NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2203 8.1727 122.0552 56.2712 34.1169 173.8897 2 V 4.7192 8.1924 126.8750 60.6844 32.8025 174.4212 3 F 4.4683 10.2373 129.3626 57.4401 40.2488 175.0533 4 E 4.3016 8.8162 121.3958 55.9439 30.7742 177.4603 5 R 3.5205 9.0695 122.6199 60.4178 30.0428 179.7060 6 C 4.4042 8.1177 115.1304 59.4700 38.0151 175.6330 7 E 3.8954 8.1097 120.9961 59.1746 29.2602 178.4212 8 L 3.6345 8.0748 120.1861 57.8663 42.1379 178.6756 9 A 3.9554 7.8317 120.7524 55.3866 18.2861 179.9147 10 R 3.9416 8.0350 116.5249 59.4262 29.6243 179.3636 11 T 3.8557 7.8944 115.6625 66.7690 68.5817 176.7199 12 L 3.9254 8.1434 121.2004 57.4365 41.5588 179.5318 13 K 3.9649 7.9250 119.2851 59.5472 31.9755 179.1771 14 R 4.0069 8.0420 117.1347 58.4087 29.9760 177.9113 15 L 4.4374 7.1767 115.9259 53.8432 41.8400 176.7359 16 G 3.8778 7.9019 106.8870 46.9355 0.0000 175.0575 17 M 3.9607 7.7593 120.6072 56.2194 32.3523 175.6755 18 D 4.3713 7.9819 117.4738 56.5290 40.5271 175.4995 19 G 3.9049 9.4067 115.1818 45.1770 0.0000 170.6654 20 Y 4.1577 8.3331 121.6208 58.4467 38.5937 176.1970 21 R 3.5124 8.9668 127.2270 57.3204 27.5623 177.5691 22 G 3.7830 8.2642 104.4465 45.5021 0.0000 174.2797 23 I 3.9548 7.3371 121.8393 59.0995 37.2151 175.8263 24 S 4.5957 8.2764 120.4992 57.8741 63.7535 175.1449 25 L 4.2804 8.4978 121.6745 58.4787 41.7441 179.1208 26 A 4.1442 8.1657 120.2214 55.4414 18.3052 179.2364 27 N 4.4241 8.0642 114.7584 56.2287 38.5444 177.7497 28 W 4.3304 7.9619 119.9168 59.9810 29.1557 178.2620 29 M 4.1222 8.3899 118.7193 58.6625 31.4506 178.0024 30 C 3.3156 7.9461 118.4871 59.1377 40.7661 175.4090 31 L 4.0253 8.2022 121.7321 58.2309 41.6670 178.8201 32 A 4.2406 8.3356 122.1982 54.3365 18.2851 179.5187 33 K 3.0532 8.3085 118.2592 59.3957 32.0724 179.1874 34 W 4.1362 7.8125 117.4841 59.1744 29.0384 178.4842 35 E 4.3151 8.6373 118.9123 58.9279 28.9703 178.0079 36 S 4.5191 8.3795 110.7596 56.7737 64.5698 175.1476 37 G 3.8774 7.7071 108.2747 46.3654 0.0000 173.3780 38 Y 3.7484 7.9129 113.8863 58.2518 35.2990 167.8602 39 N 5.3482 7.5527 119.5939 52.0359 40.0363 175.9552 40 T 4.1989 9.0892 117.5342 63.8795 69.2188 175.9303 41 R 4.3914 8.2188 117.0160 55.6916 30.0245 176.1225 42 A 4.3586 7.5890 121.5173 52.6554 19.2419 177.1613 43 T 5.0481 8.3295 111.1384 60.3715 72.5498 173.4627 44 N 4.8699 9.0322 120.4778 51.9378 42.6200 173.0234 45 Y 4.6099 8.7727 126.1875 57.3619 39.9317 174.3664 46 N 4.6023 8.8380 124.8110 51.2988 39.4951 175.6899 47 A 3.5349 8.4023 128.2370 54.6650 18.3032 178.2456 48 G 3.5844 7.4825 104.4705 48.1431 0.0000 173.2662 49 D 4.6402 7.8520 116.1911 51.4045 39.9681 176.8121 50 R 3.8171 7.1922 116.9710 57.7077 28.4410 175.9121 51 S 4.9466 7.2475 110.6053 57.0643 66.5068 172.8355 52 T 5.1189 8.7963 115.7142 61.9627 72.6784 172.8225 53 D 5.4057 8.7752 125.1320 53.2140 43.1191 175.0706 54 Y 5.0021 9.1053 121.1478 57.3356 41.5037 177.5562 55 G 4.2821 9.0307 112.0204 44.7460 0.0000 173.7199 56 I 4.1532 8.1135 116.4989 62.6987 37.7863 177.3245 57 F 4.7991 8.0017 115.4678 56.3389 40.2920 174.9262 58 Q 3.6586 8.1346 119.1777 57.1376 26.4262 174.0975 59 I 4.3580 8.2870 119.1798 61.0537 39.2605 176.8808 60 N 5.3028 9.1905 126.6193 53.4136 39.7401 175.5281 61 S 4.6355 9.3684 121.2098 60.2954 63.1382 175.3270 62 R 3.8235 8.9786 122.6528 58.7528 30.3512 177.5093 63 Y 4.5816 7.8001 113.5768 56.8344 40.5105 176.4775 64 W 4.8678 8.0259 118.3994 57.2699 31.5902 173.5651 65 C 5.5715 8.1508 111.7273 53.8524 45.2608 172.7889 66 N 5.0722 8.8705 118.9172 51.9966 40.1736 174.7233 67 D 4.8272 8.6344 123.3329 52.1735 40.4970 177.3059 68 G 4.0148 8.7940 108.0824 46.1127 0.0000 174.6999 69 K 4.4609 7.9819 117.0034 56.6200 32.9960 175.7135 70 T 4.5506 7.7030 117.3230 61.2809 69.3904 172.0784 71 P 4.1308 0.0000 0.0000 63.8989 31.4671 176.2562 