NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 K 4.2214 8.3149 121.7882 55.9129 32.5560 175.5123 3 D 4.3815 8.4518 126.4403 53.7131 41.4050 174.8289 4 G 4.0579 9.1244 111.7120 44.7960 0.0000 172.7662 5 M 3.9752 8.0223 118.7121 53.7901 33.4498 176.0925 6 R 4.5050 7.8966 117.6837 53.9837 31.5583 175.9661 7 V 3.7053 8.0380 121.9842 64.0388 32.1104 176.0692 8 G 3.9577 9.1490 115.6493 44.9882 0.0000 173.4430 9 E 4.0878 7.8291 121.6922 56.5026 30.6616 175.7276 10 R 4.9769 8.6747 126.1920 55.1953 31.4706 175.4722 11 F 5.2818 9.5507 126.8267 56.4816 42.6229 173.7093 12 T 4.7494 7.6189 114.6299 59.8760 71.3720 172.6724 13 H 4.5013 8.6903 123.6635 54.3845 32.8003 171.5312 14 D 5.2138 8.2594 125.1386 52.4824 43.2902 175.7521 15 F 4.4663 8.9158 125.2403 56.5002 42.8105 173.5333 16 V 3.9010 7.7371 127.1949 62.0696 32.0048 175.6951 17 V 3.5486 8.0314 130.1607 62.2263 32.2619 174.5443 18 P 4.5407 0.0000 0.0000 61.5733 32.9361 173.9178 19 P 4.5167 0.0000 0.0000 63.8165 31.5127 176.3054 20 H 4.3446 7.7550 113.2095 55.0778 28.8997 174.9464 21 K 3.8339 7.5718 118.2862 56.6978 33.1722 176.4738 22 T 5.1414 7.9105 108.2105 60.0668 70.4797 175.8899 23 V 3.3576 8.3469 121.4900 66.2587 31.8382 178.3638 24 R 4.2053 7.7682 117.7550 59.0166 30.1144 178.2203 25 H 4.6138 8.1073 113.7727 57.3381 29.2819 176.5674 26 L 3.9556 7.8599 121.6045 57.5329 42.2629 176.6201 27 Y 4.8880 7.5878 116.8533 53.9319 38.5468 173.9152 28 P 4.6332 0.0000 0.0000 64.3302 31.9802 177.9605 29 E 3.9884 8.3704 117.4083 58.1948 28.8624 176.0752 30 S 4.5641 7.9321 114.1815 55.9221 61.9216 172.6563 31 P 4.4550 0.0000 0.0000 65.3493 31.3561 178.8497 32 E 4.0695 7.2697 113.4867 58.3960 29.5183 177.5546 33 F 4.9619 7.6948 116.3626 57.5589 39.4701 177.2082 34 A 4.0170 7.8273 124.4133 54.9435 18.1132 178.2932 35 E 4.4563 8.0698 111.7535 55.9788 30.1976 176.1486 36 A 4.1336 8.0213 123.5696 51.2509 18.9395 176.1826 37 P 4.4375 0.0000 0.0000 62.9654 32.2689 177.1612 38 E 4.4192 8.3717 121.1486 55.4621 28.2137 176.0251 39 V 4.8239 7.2109 114.1712 58.7207 37.1306 175.1758 40 F 5.0211 9.1559 125.5410 58.6883 39.6704 174.8583 41 A 4.1385 8.7950 128.6320 51.9267 19.1257 178.2589 42 T 3.7312 8.8898 118.4585 66.9907 68.5262 177.1848 43 G 3.4120 7.7971 106.7809 47.7274 0.0000 175.6527 44 F 4.2933 7.5345 119.5573 60.2730 38.9765 177.4015 45 M 4.0620 7.6489 118.3061 58.3698 32.0204 178.2965 46 V 3.6091 8.0092 118.9420 66.1650 31.6971 178.2660 47 G 3.6767 8.0345 105.2531 47.7231 0.0000 175.3558 48 L 4.2350 8.1792 122.6395 58.2823 42.1990 179.0422 49 M 4.0444 8.1722 118.7912 58.2419 31.8988 178.4269 50 E 3.8022 8.1336 118.7440 59.1483 29.6577 179.0162 51 W 4.3230 8.3358 128.0692 60.6414 30.5393 177.7628 52 A 3.9293 8.0053 120.3702 55.4875 17.9153 179.4713 53 C 3.2408 7.7191 114.9879 62.3597 27.7615 176.4657 54 V 3.5628 7.9151 119.3941 66.1516 31.3093 177.8371 55 R 4.1045 8.2319 117.5109 59.3975 29.7149 178.9223 56 A 3.4975 7.3267 119.3793 54.6822 18.1439 178.6295 57 M 4.4606 7.9347 112.8790 55.7806 31.7768 178.1850 58 A 4.0972 7.7884 123.9151 54.8204 18.5166 177.4304 59 P 4.5157 0.0000 0.0000 63.6115 31.4124 176.0948 60 Y 4.5394 7.5431 115.0947 58.1131 39.6035 175.9069 61 L 4.4421 7.4611 119.7126 53.5829 42.8617 176.6334 62 E 4.3002 9.4199 122.7020 54.9735 30.2845 174.6717 63 P 4.4583 0.0000 0.0000 64.3193 31.9803 177.3407 64 G 3.9168 9.0739 111.0138 45.1900 0.0000 173.0130 65 E 4.8776 7.6446 118.6070 55.6964 31.3223 176.0456 66 G 4.2319 8.6682 107.0590 46.1484 0.0000 171.3180 67 S 5.5358 8.2660 113.5723 57.2587 66.8276 173.4199 68 L 4.6029 8.1664 118.6060 52.8086 45.8676 176.1112 69 G 4.1890 9.0328 111.8686 46.9153 0.0000 173.1341 70 T 4.7366 8.8719 115.1806 61.8639 70.6055 174.1728 71 A 4.6806 7.6715 122.0823 51.3572 22.5633 174.8357 72 I 5.0397 