NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3772 8.2644 123.5888 52.1441 19.8941 175.9012 2 S 4.5092 8.4067 115.7617 55.7032 65.1271 172.1728 3 N 4.9755 9.1103 122.7052 52.7727 39.0402 174.9661 4 F 5.0003 7.8667 124.0536 57.2618 37.6445 173.3825 5 T 4.7186 7.7339 112.9947 58.9784 72.4852 174.1496 6 Q 4.4301 8.5294 122.1812 56.5115 29.7946 174.3500 7 F 4.7878 7.9468 115.7837 56.0884 41.7710 172.9661 8 V 4.0720 8.5426 120.4041 62.5738 31.2819 175.3117 9 L 4.2752 8.6152 131.2892 57.3797 42.7851 176.8883 10 V 4.2630 7.4786 119.1690 60.9800 33.9697 173.7509 11 D 4.8812 8.7709 128.0795 53.1923 41.4831 176.3016 12 N 4.8740 9.4483 129.3227 52.4681 38.3011 175.2843 13 G 4.0791 8.9481 112.8888 43.9132 0.0000 173.2267 14 G 4.4623 7.2360 108.9351 44.4754 0.0000 172.9684 15 T 4.3208 7.9948 109.0841 62.1206 70.4989 174.0068 16 G 3.9492 9.0091 114.6407 44.7088 0.0000 172.3398 17 D 4.5338 7.8258 119.9624 54.2492 42.2216 175.2603 18 V 4.2141 8.5574 123.4980 61.7861 33.3096 174.5624 19 T 4.7804 8.2135 123.8324 61.7629 71.7659 173.2480 20 V 4.6241 7.8703 118.8907 59.5380 34.4327 174.7617 21 A 5.0445 8.5978 125.1810 49.1320 22.3368 173.8578 22 P 3.9094 0.0000 0.0000 63.3302 31.2764 176.3953 23 S 4.5441 8.6633 114.8863 59.3270 65.7675 173.7528 24 N 4.7519 7.8443 115.1419 52.1203 42.0329 174.2019 25 F 5.3221 8.6871 124.5386 56.1755 40.0093 174.3958 26 A 4.3370 8.4849 123.8257 52.5110 20.0254 177.6205 27 N 3.9127 9.3832 116.6952 54.5731 36.1039 175.2787 28 G 3.8396 8.2235 101.6689 46.0487 0.0000 173.7773 29 V 4.5090 7.7831 120.0615 60.6606 33.5036 174.5906 30 A 3.5287 8.5062 131.2733 51.2817 19.5464 175.5735 31 E 5.2870 8.9996 122.9025 54.1776 33.2433 174.4809 32 W 5.3335 9.9459 126.1183 55.1652 32.8349 174.6480 33 I 5.9275 8.9688 122.9544 58.8803 41.2723 175.1473 34 S 5.1089 8.6626 119.9988 57.1567 64.3187 173.5463 35 S 4.1802 8.3510 115.7144 58.8195 62.9568 173.6633 36 N 4.3189 7.8834 120.5479 52.2247 36.9716 173.6799 37 S 3.9089 8.0422 112.5114 58.3900 62.7466 175.7337 38 R 3.9309 8.9277 126.9311 59.2437 30.0782 178.5314 39 S 4.1595 8.1524 111.4641 60.6176 62.9788 174.8407 40 Q 4.4167 7.9505 117.2209 55.2740 28.9392 175.2314 41 A 4.5217 7.4973 120.0568 51.7293 19.8214 177.5325 42 Y 4.3925 9.4604 118.1320 57.3580 39.6390 174.8164 43 K 5.1885 8.5654 123.7875 54.8140 36.2592 175.0216 44 V 5.2049 8.9024 125.3014 61.7676 35.2542 173.7899 45 T 5.5439 9.2646 117.0702 60.5006 72.6635 172.2963 46 C 5.4828 9.2932 122.7600 58.4682 35.6973 172.7361 47 S 5.0615 8.8259 118.6326 57.3056 66.4307 172.9428 48 V 4.8192 7.8851 119.7457 61.4575 34.8082 174.3542 49 R 4.3121 7.8319 118.8218 55.5821 33.0900 174.1761 50 Q 4.5574 8.7513 122.3688 55.5808 28.0065 175.8941 51 S 4.2633 8.5796 120.4424 60.5154 63.2601 174.2856 52 S 4.6323 7.4963 113.6075 56.1183 65.6936 173.6548 53 A 3.7774 8.7182 121.5906 54.9346 18.3489 178.4017 54 Q 4.4753 7.9764 111.8811 55.4494 29.9473 174.4265 55 N 5.4847 7.7915 115.9311 51.4490 42.2933 173.6632 56 R 4.7167 8.7189 121.5088 54.4549 33.4785 175.1473 57 K 5.0419 9.0390 122.8306 55.1381 35.7670 174.4600 58 Y 4.9584 9.4403 125.3272 56.9829 40.3897 174.9170 59 T 5.0167 8.8929 119.4071 62.1397 71.8030 172.8834 60 I 5.0034 8.8961 127.8783 59.4737 40.5774 175.2445 61 K 5.1771 9.1585 124.1618 54.9099 36.6655 175.5365 62 V 5.0197 9.1206 123.2894 61.2121 35.5329 173.9119 63 E 4.8197 9.1947 125.3314 54.5301 33.0809 174.7333 64 V 3.8910 8.3297 125.3645 60.3729 33.3693 173.0732 65 P 4.6785 0.0000 0.0000 61.5055 33.5732 175.5797 66 K 3.7540 7.6449 122.9777 54.0957 32.7131 175.0748 67 V 3.8811 7.8708 127.2618 63.0347 32.0151 174.7072 68 A 4.6159 8.9132 128.0762 51.3654 23.3613 174.4794 69 T 4.8403 8.3348 115.7101 61.9584 70.5868 173.9702 70 Q 4.5429 9.0111 128.3697 54.8566 