72 G 3.8112 8.8240 110.8348 46.2810 0.0000 173.1596 73 A 4.1897 7.4199 122.0380 51.4330 19.0926 177.5186 74 V 4.4758 8.0182 113.0371 59.8039 35.3503 176.2220 75 N 4.8882 7.9585 114.8327 52.2728 38.5522 174.6619 76 A 3.9431 8.5253 123.5771 54.7196 19.0748 178.2429 77 C 4.6400 8.4353 111.2861 56.8390 41.2803 173.0828 78 H 4.0282 7.9589 116.5384 56.4028 26.3699 174.1133 79 L 4.7876 8.5529 118.3089 52.9728 46.4918 176.5489 80 S 4.7098 8.3777 115.5289 57.9464 63.2464 176.0025 81 C 4.0193 8.7538 124.4087 59.5441 40.7654 176.3778 82 S 3.9153 7.8048 114.7779 61.2939 61.7080 175.8771 83 A 4.0895 7.9633 122.3503 54.2903 18.0344 177.8884 84 L 4.4767 7.8543 116.7400 54.9866 41.8453 177.5590 85 L 5.5305 7.9224 116.7184 53.6016 42.5439 176.7043 86 Q 4.3830 7.8541 117.5417 55.3898 29.5707 176.0189 87 D 4.4627 8.5791 120.2807 57.0674 41.1874 176.7752 88 N 4.6379 8.0747 118.0699 53.1599 39.5028 174.6738 89 I 4.3368 8.3757 118.4120 60.9663 38.0647 177.1206 90 A 3.9262 8.3955 125.1969 55.8086 18.0783 180.1884 91 D 4.2374 8.0616 116.4851 57.5173 40.9449 178.5483 92 A 4.0444 8.0458 120.7153 55.3706 18.4206 179.7360 93 V 3.2282 8.1749 116.7419 65.9390 31.4307 178.1214 94 A 3.8348 8.2842 121.0177 55.0900 18.0635 178.8855 95 C 4.2225 8.4841 117.4165 60.1917 38.5815 175.6978 96 M 3.6477 8.0930 120.4871 58.1930 31.0845 178.9748 97 K 3.7718 7.3457 117.9750 58.9927 32.4194 179.0741 98 R 4.0769 7.5389 119.1483 59.3064 29.9290 178.4891 99 V 2.6795 7.5768 118.2373 65.9153 31.1685 177.6905 100 V 4.1655 7.3741 107.7140 61.9479 31.5508 177.5483 101 R 4.3456 7.8206 117.5613 56.1172 30.6637 176.0769 102 D 4.8345 7.3658 120.0605 52.0459 42.5223 175.5571 103 P 4.3340 0.0000 0.0000 66.4003 31.0226 177.5729 104 Q 4.0497 8.1646 117.0449 57.0312 29.6019 178.2809 105 G 3.8674 7.6071 104.6962 46.0065 0.0000 175.8401 106 I 3.9652 7.7486 120.4236 63.0047 38.1154 177.7713 107 R 4.3237 7.6468 117.6539 58.2093 29.9627 177.4229 108 A 4.1090 7.5361 119.3734 53.8109 18.4162 177.9170 109 W 4.7300 8.3451 117.2442 55.2618 30.5790 177.4812 110 V 3.7258 8.6349 123.9770 65.6785 30.9788 177.7301 111 A 4.0102 8.2476 120.4694 54.8491 18.3392 179.0705 112 W 4.0713 8.4582 126.3700 60.7709 30.5819 178.1961 113 R 3.5759 7.7532 116.5065 59.3187 29.6000 178.5297 114 N 4.4208 8.3396 115.7782 54.9486 38.7008 176.7128 115 R 4.1989 7.7173 114.0458 55.8070 30.0239 175.1812 116 C 4.5678 7.2515 114.6505 58.5454 42.8940 174.6169 117 Q 3.3086 6.8607 119.4389 57.0347 28.8016 175.2307 118 N 4.1902 8.5513 119.5178 54.1115 36.3151 174.0674 119 R 4.5999 7.4907 113.3031 54.4375 34.4649 174.2536 120 D 4.6555 8.5727 119.2852 53.7820 41.7259 176.4581 121 V 4.7339 8.3215 118.5279 61.2973 33.0570 177.6301 122 R 4.0676 8.2939 120.5691 59.5118 29.6207 178.1984 123 Q 3.9357 8.2647 115.7496 59.7086 28.1409 178.4000 124 Y 4.3129 8.3527 118.1073 59.8307 38.1535 177.1047 125 V 4.3822 7.9809 111.5573 59.9260 32.3485 175.4866 126 Q 4.0054 7.6873 119.1972 57.0839 28.9827 176.6754 127 G 3.9373 8.8696 110.0255 46.2038 0.0000 174.5690 128 C 4.4640 7.9781 116.3213 56.3112 40.8932 173.5748 129 G 3.7918 8.0617 107.1165 47.1520 0.0000 174.1611 130 V 4.0206 7.8028 116.8791 61.1692 32.1999 176.1245 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 4.22 0.00 2.04 1.72 0.00 1.31 0.00 0.00 1.30 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 1.14 7.81 2 V 8.19 4.72 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 0.92 0.00 0.00 0.95 0.00 0.00 3 F 10.24 4.47 0.00 2.76 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 4 E 8.82 4.30 0.00 1.86 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 2.31 2.38 0.00 5 R 9.07 3.52 0.00 2.05 2.00 0.00 3.42 0.00 0.00 3.47 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.88 0.00 6 C 8.12 4.40 0.00 3.01 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 8.11 3.90 