NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 7 L 4.4947 8.1693 120.6419 55.0319 43.1175 175.7604 8 H 4.8609 8.4717 116.1471 53.3093 31.6556 171.1251 9 K 4.7085 9.2512 121.6650 55.6871 34.4974 177.1423 10 E 4.9922 8.8751 122.4034 53.8169 33.7003 173.7289 11 P 5.0222 0.0000 0.0000 63.1314 32.5693 174.8446 12 A 4.9487 8.3715 121.1398 51.2853 23.0187 175.5301 13 T 4.6490 8.5536 115.0823 61.3074 72.1601 173.8801 14 L 4.2696 8.6635 127.9178 55.8232 42.3932 175.6709 15 I 4.3732 8.6152 126.3429 62.4498 39.0918 176.2210 16 K 4.5549 7.6266 121.5404 55.1819 35.5922 174.2800 17 A 4.5500 8.7178 130.9001 51.9732 19.3927 176.6535 18 I 4.1873 8.4399 123.7374 62.7625 38.8722 174.9161 19 D 4.5854 7.5106 117.1217 53.0914 43.8190 175.2409 20 G 3.8586 8.8006 108.4317 48.2299 0.0000 173.8114 21 D 5.0107 8.0493 116.5928 52.8590 41.5917 175.1963 22 T 5.1506 7.9562 114.4035 62.3749 72.5815 172.9485 23 L 5.1686 9.0538 125.2247 52.7869 46.4104 175.3078 24 K 5.1151 9.1449 124.0614 55.0989 33.8528 175.1495 25 L 5.2766 9.3278 127.3397 53.0678 46.1769 175.2670 26 M 4.9343 9.0752 122.1451 54.9057 33.5988 174.2955 27 Y 5.0365 9.2822 127.6533 56.2167 42.3496 175.4425 28 K 3.5759 9.2307 126.1315 57.4648 29.7729 176.1859 29 G 3.9513 8.3705 103.9592 45.7880 0.0000 173.7289 30 Q 4.9160 7.9053 119.2974 53.0160 31.9467 173.2458 31 P 4.9643 0.0000 0.0000 63.1562 32.4148 175.2958 32 M 4.8950 9.4971 123.0029 54.3088 36.4731 173.5430 33 T 4.9084 8.5376 121.8077 63.0393 70.4429 173.5322 34 F 5.1453 9.9453 125.7545 55.6029 42.4369 174.1725 35 R 4.9954 8.8524 123.3732 54.3141 32.1612 175.1278 36 L 4.3192 8.6801 127.4588 54.4854 42.3934 177.3479 37 L 3.8507 8.4236 124.7847 56.2172 42.2261 178.1447 38 L 3.9018 8.8435 120.5161 55.0062 39.2533 174.0389 39 V 4.9270 7.2753 109.7732 59.5856 35.6732 174.7319 40 D 4.9559 8.9826 124.1002 52.8914 42.8526 175.7140 41 T 4.7782 7.9924 113.0226 59.0193 71.2972 173.1081 42 P 4.4320 0.0000 0.0000 62.7684 32.3363 175.6305 43 E 4.6496 10.3067 121.9677 55.4235 30.9805 177.2690 44 T 4.3807 8.3910 111.1397 62.8904 70.1739 175.3685 45 K 4.1971 7.6293 120.1641 56.4307 33.2658 172.1582 46 H 4.2750 8.7819 122.0770 55.6635 28.2669 174.3625 47 P 4.3858 0.0000 0.0000 64.3822 32.1633 176.8101 48 K 4.2466 8.5349 121.5486 52.2891 30.0330 173.7089 49 K 4.4605 8.7261 126.8122 54.3685 30.6032 176.8347 50 G 3.8558 7.5711 107.6567 44.2754 0.0000 175.2405 51 V 4.1156 8.0259 123.1668 61.6905 31.3170 176.4930 52 E 4.2854 9.2730 128.2463 55.2814 31.1793 176.1288 53 K 4.1078 8.2861 122.8023 58.0655 32.5991 176.7925 54 Y 4.4031 8.1864 123.2341 59.3071 36.2556 170.9717 55 G 4.0519 7.8507 107.1801 47.7194 0.0000 173.8481 56 P 4.3167 0.0000 0.0000 65.0603 31.3709 178.6747 57 E 4.0607 8.0920 116.7354 59.2745 29.4639 179.0133 58 A 4.0360 8.4420 121.2848 55.2539 18.4466 179.9400 59 S 4.1606 8.2698 113.5851 61.6724 62.8183 176.7829 60 A 4.0736 8.2303 123.6103 54.7739 18.1056 179.5146 61 F 3.9673 8.4228 119.3277 61.8147 39.4855 177.4690 62 T 3.9311 8.2960 115.4601 66.4476 68.1675 176.4337 63 K 3.8783 8.0856 121.3784 59.6393 32.2635 179.0291 64 K 3.9102 8.2286 118.9443 59.5741 31.7035 179.0856 65 M 3.8693 7.6746 117.5853 58.5647 31.8661 178.2643 66 V 3.8465 7.9717 112.4217 63.7909 31.6850 178.4116 67 E 4.0114 8.3368 117.9174 58.8991 29.4325 177.3709 68 N 4.6448 7.9273 113.7025 52.9059 38.9115 174.9730 69 A 4.5284 7.2888 121.3385 51.4391 19.4450 178.4154 70 K 4.1806 