.4576 179.2109 21 I 3.7328 7.6666 119.4072 64.7827 37.2144 178.3767 22 M 4.2458 8.1588 119.6315 58.3133 31.7083 179.1429 23 G 3.5954 8.6011 106.4895 47.8313 0.0000 176.0467 24 R 3.9850 7.5783 119.6392 59.0215 30.3098 178.9527 25 I 3.8537 7.4936 119.7855 64.1461 37.0843 177.9393 26 E 3.9927 8.4922 120.5882 59.2477 29.2620 178.7436 27 K 4.1817 7.9648 116.6572 57.8698 32.3201 178.0698 28 K 4.1840 7.5320 118.1162 55.6122 32.4123 175.4103 29 N 4.2823 7.8283 115.1131 55.3685 37.5640 173.7547 30 F 4.6259 7.9754 113.5449 56.1204 40.5472 175.2380 31 K 4.7807 8.6457 123.0592 54.7560 34.6927 175.8598 32 I 4.1442 8.4154 124.9346 61.4528 36.8830 175.9800 33 V 3.9403 8.6859 129.2122 65.4846 32.1523 175.8826 34 S 4.5390 7.3438 112.2168 58.0846 66.1473 173.4682 35 M 5.2270 8.2022 117.7528 54.7608 35.0200 173.4777 36 K 4.7018 9.2806 126.9014 54.5516 36.1680 174.1447 37 F 5.1510 8.6829 128.1285 56.2984 41.4992 174.7391 38 W 4.4105 8.3443 126.6859 54.5037 30.2122 176.4797 39 S 3.6880 8.3018 121.1825 60.7388 62.5127 174.7580 40 K 4.0782 7.5193 119.6408 55.0802 34.2013 174.6301 41 A 4.0728 8.4050 130.0768 51.2092 19.2440 174.9977 42 P 4.2998 0.0000 0.0000 62.0997 32.0529 177.6732 43 R 3.8439 8.7263 123.3301 59.3869 29.6347 177.9480 44 N 4.2720 7.9375 116.4745 56.5543 38.7999 176.6628 45 L 3.5452 7.6657 120.4283 57.4564 41.4692 179.3504 46 I 3.9587 7.4128 119.2131 64.6495 36.8949 178.2123 47 E 4.2065 7.9159 117.7710 59.3975 29.5777 179.0574 48 Q 4.0904 8.2443 118.3390 59.2638 28.5979 178.1195 49 H 3.9583 8.6618 118.8597 59.4797 30.0517 176.2216 50 Y 4.8298 8.2150 117.0865 57.6882 38.2991 177.7009 51 K 4.1341 8.1557 123.1108 60.0313 32.5234 178.3431 52 E 4.1934 8.3567 116.9919 58.1986 29.6522 176.7146 53 H 4.8404 8.9780 116.1175 55.0201 29.8128 176.0489 54 S 2.0000 7.3396 115.3372 60.9226 62.3530 175.4706 55 E 4.1602 7.7020 116.5707 56.1121 29.6404 175.9237 56 Q 4.3585 7.7796 119.9900 53.9672 30.2143 176.9838 57 S 4.0562 8.4841 116.6049 61.6293 63.1664 174.9037 58 Y 4.4331 7.4976 116.4525 57.3484 38.4892 176.8925 59 F 4.0541 8.3755 124.4885 61.6887 39.3761 176.6189 60 N 4.2299 8.2080 115.4374 56.5428 38.5628 176.6737 61 D 4.3882 8.2312 119.6873 57.5567 40.8755 178.8936 62 L 3.9622 8.2318 120.7104 58.4965 42.2611 178.8852 63 C 3.9963 7.8454 116.6003 62.7564 27.7116 175.8479 64 D 4.4060 8.1005 120.1698 57.0858 40.5843 178.3592 65 F 4.5115 8.0769 121.0955 61.6573 39.3424 176.9622 66 M 3.7903 7.8727 115.6644 56.7334 30.3586 177.2741 67 V 4.2815 7.0250 111.0931 60.8359 32.6586 177.4610 68 S 4.1988 8.2507 116.3905 60.4712 63.2407 173.7155 69 G 3.9552 6.8147 106.3049 44.2808 0.0000 170.8901 70 P 4.4321 0.0000 0.0000 62.0714 32.4952 175.7423 71 I 4.9973 8.0456 113.7614 59.5813 41.6614 173.7422 72 I 5.1861 8.5171 123.6405 59.5686 40.5300 174.6133 73 S 4.9747 8.9840 121.2576 56.5615 65.3230 173.0192 74 I 4.8974 8.6906 125.2415 59.2482 40.7302 174.5284 75 V 4.3840 8.2695 127.5251 62.1741 32.6569 174.4346 76 Y 5.2617 8.6308 125.7337 56.5609 40.9775 174.4304 77 E 5.1854 9.2168 122.2861 54.6747 33.3959 174.7467 78 G 4.4460 8.5850 112.6077 45.9810 0.0000 172.4132 79 T 4.2660 7.9901 110.2818 62.7557 68.9018 174.1423 80 D 4.7380 8.9283 125.1790 55.1986 38.8256 175.6222 81 A 3.9318 7.6794 123.4567 55.6705 18.0273 180.3742 82 I 3.5859 8.4377 118.4920 64.7201 37.3481 178.9157 83 S 4.1480 7.9498 114.3983 61.3649 62.9652 176.3512 84 K 4.0217 8.0591 122.1684 59.3053 31.8465 179.3733 85 I 3.6670 7.8168 119.8404 63.8335 36.8044 178.6561 86 R 3.9516 7.5734 119.4807 59.1189 29.6113 179.0889 87 R 3.9946 7.7738 116.9907 58.8170 30.2706 178.6799 88 L 4.1201 7.7226 119.3112 57.5008 41.4905 178.9689 89 Q 3.9519 7.8859 119.7229 58.5461 28.9924 177.7230 90 G 4.2327 7.1174 103.0545 44.9037 0.0000 172.5955 91 N 4.4693 8.2075 117.5629 53.6656 39.6444 