0.00 2.06 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 0.00 2.55 2.39 0.00 8 L 8.07 3.63 0.00 1.38 1.36 -0.13 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.83 3.96 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 10 R 8.04 3.94 0.00 1.90 1.99 0.00 3.14 0.00 0.00 3.26 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.84 0.00 11 T 7.89 3.86 4.29 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 1.19 0.00 0.00 12 L 8.14 3.93 0.00 1.59 1.59 0.94 0.35 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 13 K 7.93 3.96 0.00 1.96 1.92 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.50 7.81 14 R 8.04 4.01 0.00 2.01 1.97 0.00 3.20 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.83 0.00 15 L 7.18 4.44 0.00 1.65 1.54 0.83 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.90 3.88 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 0.00 0.00 0.00 17 M 7.76 3.96 0.00 1.25 1.97 0.00 0.00 0.00 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.19 0.00 18 D 7.98 4.37 0.00 2.68 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 19 G 9.41 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 0.00 0.00 0.00 20 Y 8.33 4.16 0.00 3.40 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 21 R 8.97 3.51 0.00 1.95 1.88 0.00 3.26 0.00 0.00 3.02 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.58 1.32 0.00 22 G 8.26 3.78 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 0.00 0.00 0.00 23 I 7.34 3.95 1.53 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 0.81 0.36 -0.45 0.00 0.00 24 S 8.28 4.60 0.00 4.05 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 8.50 4.28 0.00 2.14 1.81 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.14 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 0.00 0.00 0.00 0.00 0.00 27 N 8.06 4.42 0.00 2.63 2.68 0.00 0.00 7.02 8.81 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 28 W 7.96 4.33 0.00 3.53 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 29 M 8.39 4.12 0.00 2.17 2.34 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.95 0.00 30 C 7.95 3.32 0.00 2.45 3.14 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 31 L 8.20 4.03 0.00 1.95 1.90 0.81 -0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.34 4.24 1.25 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 0.00 0.00 0.00 33 K 8.31 3.05 0.00 1.51 1.88 0.00 0.71 0.00 0.00 1.12 0.00 0.00 2.49 0.00 0.00 2.42 0.00 0.00 0.00 0.00 1.28 0.44 7.81 34 W 7.81 4.14 0.00 3.41 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 35 E 8.64 4.32 0.00 2.01 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 2.61 2.60 0.00 36 S 8.38 4.52 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 7.71 3.88 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 0.00 0.00 0.00 38 Y 7.91 3.75 0.00 3.27 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 7.55 5.35 0.00 2.67 2.80 0.00 0.00 6.99 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 9.09 4.20 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 1.44 0.00 0.00 41 R 8.22 4.39 0.00 1.97 2.10 0.00 3.14 0.00 0.00 3.25 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.72 0.00 42 A 7.59 4.36 1.39 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 43 T 8.33 5.05 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 1.29 0.00 0.00 44 N 9.03 4.87 0.00 2.81 2.74 0.00 0.00 6.82 7.19 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 45 Y 8.77 4.61 0.00 2.92 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 46 N 8.84 4.60 0.00 2.62 2.60 0.00 0.00 6.51 8.06 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 47 A 8.40 3.53 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 48 G 7.48 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 0.00 0.00 0.00 49 D 7.85 4.64 0.00 2.76 2.84 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 