8.9866 121.7016 58.6903 32.5832 178.1251 71 K 4.7479 8.5491 117.2020 54.4131 36.3316 175.6399 72 L 5.2960 8.5259 122.9665 53.0717 45.3333 175.2483 73 E 5.1555 9.1799 120.9995 54.7213 34.2458 174.9247 74 V 4.7213 9.0212 115.6572 59.5013 35.3485 174.6342 75 E 4.9494 8.9890 124.7237 54.3238 32.0997 174.9909 76 F 4.6353 8.8354 125.7705 57.7824 39.9908 175.7967 77 D 5.0060 8.4984 120.8927 53.6842 43.1717 175.7593 78 K 4.4131 9.1303 116.8060 57.3515 33.3837 178.1885 79 G 4.1666 8.3231 112.5253 44.8571 0.0000 173.8530 80 Q 4.1379 8.5842 121.9327 56.4696 29.4429 176.4234 81 R 4.7263 8.4010 117.4248 56.4127 31.7287 175.5789 82 T 5.1893 7.6605 108.5343 59.8811 72.3647 173.4185 83 D 4.9022 8.5950 123.5012 51.7655 42.0866 176.9779 84 K 3.9320 8.6021 116.5919 59.1168 32.4356 176.9020 85 Y 4.3387 8.3897 116.9478 57.7438 38.0342 176.4120 86 G 3.9127 8.3667 108.3023 45.2959 0.0000 173.7265 87 R 4.3392 7.9703 119.2331 54.8992 31.6925 176.3237 88 G 3.4273 8.2357 111.1233 46.4454 0.0000 172.4177 89 L 5.3307 8.9323 123.8017 53.0994 43.3505 175.5906 90 A 4.5408 8.3948 124.9365 50.7399 23.5599 174.0519 91 Y 4.8699 8.8537 117.5067 57.3088 39.6796 175.0911 92 I 4.7806 8.8211 124.5972 59.6569 40.4357 174.0590 93 Y 5.0089 9.2344 123.8887 56.0746 40.9436 174.3955 94 A 4.9505 9.2231 126.5938 50.2619 21.2783 176.3857 95 D 4.2960 9.7380 124.9795 55.8295 39.0528 175.4064 96 G 3.9890 8.4346 104.8336 45.3835 0.0000 173.5663 97 K 4.5711 7.9365 120.2189 54.6710 34.0259 175.3403 98 M 4.0180 8.4824 123.0095 54.9745 33.1347 177.1521 99 V 3.6280 8.8441 127.3447 66.1904 31.4613 177.7030 100 N 4.3296 8.0049 115.7925 56.3223 38.3379 176.8403 101 E 3.8778 8.0488 120.0195 58.9328 29.8520 178.3607 102 A 4.0420 8.0545 120.9223 55.2992 18.4635 179.5132 103 L 3.4750 7.8800 117.3275 57.8495 41.6514 180.0996 104 V 3.6829 7.4473 117.7736 66.0390 31.3135 178.0382 105 R 3.9088 8.5167 117.7764 59.0525 29.8646 177.4101 106 Q 4.3842 7.6559 115.4857 54.8392 29.0463 175.9098 107 G 3.8915 8.0375 108.4283 46.7071 0.0000 174.8150 108 L 4.4991 7.6198 116.3907 53.7319 42.2682 176.1239 109 A 4.5968 7.4602 118.5379 50.9967 21.9651 176.3930 110 K 4.8029 8.5307 119.5022 54.5600 35.1083 176.1702 111 V 4.1609 8.7539 123.3022 62.7954 31.8617 176.0339 112 A 4.0116 8.6973 130.4247 51.2993 19.4179 176.6727 113 Y 4.1989 7.3892 117.0087 58.1930 38.4609 176.2214 114 V 4.0905 7.9741 123.3118 61.1685 33.5337 174.8087 115 Y 4.6985 8.0583 123.6878 55.7218 38.7952 175.2574 116 K 4.3564 8.6331 124.7380 56.2987 32.6715 175.2533 117 P 4.7709 0.0000 0.0000 63.1036 31.7827 176.9957 118 N 4.8664 8.6233 119.7072 52.1319 36.9442 175.2851 119 N 5.1299 7.7417 114.5748 52.9919 38.7472 177.7679 120 T 3.8269 8.6515 117.9609 67.8800 68.7225 175.2593 121 H 4.8666 7.9079 116.6897 55.8290 29.2662 177.0009 122 E 4.0015 8.2891 123.4850 59.7064 29.3657 178.6952 123 Q 4.0202 8.0318 117.5629 58.8282 29.0470 177.4787 124 H 4.1576 8.3061 118.9251 59.6324 29.7486 177.0605 125 L 3.9308 7.9834 120.3807 57.8877 41.3874 179.8324 126 R 3.9397 8.2159 117.9588 59.0143 29.9902 179.2841 127 K 3.9623 8.1994 118.6088 59.4958 31.9215 179.5756 128 S 4.1529 7.9044 115.2250 61.2730 62.7201 176.3114 129 E 3.9117 8.4796 122.3990 59.1897 29.3598 178.7040 130 A 3.7647 8.1142 121.0124 54.9045 18.3316 179.3996 131 Q 3.7703 7.8814 117.3222 59.4267 29.2273 178.4177 132 A 4.0022 8.1687 121.8967 54.9036 18.2710 179.8272 133 K 3.2656 7.6702 117.0463 59.3776 