175.3415 92 T 3.9179 8.4683 120.8430 66.4629 68.9355 174.5048 93 N 4.3530 8.3139 121.6501 52.7795 38.5956 173.5902 94 P 4.3021 0.0000 0.0000 64.8456 31.4224 176.8340 95 L 4.4252 8.0548 118.0933 54.8711 41.6529 176.8233 96 A 4.6273 8.1443 120.2990 51.3884 20.8326 177.0079 97 S 4.1995 8.0898 110.9549 57.9313 63.9501 173.9061 98 A 4.2829 8.4270 128.1796 50.5512 19.2505 174.8258 99 P 4.4567 0.0000 0.0000 64.0816 32.0140 175.6567 100 G 4.1305 9.3325 111.2185 46.2650 0.0000 175.0887 101 T 4.4034 7.6791 109.7781 60.2768 71.5506 175.9487 102 I 3.6427 8.7918 122.3171 64.8898 37.1469 179.2067 103 R 4.0873 8.3462 119.0646 59.1184 29.6420 179.4487 104 G 3.6281 7.9622 104.8741 47.3569 0.0000 174.8006 105 D 4.6681 7.9865 119.7286 55.2342 41.5068 177.3562 106 L 4.5739 8.0395 116.3830 54.2948 44.1892 176.5252 107 A 4.6858 7.5104 120.3521 51.2938 20.4225 176.6730 108 N 4.8641 8.0913 116.3022 51.8297 37.8164 173.7315 109 D 4.5393 7.7040 112.9800 52.7218 44.0718 175.8113 110 I 3.9043 8.3688 125.2372 63.1086 38.5175 176.2719 111 R 4.2081 7.5399 116.5925 57.7384 31.0539 176.8303 112 E 4.0171 8.3184 120.9296 54.7879 27.9651 175.7483 113 N 4.9792 8.0762 122.8156 52.2197 38.5220 177.1999 114 L 4.3211 9.2669 124.3464 56.4382 41.3846 174.5082 115 I 5.1855 8.1454 116.0767 59.7341 41.3725 173.7179 116 H 5.1714 9.3333 127.9101 54.4346 32.5776 172.7259 117 A 5.0703 8.1210 125.4455 49.8888 22.0747 176.1810 118 S 4.3798 8.4773 118.3493 59.2390 63.0523 174.5232 119 D 4.7004 8.8943 122.2578 53.8659 40.5535 176.5647 120 S 4.7317 7.5131 114.3323 55.7677 67.4749 174.5031 121 E 4.0483 8.7641 121.3858 59.6198 29.0897 179.3859 122 D 4.4149 8.0200 118.5050 57.0780 41.1662 178.6822 123 S 4.1186 8.8577 115.9917 61.4297 62.7761 176.3225 124 A 3.9987 8.3574 123.8465 55.3503 18.2023 179.8316 125 V 3.5359 7.4955 116.3077 66.1736 31.4369 177.6033 126 D 4.3415 7.8450 116.2161 57.6501 41.2825 177.8793 127 E 4.2432 8.8331 119.3145 59.4047 29.3977 179.4291 128 I 4.0962 8.2554 120.5166 64.1702 37.0186 177.7221 129 S 4.5579 7.8488 111.5019 59.2637 63.2777 175.5745 130 I 3.8787 7.3446 124.1078 63.5888 37.3274 177.2307 131 W 4.4725 8.1180 117.3649 57.1001 30.7965 176.4862 132 F 5.0791 8.5847 116.5602 55.4920 39.0192 173.0292 133 P 4.4941 0.0000 0.0000 63.1578 31.0045 176.8587 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 L 8.18 4.39 0.00 1.62 1.73 0.94 0.42 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 2 Q 8.61 4.60 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.58 0.00 0.00 0.00 0.00 0.00 2.31 2.45 0.00 3 R 8.57 5.19 0.00 1.66 1.79 0.00 3.17 0.00 0.00 3.13 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.60 0.00 4 T 8.74 4.72 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 1.17 0.00 0.00 5 L 8.51 5.14 0.00 1.92 1.62 1.20 0.73 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 6 V 8.85 4.94 2.24 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 1.10 0.00 0.00 1.08 0.00 0.00 7 L 8.77 4.91 0.00 1.53 1.33 0.48 -0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 8 I 8.58 4.63 2.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.78 0.81 0.00 0.00 9 K 9.01 4.35 0.00 2.03 1.61 0.00 1.96 0.00 0.00 1.92 0.00 0.00 3.01 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.48 1.62 7.81 10 P 0.00 4.74 0.00 2.00 2.08 0.00 3.07 0.00 0.00 3.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.98 0.00 11 D 8.54 4.63 0.00 2.99 3.