50 R 7.19 3.82 0.00 1.91 2.13 0.00 3.14 0.00 0.00 3.33 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 51 S 7.25 4.95 0.00 3.94 3.89 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 52 T 8.80 5.12 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 0.68 0.00 0.00 53 D 8.78 5.41 0.00 2.79 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 54 Y 9.11 5.00 0.00 2.93 2.90 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 55 G 9.03 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 0.00 0.00 0.00 56 I 8.11 4.15 1.70 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.79 0.71 0.33 0.00 0.00 57 F 8.00 4.80 0.00 3.10 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 58 Q 8.13 3.66 0.00 2.60 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.92 6.84 0.00 0.00 0.00 0.00 0.00 2.52 2.69 0.00 59 I 8.29 4.36 2.12 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.04 1.11 0.00 0.00 60 N 9.19 5.30 0.00 3.08 3.02 0.00 0.00 6.97 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 9.37 4.64 0.00 4.02 4.31 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 62 R 8.98 3.82 0.00 1.50 1.28 0.00 2.61 0.00 0.00 2.82 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.01 0.00 63 Y 7.80 4.58 0.00 1.71 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 0.00 0.00 0.00 64 W 8.03 4.87 0.00 3.45 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 65 C 8.15 5.57 0.00 3.09 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 8.87 5.07 0.00 2.85 2.68 0.00 0.00 7.06 8.03 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 67 D 8.63 4.83 0.00 2.84 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 68 G 8.79 4.01 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 69 K 7.98 4.46 0.00 1.83 1.90 0.00 1.63 0.00 0.00 1.73 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.54 1.46 7.81 70 T 7.70 4.55 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 1.20 0.00 0.00 71 P 0.00 4.13 0.00 2.01 2.02 0.00 3.81 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 2.04 2.11 0.00 72 G 8.82 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 0.00 0.00 0.00 73 A 7.42 4.19 1.24 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 0.00 0.00 74 V 8.02 4.48 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 0.65 0.00 0.00 0.84 0.00 0.00 75 N 7.96 4.89 0.00 2.68 2.55 0.00 0.00 6.79 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 76 A 8.53 3.94 1.12 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 77 C 8.44 4.64 0.00 3.37 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 78 H 7.96 4.03 0.00 3.29 3.37 0.00 5.81 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 8.55 4.79 0.00 1.65 1.49 0.96 0.72 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 8.38 4.71 0.00 3.83 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 81 C 8.75 4.02 0.00 2.27 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 82 S 7.80 3.92 0.00 3.89 3.83 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 83 A 7.96 4.09 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 84 L 7.85 4.48 0.00 1.94 1.83 1.04 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.92 5.53 0.00 1.66 1.71 1.14 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.85 4.38 0.00 2.22 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.39 7.09 0.00 0.00 0.00 0.00 0.00 2.38 2.52 0.00 87 D 8.58 4.46 0.00 2.64 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 88 N 8.07 4.64 0.00 2.70 2.75 0.00 0.00 6.90 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 8.38 4.34 1.81 0.00 0.00 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.01 0.95 0.00 0.00 90 A 8.40 3.93 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 91 D 8.06 4.24 0.00 2.74 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 92 A 8.05 4.04 1.42 