31.8419 179.1182 134 K 3.7127 7.8275 118.7482 59.4807 32.0676 177.4821 135 E 4.3155 8.0262 115.2554 54.9751 29.9404 175.9893 136 K 4.0523 8.0541 118.5246 57.2695 30.5754 174.9401 137 L 4.4798 8.0010 117.8118 55.3601 44.6769 177.8714 138 N 3.7995 9.3746 119.1525 52.7733 37.9716 177.4009 139 I 3.5639 5.4200 122.4880 63.5906 37.8191 177.1320 140 W 4.7760 7.7929 120.0681 56.4629 29.3020 176.4143 141 S 4.7588 8.2186 119.0817 58.1234 62.2934 174.0339 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 7 L 8.17 4.49 0.00 1.73 1.79 1.02 0.82 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 8 H 8.47 4.86 0.00 3.31 3.24 0.00 5.51 0.00 0.00 0.00 0.00 6.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 9.25 4.71 0.00 1.59 1.70 0.00 1.41 0.00 0.00 1.02 0.00 0.00 2.32 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.15 1.29 7.81 10 E 8.88 4.99 0.00 2.18 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 2.37 2.23 0.00 11 P 0.00 5.02 0.00 2.09 2.06 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 12 A 8.37 4.95 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 13 T 8.55 4.65 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 14 L 8.66 4.27 0.00 1.62 1.56 0.91 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 15 I 8.62 4.37 2.03 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 1.15 0.79 0.94 0.00 0.00 16 K 7.63 4.55 0.00 1.81 1.62 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.85 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.42 1.45 7.81 17 A 8.72 4.55 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 18 I 8.44 4.19 2.03 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 1.20 0.68 0.91 0.00 0.00 19 D 7.51 4.59 0.00 2.63 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 20 G 8.80 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 21 D 8.05 5.01 0.00 2.70 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 22 T 7.96 5.15 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 23 L 9.05 5.17 0.00 1.58 1.51 0.87 0.50 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 24 K 9.14 5.12 0.00 1.83 1.83 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.88 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.40 1.47 7.81 25 L 9.33 5.28 0.00 1.64 1.49 0.27 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 26 M 9.08 4.93 0.00 2.15 1.99 0.00 0.00 0.00 0.00 0.00 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.55 0.00 27 Y 9.28 5.04 0.00 3.19 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 28 K 9.23 3.58 0.00 1.60 1.68 0.00 1.38 0.00 0.00 0.61 0.00 0.00 2.83 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.70 1.23 7.81 29 G 8.37 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 0.00 0.00 0.00 30 Q 7.91 4.92 0.00 2.11 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.95 0.00 0.00 0.00 0.00 0.00 2.32 2.35 0.00 31 P 0.00 4.96 0.00 2.12 2.11 0.00 3.78 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.00 0.00 32 M 9.50 4.90 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.38 0.00 33 T 8.54 4.91 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 1.23 0.00 0.00 34 F 9.95 5.15 0.00 2.82 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 35 R 8.85 5.00 0.00 1.90 1.78 0.00 3.33 0.00 0.00 3.18 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 36 L 8.68 4.32 0.00 1.55 1.59 0.96 1.32 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 37 L 8.42 3.85 