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 A 8.21 4.07 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 13 F 8.30 4.14 0.00 3.32 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 8.27 4.08 0.00 2.09 2.23 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 2.39 2.46 0.00 15 R 7.84 4.42 0.00 1.94 1.95 0.00 3.39 0.00 0.00 3.26 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.80 0.00 16 S 7.73 3.76 0.00 3.98 3.95 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 17 L 8.13 4.64 0.00 1.60 1.60 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 18 V 7.69 3.32 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 0.84 0.00 0.00 0.11 0.00 0.00 19 A 7.82 4.01 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 20 E 8.18 3.85 0.00 2.07 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 0.00 2.37 2.47 0.00 21 I 7.67 3.73 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 1.51 0.55 0.92 0.00 0.00 22 M 8.16 4.25 0.00 2.17 2.25 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.72 0.00 23 G 8.60 3.60 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 0.00 24 R 7.58 3.98 0.00 1.87 1.99 0.00 3.28 0.00 0.00 3.21 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.74 0.00 25 I 7.49 3.85 1.69 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.06 -0.03 0.00 0.00 26 E 8.49 3.99 0.00 2.16 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 2.32 2.40 0.00 27 K 7.96 4.18 0.00 1.84 1.84 0.00 1.74 0.00 0.00 1.62 0.00 0.00 2.97 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.46 1.58 7.81 28 K 7.53 4.18 0.00 1.78 2.15 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.15 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.80 1.43 7.81 29 N 7.83 4.28 0.00 2.78 2.67 0.00 0.00 7.11 7.13 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 30 F 7.98 4.63 0.00 2.89 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 31 K 8.65 4.78 0.00 1.77 1.76 0.00 1.71 0.00 0.00 1.70 0.00 0.00 2.79 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.41 1.57 7.81 32 I 8.42 4.14 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.65 0.81 0.00 0.00 33 V 8.69 3.94 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 0.63 0.00 0.00 0.96 0.00 0.00 34 S 7.34 4.54 0.00 3.64 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.20 5.23 0.00 2.03 1.90 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.58 0.00 36 K 9.28 4.70 0.00 1.85 1.50 0.00 1.35 0.00 0.00 0.85 0.00 0.00 2.40 0.00 0.00 2.29 0.00 0.00 0.00 0.00 0.30 0.97 7.81 37 F 8.68 5.15 0.00 3.06 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 38 W 8.34 4.41 0.00 3.02 3.02 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 39 S 8.30 3.69 0.00 4.03 4.26 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 40 K 7.52 4.08 0.00 1.65 1.68 0.00 1.75 0.00 0.00 1.69 0.00 0.00 3.18 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.28 1.46 7.81 41 A 8.40 4.07 1.05 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 0.00 0.00 42 P 0.00 4.30 0.00 2.03 1.94 0.00 3.15 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 2.09 2.13 0.00 43 R 8.73 3.84 0.00 1.81 1.90 0.00 3.15 0.00 0.00 3.24 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.64 0.00 44 N 7.94 4.27 0.00 2.72 2.67 0.00 0.00 7.25 6.66 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 45 L 7.67 3.55 0.00 1.09 0.43 -0.36 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.00 0.00 0.00 0.00 46 I 7.41 3.96 1.93 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 1.68 0.90 0.95 0.00 0.00 47 E 7.92 4.21 0.00 2.11 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 2.76 2.34 0.00 48 Q 8.24 4.09 0.00 2.01 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.16 6.71 0.00 0.00 0.00 0.00 0.00 2.40 2.39 0.00 49 H 8.66 3.96 0.00 2.92 3.51 0.00 5.93 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 Y 8.21 4.83 0.00 3.35 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 51 K 8.16 4.13 0.00 1.96 2.32 0.00 1.30 0.00 0.00 1.64 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.64 1.45 7.81 52 E 8.36 4.19 0.00 2.08 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 2.33 2.36 0.00 53 H 8.98 4.84 0.00 3.63 3.50 0.00 5.66 