31.0974 174.1115 71 T 5.0378 8.4995 122.7167 61.7867 71.1762 173.9535 72 V 4.1613 8.4423 126.0933 62.2108 34.0855 175.4012 73 G 3.6126 9.5668 114.7762 46.3258 0.0000 174.1015 74 G 3.8013 8.4149 105.8546 44.8742 0.0000 173.6907 75 V 4.3164 7.6523 121.1170 61.1407 32.8772 174.2298 76 E 5.3007 8.7267 126.4535 55.0601 31.4393 175.3673 77 L 4.9093 8.8295 121.9942 52.2868 46.0960 173.9148 78 P 4.7178 0.0000 0.0000 62.6688 32.2285 175.9832 79 V 4.5338 8.9393 116.9385 60.1248 37.0044 173.2448 80 A 4.8271 8.2993 122.4789 50.2352 19.7628 176.5705 81 A 4.1580 8.6531 126.3938 55.1096 19.2899 176.8978 82 W 4.5841 6.7921 109.9676 56.4186 31.0765 173.6117 83 R 5.1656 8.9734 117.7368 54.5902 33.7941 174.7626 84 S 4.8351 9.1049 117.1301 57.0684 64.6007 172.3680 85 Y 5.1100 8.7706 124.1505 56.3024 40.0444 174.5515 86 L 4.6479 8.8977 127.7553 53.4960 44.1194 174.6720 87 N 5.4881 8.8702 124.4959 52.1171 41.4502 172.9641 88 M 5.0037 9.2311 123.6491 53.4769 34.9839 174.1964 89 E 5.2082 8.8412 119.4837 54.5363 33.1244 174.8078 90 L 4.7516 9.1890 126.3948 53.6105 44.8883 174.8718 91 T 5.1463 8.6661 122.9280 62.0468 70.6783 174.0996 92 I 4.6453 8.7665 126.6045 58.7066 41.0131 173.4287 93 P 5.2165 0.0000 0.0000 62.0450 32.3443 177.1165 94 I 3.9021 8.3858 115.4714 62.2372 37.3704 176.6046 95 F 4.4914 7.7588 120.3818 58.0020 39.5019 175.6034 96 A 4.3199 7.7946 125.6089 52.0686 18.5618 178.4432 97 T 4.3874 8.9917 115.1645 60.9341 71.7417 175.5146 98 N 4.4217 8.5731 117.1834 56.3599 38.5240 177.8715 99 S 4.1330 8.0040 116.3877 61.6856 63.0256 176.1330 100 D 4.4061 7.9966 121.1260 57.6322 40.5631 178.7550 101 C 4.1637 8.1412 117.2252 62.8520 28.1261 175.9311 102 E 3.9704 8.3462 120.2293 59.2252 28.9639 179.2891 103 L 3.9396 7.8443 120.0448 58.2318 42.0724 179.0324 104 I 3.7162 7.6487 119.7938 64.3333 36.9099 178.6582 105 V 3.5534 7.8109 119.1790 65.8647 31.3097 178.3345 106 K 4.0993 8.1366 117.9889 59.1807 31.7988 179.2410 107 A 3.9755 8.0327 121.4743 55.3048 18.0558 179.6243 108 M 4.0289 7.5324 116.3412 58.5682 32.1933 178.7373 109 Q 4.2120 8.3649 118.5527 58.8520 28.8898 178.9666 110 G 3.5700 8.3699 107.0909 47.6254 0.0000 175.4297 111 L 4.0358 7.9131 121.7702 57.1213 42.0902 178.0969 112 L 4.5601 7.1849 115.8432 53.1184 42.8578 176.5775 113 K 4.0368 7.2554 121.1891 56.0317 32.7864 175.8443 114 D 4.5553 8.4838 124.5963 56.2040 41.1353 176.4792 115 G 4.0521 8.9760 111.8461 45.7073 0.0000 174.2435 116 N 4.6065 7.9412 116.7212 52.3172 40.6732 173.4370 117 P 4.0332 0.0000 0.0000 66.5019 31.3988 178.5628 118 I 3.6642 7.7015 117.4885 64.2794 37.3275 176.7194 119 P 4.3084 0.0000 0.0000 65.7477 31.2476 177.9698 120 S 4.3560 8.1021 112.4336 59.8778 63.1697 176.2236 121 A 4.0339 7.7829 125.1371 55.0364 18.4535 179.5859 122 I 3.6420 7.7975 118.1139 64.4707 37.0964 178.3488 123 A 4.2902 7.8512 118.9523 53.5837 18.2318 177.2950 124 A 4.6750 7.0209 117.9045 52.4864 19.6410 175.5193 125 N 4.2041 7.8829 113.0681 55.9242 36.9684 174.2612 126 S 4.9393 8.2456 113.3797 56.7081 66.6113 172.7318 127 G 4.4116 8.2911 109.3646 44.9504 0.0000 172.1003 128 I 4.1967 8.2268 121.1439 60.7279 38.5775 175.3450 129 Y 4.4015 7.5832 120.4848 57.6560 37.3093 174.3652 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 A 8.26 4.38 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 2 S 8.41 4.51 0.00 3.97 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 3 N 9.11 4.98 0.00 2.93 2.96 0.00 0.00 6.02 7.43 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 4 F 7.87 5.00 0.00 2.76 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 5 T 7.73 4.72 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 1.29 0.00 0.00 6 Q 8.53 4.43 0.00 2.04 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.85 0.00 0.00 0.00 0.00 0.00 