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 0.00 0.00 93 V 8.17 3.23 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 0.65 0.00 0.00 0.89 0.00 0.00 94 A 8.28 3.83 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 95 C 8.48 4.22 0.00 3.09 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 96 M 8.09 3.65 0.00 1.30 1.55 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 2.64 0.00 97 K 7.35 3.77 0.00 1.60 1.33 0.00 1.30 0.00 0.00 0.96 0.00 0.00 2.32 0.00 0.00 2.49 0.00 0.00 0.00 0.00 0.30 0.96 7.81 98 R 7.54 4.08 0.00 1.95 2.16 0.00 3.31 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.03 0.00 99 V 7.58 2.68 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 0.35 0.00 0.00 -0.50 0.00 0.00 100 V 7.37 4.17 2.15 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 1.10 0.00 0.00 1.42 0.00 0.00 101 R 7.82 4.35 0.00 2.13 2.04 0.00 3.25 0.00 0.00 3.31 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 2.00 0.00 102 D 7.37 4.83 0.00 3.02 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 0.00 103 P 0.00 4.33 0.00 2.16 2.20 0.00 3.81 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 1.99 2.01 0.00 104 Q 8.16 4.05 0.00 2.01 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.69 0.00 0.00 0.00 0.00 0.00 2.35 2.34 0.00 105 G 7.61 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 0.00 106 I 7.75 3.97 1.02 0.00 0.00 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.32 0.75 -0.93 0.00 0.00 107 R 7.65 4.32 0.00 2.06 2.08 0.00 3.29 0.00 0.00 3.30 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.69 0.00 108 A 7.54 4.11 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 W 8.35 4.73 0.00 3.69 3.15 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 0.00 110 V 8.63 3.73 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 1.15 0.00 0.00 0.99 0.00 0.00 111 A 8.25 4.01 1.57 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 0.00 112 W 8.46 4.07 0.00 3.45 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 0.00 113 R 7.75 3.58 0.00 2.06 1.97 0.00 3.54 0.00 0.00 3.64 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.15 0.00 114 N 8.34 4.42 0.00 2.51 2.69 0.00 0.00 6.89 7.20 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 0.00 115 R 7.72 4.20 0.00 0.85 0.93 0.00 2.72 0.00 0.00 2.82 7.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.50 0.00 116 C 7.25 4.57 0.00 2.08 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 0.00 117 Q 6.86 3.31 0.00 0.93 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.76 0.00 0.00 0.00 0.00 0.00 2.11 2.05 0.00 118 N 8.55 4.19 0.00 2.75 2.78 0.00 0.00 6.75 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 7.49 4.60 0.00 1.83 1.74 0.00 3.14 0.00 0.00 3.06 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.71 0.00 120 D 8.57 4.66 0.00 2.63 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 0.00 121 V 8.32 4.73 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.00 0.00 1.01 0.00 0.00 122 R 8.29 4.07 0.00 1.89 2.04 0.00 3.18 0.00 0.00 3.42 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.76 0.00 123 Q 8.26 3.94 0.00 2.01 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 7.13 0.00 0.00 0.00 0.00 0.00 2.40 2.14 0.00 124 Y 8.35 4.31 0.00 3.15 3.15 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 0.00 125 V 7.98 4.38 2.15 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 1.01 0.00 0.00 1.06 0.00 0.00 126 Q 7.69 4.01 0.00 2.05 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.03 0.00 0.00 0.00 0.00 0.00 2.52 2.31 0.00 127 G 8.87 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 0.00 128 C 7.98 4.46 0.00 3.03 3.15 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 0.00 129 G 8.06 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 V 7.80 4.02 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 0.83 0.00 0.00 0.97 0.00 0.00