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 S 7.34 2.00 0.00 3.45 3.63 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 0.00 55 E 7.70 4.16 0.00 1.86 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 2.13 2.17 0.00 56 Q 7.78 4.36 0.00 1.43 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.79 0.00 0.00 0.00 0.00 0.00 2.22 2.24 0.00 57 S 8.48 4.06 0.00 3.99 3.99 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 58 Y 7.50 4.43 0.00 3.17 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 59 F 8.38 4.05 0.00 3.10 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 60 N 8.21 4.23 0.00 2.81 2.86 0.00 0.00 7.03 8.08 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 61 D 8.23 4.39 0.00 2.86 2.76 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 62 L 8.23 3.96 0.00 1.76 1.87 0.68 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 63 C 7.85 4.00 0.00 2.87 2.77 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 64 D 8.10 4.41 0.00 2.83 2.75 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 0.00 0.00 0.00 65 F 8.08 4.51 0.00 2.99 3.20 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.87 3.79 0.00 1.93 2.00 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.72 0.00 67 V 7.03 4.28 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 0.84 0.00 0.00 0.94 0.00 0.00 68 S 8.25 4.20 0.00 4.01 4.28 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 69 G 6.81 3.96 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 0.00 0.00 0.00 70 P 0.00 4.43 0.00 0.50 1.29 0.00 3.56 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.75 0.00 71 I 8.05 5.00 1.89 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.45 0.77 0.00 0.00 72 I 8.52 5.19 2.06 0.00 0.00 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 1.80 1.59 1.04 0.00 0.00 73 S 8.98 4.97 0.00 3.56 3.04 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 74 I 8.69 4.90 1.47 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 1.03 0.78 -0.13 0.00 0.00 75 V 8.27 4.38 1.74 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 0.99 0.00 0.00 0.34 0.00 0.00 76 Y 8.63 5.26 0.00 2.95 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 77 E 9.22 5.19 0.00 2.05 1.82 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 2.26 2.37 0.00 78 G 8.59 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 0.00 0.00 0.00 0.00 79 T 7.99 4.27 4.26 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 1.22 0.00 0.00 80 D 8.93 4.74 0.00 3.01 2.83 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 0.00 0.00 0.00 0.00 81 A 7.68 3.93 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 82 I 8.44 3.59 1.95 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 1.58 0.71 0.96 0.00 0.00 83 S 7.95 4.15 0.00 4.05 4.13 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 84 K 8.06 4.02 0.00 2.12 2.11 0.00 2.05 0.00 0.00 1.79 0.00 0.00 2.98 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.54 1.56 7.81 85 I 7.82 3.67 1.70 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.89 -0.23 0.74 0.00 0.00 86 R 7.57 3.95 0.00 2.05 1.96 0.00 3.12 0.00 0.00 3.16 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 87 R 7.77 3.99 0.00 1.82 1.99 0.00 3.17 0.00 0.00 3.23 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.70 0.00 88 L 7.72 4.12 0.00 1.80 1.67 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 7.89 3.95 0.00 2.28 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 5.37 0.00 0.00 0.00 0.00 0.00 2.37 2.39 0.00 90 G 7.12 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 91 N 8.21 4.47 0.00 2.70 2.81 0.00 0.00 7.05 7.70 0.00 0.00 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 T 8.47 3.92 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 1.19 0.00 0.00 93 N 8.31 4.35 0.00 2.83 2.85 0.00 0.00 6.98 7.35 