2.32 2.50 0.00 7 F 7.95 4.79 0.00 3.04 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 8 V 8.54 4.07 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 0.79 0.00 0.00 0.92 0.00 0.00 9 L 8.62 4.28 0.00 1.38 1.41 1.01 1.07 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 10 V 7.48 4.26 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 0.99 0.00 0.00 0.85 0.00 0.00 11 D 8.77 4.88 0.00 2.65 2.57 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 12 N 9.45 4.87 0.00 2.79 2.72 0.00 0.00 6.76 7.56 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 13 G 8.95 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 0.00 0.00 0.00 14 G 7.24 4.46 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 0.00 15 T 7.99 4.32 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 16 G 9.01 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 17 D 7.83 4.53 0.00 2.63 2.53 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.56 4.21 1.60 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 -0.03 0.00 0.00 0.50 0.00 0.00 19 T 8.21 4.78 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 1.14 0.00 0.00 20 V 7.87 4.62 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 0.60 0.00 0.00 -0.24 0.00 0.00 21 A 8.60 5.04 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 P 0.00 3.91 0.00 1.26 0.49 0.00 3.44 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 1.60 1.38 0.00 23 S 8.66 4.54 0.00 3.80 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 24 N 7.84 4.75 0.00 2.79 2.68 0.00 0.00 6.60 7.71 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 25 F 8.69 5.32 0.00 2.44 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 26 A 8.48 4.34 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 27 N 9.38 3.91 0.00 2.88 2.89 0.00 0.00 6.95 7.65 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 28 G 8.22 3.84 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 0.00 0.00 0.00 29 V 7.78 4.51 2.26 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 1.00 0.00 0.00 1.02 0.00 0.00 30 A 8.51 3.53 0.08 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 0.00 0.00 31 E 9.00 5.29 0.00 2.06 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 2.27 2.37 0.00 32 W 9.95 5.33 0.00 3.22 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 33 I 8.97 5.93 1.90 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.95 1.00 0.00 0.00 34 S 8.66 5.11 0.00 3.82 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 35 S 8.35 4.18 0.00 3.82 3.80 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 36 N 7.88 4.32 0.00 2.93 2.90 0.00 0.00 6.88 7.57 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 37 S 8.04 3.91 0.00 3.88 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 38 R 8.93 3.93 0.00 1.89 1.94 0.00 3.25 0.00 0.00 3.41 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.70 0.00 39 S 8.15 4.16 0.00 4.00 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 40 Q 7.95 4.42 0.00 2.01 2.06 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 2.23 0.00 41 A 7.50 4.52 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 42 Y 9.46 4.39 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 43 K 8.57 5.19 0.00 1.81 1.63 0.00 1.66 0.00 0.00 1.82 0.00 0.00 2.85 0.00 0.00 3.17 0.00 0.00 0.00 0.00 1.42 1.44 7.81 44 V 8.90 5.20 2.27 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 0.77 0.00 0.00 0.98 0.00 0.00 45 T 9.26 5.54 4.36 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 46 C 9.29 5.48 0.00 3.23 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 47 S 8.83 5.06 0.00 4.00 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 48 V 7.89 4.82 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 -0.24 0.00 0.00 0.78 0.00 0.00 49 R 7.83 4.31 0.00 1.78 1.89 