0.00 1.24 1.18 0.38 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 38 L 8.84 3.90 0.00 2.01 1.89 1.14 1.00 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 39 V 7.28 4.93 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 0.73 0.00 0.00 0.91 0.00 0.00 40 D 8.98 4.96 0.00 2.42 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 0.00 0.00 0.00 0.00 41 T 7.99 4.78 4.20 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 1.21 0.00 0.00 42 P 0.00 4.43 0.00 2.32 2.07 0.00 3.54 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.04 0.00 43 E 10.31 4.65 0.00 2.00 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 0.00 2.24 2.28 0.00 44 T 8.39 4.38 4.24 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 1.23 0.00 0.00 45 K 7.63 4.20 0.00 1.76 1.87 0.00 1.69 0.00 0.00 1.70 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.43 1.50 7.81 46 H 8.78 4.27 0.00 3.35 3.49 0.00 5.61 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 P 0.00 4.39 0.00 2.17 2.16 0.00 3.67 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.91 0.00 48 K 8.53 4.25 0.00 1.76 1.88 0.00 1.93 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.41 1.42 7.81 49 K 8.73 4.46 0.00 1.88 1.92 0.00 1.58 0.00 0.00 1.43 0.00 0.00 2.80 0.00 0.00 2.66 0.00 0.00 0.00 0.00 1.18 1.14 7.81 50 G 7.57 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 51 V 8.03 4.12 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 0.80 0.00 0.00 0.96 0.00 0.00 52 E 9.27 4.29 0.00 1.89 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 0.00 2.30 2.41 0.00 53 K 8.29 4.11 0.00 1.65 1.69 0.00 1.19 0.00 0.00 1.48 0.00 0.00 2.80 0.00 0.00 2.38 0.00 0.00 0.00 0.00 1.32 1.18 7.81 54 Y 8.19 4.40 0.00 3.20 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 55 G 7.85 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 0.00 0.00 0.00 56 P 0.00 4.32 0.00 2.15 2.12 0.00 3.56 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.17 0.00 57 E 8.09 4.06 0.00 2.39 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 0.00 2.54 2.50 0.00 58 A 8.44 4.04 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 59 S 8.27 4.16 0.00 4.06 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 60 A 8.23 4.07 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 61 F 8.42 3.97 0.00 3.29 3.18 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 62 T 8.30 3.93 4.30 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 1.27 0.00 0.00 63 K 8.09 3.88 0.00 1.91 2.01 0.00 1.64 0.00 0.00 1.65 0.00 0.00 2.99 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.52 1.57 7.81 64 K 8.23 3.91 0.00 1.64 1.76 0.00 1.72 0.00 0.00 1.54 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.61 1.54 7.81 65 M 7.67 3.87 0.00 1.84 1.65 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.49 0.00 66 V 7.97 3.85 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 0.91 0.00 0.00 0.99 0.00 0.00 67 E 8.34 4.01 0.00 1.97 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 2.33 2.47 0.00 68 N 7.93 4.64 0.00 2.80 2.80 0.00 0.00 6.98 7.50 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 69 A 7.29 4.53 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 70 K 8.99 4.18 0.00 1.87 1.88 0.00 1.64 0.00 0.00 1.70 0.00 0.00 2.98 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.66 7.81 71 K 8.55 4.75 0.00 1.67 1.64 0.00 1.59 0.00 0.00 1.64 0.00 0.00 2.81 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.34 