8.1836 118.8694 60.0611 41.6312 174.7367 73 C 4.6744 9.4651 129.2895 58.3520 33.2780 172.6977 74 V 5.1304 8.0331 117.0720 59.4925 35.9377 175.0298 75 T 4.3728 8.5804 113.1507 61.5819 71.0924 173.4711 76 H 5.0844 8.5863 121.7388 54.9330 30.1275 172.3643 77 T 4.5830 9.0154 111.9086 61.2445 69.8871 174.8527 78 A 4.5803 7.8366 123.5342 50.8462 22.2210 175.0625 79 A 4.7809 8.3337 122.4329 50.9147 21.3855 176.7579 80 T 4.6710 8.3187 116.1449 60.9676 71.4148 172.3764 81 P 4.8507 0.0000 0.0000 61.3730 33.1750 174.1374 82 P 4.5160 0.0000 0.0000 64.1303 31.7682 175.3411 83 G 4.0710 8.9702 108.9842 45.6052 0.0000 174.5533 84 L 4.2129 7.2149 118.3354 54.7522 43.5276 176.5148 85 T 4.6281 8.1957 118.2449 62.2616 70.3772 173.9119 86 V 4.3967 8.6418 128.1409 62.4047 33.0766 174.6522 87 T 4.7990 8.9755 125.8360 62.2018 70.3595 173.8777 88 V 4.5901 8.9936 127.2989 61.8859 33.6938 174.4552 89 T 4.9634 8.8755 124.5831 61.7859 70.8314 173.1199 90 A 5.4056 9.1347 128.8785 49.9517 22.0535 174.5702 91 E 5.8006 9.3521 120.4668 53.2362 32.7583 175.0534 92 L 3.3936 8.5321 126.4923 55.1449 42.7580 176.8631 93 R 4.2551 8.3694 126.1985 57.7131 31.2029 176.9539 94 S 4.5720 7.1726 110.3276 57.2022 65.9898 174.3574 95 V 4.6516 8.3458 121.6603 60.1665 33.4683 174.8927 96 E 4.4080 8.8924 127.8173 54.5099 30.8008 176.7278 97 G 3.8981 8.0246 118.7594 46.9982 0.0000 174.5420 98 R 4.0875 8.5623 125.0323 56.7290 30.5656 175.1480 99 R 4.7013 7.8240 120.0512 55.4238 31.1143 174.8257 100 L 5.0794 8.8327 127.2614 53.0776 44.2840 175.5042 101 S 5.0679 8.8315 118.1256 56.3232 65.2774 172.7799 102 W 5.4826 9.1435 125.2076 54.9466 33.7521 174.0598 103 R 5.0726 9.1605 123.7569 54.9745 31.5338 175.1187 104 V 5.1987 8.7954 120.1678 59.9395 35.3584 174.9611 105 S 5.1732 8.7561 116.5653 57.7588 66.9520 172.7047 106 A 5.6186 8.8624 120.7992 50.8884 23.0055 174.8157 107 H 5.1805 8.6902 119.4110 54.3853 33.6888 173.1767 108 D 5.3210 8.0934 124.0890 52.5240 39.5349 177.8859 109 G 4.0611 8.6819 108.9286 46.2109 0.0000 174.4945 110 V 4.2135 7.8999 115.8689 63.8553 33.6900 174.9991 111 D 4.8945 8.2534 118.5067 51.7476 44.2279 174.8050 112 E 4.4392 8.6836 123.2428 56.4455 30.2534 176.4463 113 I 4.4486 9.6777 118.7995 59.9039 39.5225 175.3083 114 G 4.8776 7.7357 113.3615 46.5678 0.0000 171.1986 115 S 5.0365 7.4172 113.9104 56.9338 66.6772 175.0618 116 G 4.1190 7.2781 106.6513 46.3049 0.0000 171.3202 117 T 5.2709 8.0510 111.4761 60.3789 72.8384 173.0482 118 H 5.4416 9.2403 121.5850 54.8999 33.8109 171.7417 119 E 5.3427 9.0249 124.4061 54.7660 32.6682 175.2480 120 R 5.2016 9.2106 121.0548 54.3887 35.4607 173.9032 121 A 5.0849 8.5461 122.1330 50.0001 21.8061 175.8557 122 V 4.2948 8.6938 124.2620 62.8614 32.2955 175.3371 123 I 4.7315 8.8100 120.5126 59.1713 41.8730 174.0549 124 H 4.7689 8.6982 122.7922 55.2489 29.9123 175.8278 125 L 4.0641 8.2650 128.1312 58.6113 41.7944 178.7361 126 E 4.0216 8.2407 118.0878 59.1264 28.8883 178.9603 127 K 3.9720 8.4068 119.1221 59.4856 32.2759 179.0769 128 F 4.0644 8.3615 121.3013 61.1515 39.3358 176.6645 129 N 4.1792 8.4157 116.5093 56.6833 38.4551 176.5496 130 A 4.0028 7.3385 120.7284 54.1507 18.8210 178.8902 131 K 4.0167 7.8885 118.6295 59.0027 32.2927 179.0051 132 V 3.5273 7.1656 118.0375 65.7758 31.3815 177.7614 133 R 3.9451 8.0455 118.0108 59.5118 29.7446 178.3742 134 Q 4.2328 7.4744 113.4927 57.3440 28.6445 177.4904 135 K 4.4495 9.3311 118.7838 57.1144 34.1753 176.0882 136 T 4.0271 7.4398 119.5677 63.9996 68.4184 173.6483 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 2 K 8.31 4.22 0.00 1.80 1.85 0.00 1.57 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.53 7.81 3 D 8.45 4.38 0.00 2.80 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 4 G 9.12 4.06 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 