0.00 2.95 0.00 0.00 3.05 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.60 0.00 50 Q 8.75 4.56 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 7.10 0.00 0.00 0.00 0.00 0.00 2.30 2.59 0.00 51 S 8.58 4.26 0.00 4.04 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 52 S 7.50 4.63 0.00 3.96 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 53 A 8.72 3.78 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 54 Q 7.98 4.48 0.00 2.13 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.70 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 55 N 7.79 5.48 0.00 2.60 2.67 0.00 0.00 6.84 7.54 0.00 0.00 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 R 8.72 4.72 0.00 1.75 1.69 0.00 2.96 0.00 0.00 3.04 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.48 0.00 57 K 9.04 5.04 0.00 1.73 1.57 0.00 1.64 0.00 0.00 1.66 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.35 1.45 7.81 58 Y 9.44 4.96 0.00 2.95 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 59 T 8.89 5.02 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 60 I 8.90 5.00 1.92 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 1.32 0.84 0.96 0.00 0.00 61 K 9.16 5.18 0.00 1.75 1.74 0.00 1.69 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.45 7.81 62 V 9.12 5.02 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 1.12 0.00 0.00 0.99 0.00 0.00 63 E 9.19 4.82 0.00 1.84 1.56 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 1.70 2.22 0.00 64 V 8.33 3.89 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 0.78 0.00 0.00 0.95 0.00 0.00 65 P 0.00 4.68 0.00 1.80 1.70 0.00 2.20 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.59 0.00 66 K 7.64 3.75 0.00 0.79 0.74 0.00 1.14 0.00 0.00 1.10 0.00 0.00 2.90 0.00 0.00 2.81 0.00 0.00 0.00 0.00 0.31 0.77 7.81 67 V 7.87 3.88 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 0.75 0.00 0.00 0.86 0.00 0.00 68 A 8.91 4.62 1.11 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 0.00 0.00 69 T 8.33 4.84 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 70 Q 9.01 4.54 0.00 2.10 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.75 0.00 0.00 0.00 0.00 0.00 2.28 2.32 0.00 71 T 8.50 5.04 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 1.21 0.00 0.00 72 V 8.44 4.16 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 0.98 0.00 0.00 0.94 0.00 0.00 73 G 9.57 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.41 3.80 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 0.00 0.00 0.00 75 V 7.65 4.32 2.22 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 0.97 0.00 0.00 0.98 0.00 0.00 76 E 8.73 5.30 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 2.20 2.31 0.00 77 L 8.83 4.91 0.00 1.54 1.54 0.92 0.86 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 78 P 0.00 4.72 0.00 1.92 1.97 0.00 3.62 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 2.01 2.10 0.00 79 V 8.94 4.53 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 0.66 0.00 0.00 0.92 0.00 0.00 80 A 8.30 4.83 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 A 8.65 4.16 1.11 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 0.00 0.00 82 W 6.79 4.58 0.00 3.40 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 83 R 8.97 5.17 0.00 1.46 1.13 0.00 3.20 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 1.51 0.00 84 S 9.10 4.84 0.00 4.03 3.74 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 85 Y 8.77 5.11 0.00 2.84 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 86 L 8.90 4.65 0.00 1.81 1.58 0.96 0.41 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 87 N 8.87 5.49 0.00 2.77 2.71 0.00 0.00 6.96 7.65 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 88 M 9.23 5.00 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.52 