1.38 7.81 72 L 8.53 5.30 0.00 1.69 1.48 0.88 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 73 E 9.18 5.16 0.00 1.92 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 2.21 2.26 0.00 74 V 9.02 4.72 1.45 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 0.10 0.00 0.00 0.70 0.00 0.00 75 E 8.99 4.95 0.00 2.19 2.34 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 2.59 2.44 0.00 76 F 8.84 4.64 0.00 3.04 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 77 D 8.50 5.01 0.00 2.73 2.96 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 78 K 9.13 4.41 0.00 1.80 1.89 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.05 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.50 1.45 7.81 79 G 8.32 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 80 Q 8.58 4.14 0.00 2.14 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.77 0.00 0.00 0.00 0.00 0.00 2.32 2.28 0.00 81 R 8.40 4.73 0.00 1.45 1.29 0.00 2.75 0.00 0.00 2.53 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.65 0.00 82 T 7.66 5.19 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 1.12 0.00 0.00 83 D 8.60 4.90 0.00 2.83 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 84 K 8.60 3.93 0.00 1.57 1.75 0.00 1.21 0.00 0.00 1.48 0.00 0.00 2.90 0.00 0.00 3.07 0.00 0.00 0.00 0.00 0.83 0.21 7.81 85 Y 8.39 4.34 0.00 3.08 3.01 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 86 G 8.37 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 87 R 7.97 4.34 0.00 2.09 1.82 0.00 3.14 0.00 0.00 3.32 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.70 0.00 88 G 8.24 3.43 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 0.00 0.00 0.00 0.00 89 L 8.93 5.33 0.00 1.55 1.61 0.95 0.71 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 90 A 8.39 4.54 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.85 4.87 0.00 3.05 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 92 I 8.82 4.78 1.76 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 1.12 1.10 0.80 0.00 0.00 93 Y 9.23 5.01 0.00 2.79 2.85 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 0.00 0.00 0.00 94 A 9.22 4.95 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 95 D 9.74 4.30 0.00 2.79 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 96 G 8.43 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 0.00 0.00 0.00 97 K 7.94 4.57 0.00 1.92 1.75 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.41 1.38 7.81 98 M 8.48 4.02 0.00 1.92 1.64 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 2.45 0.00 99 V 8.84 3.63 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 1.01 0.00 0.00 0.90 0.00 0.00 100 N 8.00 4.33 0.00 2.89 2.89 0.00 0.00 6.78 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 0.00 101 E 8.05 3.88 0.00 1.91 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 2.21 2.06 0.00 102 A 8.05 4.04 1.64 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 0.00 103 L 7.88 3.48 0.00 1.83 1.61 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 104 V 7.45 3.68 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 1.02 0.00 0.00 0.97 0.00 0.00 105 R 8.52 3.91 0.00 1.95 2.07 0.00 3.34 0.00 0.00 3.21 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 106 Q 7.66 4.38 0.00 1.66 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.35 0.00 0.00 0.00 0.00 0.00 2.35 2.05 0.00 107 G 8.04 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 0.00 0.00 0.00 108 