0.00 0.00 0.00 5 M 8.02 3.98 0.00 1.53 1.63 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.81 0.00 6 R 7.90 4.51 0.00 1.93 2.01 0.00 2.96 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 1.72 1.57 0.00 7 V 8.04 3.71 2.01 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 0.76 0.00 0.00 0.84 0.00 0.00 8 G 9.15 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 9 E 7.83 4.09 0.00 2.21 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 2.41 2.38 0.00 10 R 8.67 4.98 0.00 1.79 1.91 0.00 3.22 0.00 0.00 3.18 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 11 F 9.55 5.28 0.00 3.15 2.99 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 12 T 7.62 4.75 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 1.08 0.00 0.00 13 H 8.69 4.50 0.00 2.91 2.90 0.00 5.74 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 D 8.26 5.21 0.00 2.39 2.40 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 15 F 8.92 4.47 0.00 2.78 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 16 V 7.74 3.90 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 0.57 0.00 0.00 0.74 0.00 0.00 17 V 8.03 3.55 1.87 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 0.75 0.00 0.00 0.43 0.00 0.00 18 P 0.00 4.54 0.00 2.09 2.02 0.00 3.82 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.83 0.00 19 P 0.00 4.52 0.00 2.07 2.13 0.00 3.67 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 2.00 2.04 0.00 20 H 7.75 4.34 0.00 3.12 3.26 0.00 5.66 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 21 K 7.57 3.83 0.00 1.83 1.58 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.84 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.07 1.38 7.81 22 T 7.91 5.14 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 1.37 0.00 0.00 23 V 8.35 3.36 2.01 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 0.40 0.00 0.00 0.92 0.00 0.00 24 R 7.77 4.21 0.00 2.07 2.02 0.00 3.22 0.00 0.00 3.32 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.66 0.00 25 H 8.11 4.61 0.00 3.52 3.60 0.00 5.85 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 L 7.86 3.96 0.00 1.39 1.87 -0.37 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 27 Y 7.59 4.89 0.00 3.35 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 28 P 0.00 4.63 0.00 2.07 2.15 0.00 3.72 0.00 0.00 4.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 29 E 8.37 3.99 0.00 2.23 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 0.00 2.48 2.41 0.00 30 S 7.93 4.56 0.00 3.68 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 31 P 0.00 4.45 0.00 2.18 2.07 0.00 3.54 0.00 0.00 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 32 E 7.27 4.07 0.00 1.61 1.87 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 2.24 2.25 0.00 33 F 7.69 4.96 0.00 3.20 2.97 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 34 A 7.83 4.02 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 35 E 8.07 4.46 0.00 2.01 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 0.00 2.27 2.32 0.00 36 A 8.02 4.13 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 37 P 0.00 4.44 0.00 2.06 2.02 0.00 3.67 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 2.13 0.00 38 E 8.37 4.42 0.00 1.99 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 2.34 2.31 0.00 39 V 7.21 4.82 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 0.92 0.00 0.00 0.95 0.00 0.00 40 F 9.16 5.02 0.00 3.04 3.09 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 0.00 0.00 0.00 0.00 41 A 8.79 4.14 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 42 T 8.89 3.73 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 1.18 0.00 0.00 43 G 7.80 3.41 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 44 F 7.53 4.29 0.00 2.73 2.73 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 