0.00 89 E 8.84 5.21 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 2.24 2.30 0.00 90 L 9.19 4.75 0.00 1.72 1.57 0.93 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.67 5.15 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 1.25 0.00 0.00 92 I 8.77 4.65 1.99 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 1.28 1.14 0.96 0.00 0.00 93 P 0.00 5.22 0.00 2.24 2.18 0.00 3.94 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.15 0.00 94 I 8.39 3.90 1.64 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 -0.36 0.78 0.00 0.00 95 F 7.76 4.49 0.00 3.12 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 96 A 7.79 4.32 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 T 8.99 4.39 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 1.25 0.00 0.00 98 N 8.57 4.42 0.00 2.84 2.92 0.00 0.00 6.84 7.57 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 99 S 8.00 4.13 0.00 3.87 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 0.00 100 D 8.00 4.41 0.00 2.95 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 0.00 101 C 8.14 4.16 0.00 3.14 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 0.00 102 E 8.35 3.97 0.00 2.18 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 2.31 2.44 0.00 103 L 7.84 3.94 0.00 1.94 1.83 0.92 0.84 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 0.00 104 I 7.65 3.72 2.00 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 1.41 1.43 0.88 0.00 0.00 105 V 7.81 3.55 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 0.97 0.00 0.00 0.87 0.00 0.00 106 K 8.14 4.10 0.00 1.99 1.83 0.00 1.70 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.66 7.81 107 A 8.03 3.98 1.35 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 0.00 0.00 108 M 7.53 4.03 0.00 1.91 2.23 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.55 0.00 109 Q 8.36 4.21 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.33 2.62 0.00 110 G 8.37 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 0.00 111 L 7.91 4.04 0.00 1.74 1.92 0.91 0.80 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 0.00 112 L 7.18 4.56 0.00 1.58 1.65 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.26 4.04 0.00 1.77 1.67 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.89 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.41 7.81 114 D 8.48 4.56 0.00 2.70 2.61 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.98 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 0.00 116 N 7.94 4.61 0.00 2.91 2.72 0.00 0.00 6.79 8.01 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 0.00 117 P 0.00 4.03 0.00 2.10 2.01 0.00 3.58 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 2.08 2.16 0.00 118 I 7.70 3.66 1.86 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 1.69 0.40 0.91 0.00 0.00 119 P 0.00 4.31 0.00 2.26 2.40 0.00 3.61 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.09 0.00 120 S 8.10 4.36 0.00 4.12 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 0.00 121 A 7.78 4.03 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 0.00 122 I 7.80 3.64 1.89 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 1.47 1.13 0.93 0.00 0.00 123 A 7.85 4.29 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 0.00 124 A 7.02 4.67 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 0.00 125 N 7.88 4.20 0.00 2.85 2.85 0.00 0.00 6.63 7.03 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 0.00 126 S 8.25 4.94 0.00 4.00 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 0.00 127 G 8.29 4.41 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 0.00 128 I 8.23 4.20 1.86 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.86 0.83 0.00 0.00 129 Y 7.58 4.40 0.00 3.02 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