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 94 P 0.00 4.30 0.00 2.19 2.14 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 95 L 8.05 4.43 0.00 1.76 1.73 0.91 0.72 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 96 A 8.14 4.63 1.22 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 0.00 0.00 0.00 97 S 8.09 4.20 0.00 3.99 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 0.00 98 A 8.43 4.28 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 99 P 0.00 4.46 0.00 2.05 2.00 0.00 3.65 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 2.03 2.09 0.00 100 G 9.33 4.13 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 0.00 0.00 0.00 101 T 7.68 4.40 4.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 102 I 8.79 3.64 2.01 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 1.51 0.88 0.91 0.00 0.00 103 R 8.35 4.09 0.00 1.93 1.97 0.00 3.33 0.00 0.00 3.26 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.74 0.00 104 G 7.96 3.63 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 0.00 0.00 0.00 0.00 105 D 7.99 4.67 0.00 2.74 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 0.00 106 L 8.04 4.57 0.00 1.64 1.66 0.92 0.55 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 0.00 107 A 7.51 4.69 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 0.00 108 N 8.09 4.86 0.00 2.63 2.71 0.00 0.00 6.75 8.47 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 0.00 109 D 7.70 4.54 0.00 2.59 2.49 0.00 0.00 0.00 0.00 0.00 0.00 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 I 8.37 3.90 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.65 0.83 0.00 0.00 111 R 7.54 4.21 0.00 1.60 1.81 0.00 3.12 0.00 0.00 3.19 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 1.47 0.00 112 E 8.32 4.02 0.00 1.68 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 1.47 1.47 0.00 113 N 8.08 4.98 0.00 2.91 3.11 0.00 0.00 6.20 6.67 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 0.00 114 L 9.27 4.32 0.00 1.99 1.92 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 0.00 0.00 0.00 0.00 0.00 0.00 115 I 8.15 5.19 1.90 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 1.13 0.95 0.99 0.00 0.00 116 H 9.33 5.17 0.00 3.37 3.11 0.00 5.78 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 A 8.12 5.07 1.13 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 0.00 0.00 118 S 8.48 4.38 0.00 3.82 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 0.00 119 D 8.89 4.70 0.00 2.79 2.80 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 0.00 120 S 7.51 4.73 0.00 3.84 3.96 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 0.00 121 E 8.76 4.05 0.00 2.05 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 0.00 2.42 2.43 0.00 122 D 8.02 4.41 0.00 2.70 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 0.00 123 S 8.86 4.12 0.00 4.02 4.11 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 0.00 124 A 8.36 4.00 1.47 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 0.00 0.00 125 V 7.50 3.54 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 1.01 0.00 0.00 1.05 0.00 0.00 126 D 7.85 4.34 0.00 2.81 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 E 8.83 4.24 0.00 2.19 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 2.26 2.46 0.00 128 I 8.26 4.10 2.01 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.03 1.04 0.00 0.00 129 S 7.85 4.56 0.00 4.09 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 0.00 130 I 7.34 3.88 1.83 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 1.39 0.80 0.16 0.00 0.00 131 W 8.12 4.47 0.00 3.26 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 0.00 132 F 8.58 5.08 0.00 3.20 3.02 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 0.00 133 P 0.00 4.49 0.00 2.21 2.07 0.00 3.97 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 1.98 0.00