L 7.62 4.50 0.00 1.28 1.46 0.45 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 109 A 7.46 4.60 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 0.00 110 K 8.53 4.80 0.00 1.67 1.74 0.00 1.31 0.00 0.00 1.21 0.00 0.00 2.84 0.00 0.00 2.69 0.00 0.00 0.00 0.00 1.31 1.21 7.81 111 V 8.75 4.16 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 0.75 0.00 0.00 0.95 0.00 0.00 112 A 8.70 4.01 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 0.00 113 Y 7.39 4.20 0.00 2.86 2.66 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 0.00 114 V 7.97 4.09 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 0.83 0.00 0.00 1.01 0.00 0.00 115 Y 8.06 4.70 0.00 3.16 2.85 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 0.00 0.00 0.00 116 K 8.63 4.36 0.00 1.80 1.80 0.00 1.76 0.00 0.00 1.79 0.00 0.00 3.06 0.00 0.00 3.42 0.00 0.00 0.00 0.00 1.49 1.47 7.81 117 P 0.00 4.77 0.00 2.22 2.16 0.00 3.81 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.01 0.00 118 N 8.62 4.87 0.00 2.94 2.89 0.00 0.00 6.64 6.73 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 0.00 119 N 7.74 5.13 0.00 2.86 3.00 0.00 0.00 6.10 7.22 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 0.00 120 T 8.65 3.83 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 1.04 0.00 0.00 121 H 7.91 4.87 0.00 2.94 3.16 0.00 5.62 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 E 8.29 4.00 0.00 2.20 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 2.33 2.39 0.00 123 Q 8.03 4.02 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.62 0.00 0.00 0.00 0.00 0.00 2.46 2.36 0.00 124 H 8.31 4.16 0.00 3.21 3.48 0.00 5.87 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 0.00 125 L 7.98 3.93 0.00 1.76 1.70 1.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.22 3.94 0.00 1.86 1.96 0.00 3.13 0.00 0.00 3.17 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.68 0.00 127 K 8.20 3.96 0.00 1.99 1.85 0.00 1.83 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.47 7.81 128 S 7.90 4.15 0.00 3.84 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 0.00 129 E 8.48 3.91 0.00 2.04 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 2.19 2.58 0.00 130 A 8.11 3.76 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 0.00 131 Q 7.88 3.77 0.00 2.25 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.74 0.00 0.00 0.00 0.00 0.00 2.33 2.49 0.00 132 A 8.17 4.00 1.46 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 0.00 0.00 0.00 0.00 0.00 0.00 133 K 7.67 3.27 0.00 1.51 1.40 0.00 0.61 0.00 0.00 0.77 0.00 0.00 2.13 0.00 0.00 2.36 0.00 0.00 0.00 0.00 0.42 0.21 7.81 134 K 7.83 3.71 0.00 1.82 1.90 0.00 1.62 0.00 0.00 1.64 0.00 0.00 2.97 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.49 7.81 135 E 8.03 4.32 0.00 1.97 1.96 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 2.28 2.41 0.00 136 K 8.05 4.05 0.00 1.97 1.89 0.00 1.67 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.39 7.81 137 L 8.00 4.48 0.00 1.78 1.65 1.02 0.79 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 0.00 138 N 9.37 3.80 0.00 2.61 1.42 0.00 0.00 7.37 7.79 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 0.00 139 I 5.42 3.56 1.30 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.34 -0.36 0.52 0.00 0.00 140 W 7.79 4.78 0.00 3.31 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 0.00 141 S 8.22 4.76 0.00 3.99 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