0.00 0.00 0.00 0.00 45 M 7.65 4.06 0.00 1.97 1.77 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.75 2.54 0.00 46 V 8.01 3.61 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 0.90 0.00 0.00 0.90 0.00 0.00 47 G 8.03 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 L 8.18 4.24 0.00 2.17 1.97 0.69 0.90 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 49 M 8.17 4.04 0.00 2.05 2.16 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 2.71 2.57 0.00 50 E 8.13 3.80 0.00 2.14 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 2.03 2.39 0.00 51 W 8.34 4.32 0.00 3.46 3.09 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 0.00 0.00 0.00 0.00 52 A 8.01 3.93 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 53 C 7.72 3.24 0.00 2.74 1.87 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 54 V 7.92 3.56 2.30 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 0.86 0.00 0.00 0.94 0.00 0.00 55 R 8.23 4.10 0.00 2.00 2.00 0.00 3.28 0.00 0.00 3.14 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 2.09 0.00 56 A 7.33 3.50 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 57 M 7.93 4.46 0.00 2.57 2.44 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.85 0.00 58 A 7.79 4.10 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 0.00 0.00 0.00 0.00 0.00 0.00 59 P 0.00 4.52 0.00 1.87 2.04 0.00 3.91 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.89 0.00 60 Y 7.54 4.54 0.00 3.16 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 61 L 7.46 4.44 0.00 1.66 1.62 0.91 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 62 E 9.42 4.30 0.00 2.09 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 2.35 2.45 0.00 63 P 0.00 4.46 0.00 2.05 2.00 0.00 3.69 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 2.09 0.00 64 G 9.07 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 0.00 0.00 0.00 65 E 7.64 4.88 0.00 2.20 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 2.46 2.27 0.00 66 G 8.67 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 67 S 8.27 5.54 0.00 3.92 3.82 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 0.00 0.00 0.00 68 L 8.17 4.60 0.00 1.49 1.46 0.52 0.17 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 69 G 9.03 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 70 T 8.87 4.74 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 1.26 0.00 0.00 71 A 7.67 4.68 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 72 I 8.18 5.04 1.91 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.73 0.92 0.00 0.00 73 C 9.47 4.67 0.00 2.99 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 74 V 8.03 5.13 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 0.82 0.00 0.00 0.92 0.00 0.00 75 T 8.58 4.37 4.27 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 1.23 0.00 0.00 76 H 8.59 5.08 0.00 3.09 3.17 0.00 5.73 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 T 9.02 4.58 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 1.23 0.00 0.00 78 A 7.84 4.58 1.26 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 0.00 0.00 79 A 8.33 4.78 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 80 T 8.32 4.67 4.38 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 1.15 0.00 0.00 81 P 0.00 4.85 0.00 2.11 2.19 0.00 3.71 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.99 0.00 82 P 0.00 4.52 0.00 2.04 2.00 0.00 3.64 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 2.04 2.21 0.00 83 G 8.97 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.21 4.21 0.00 1.52 1.68 0.93 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 85 T 8.20 4.63 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 1.09 0.00 0.00 86 V 8.64 4.40 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 1.06 0.00 0.00 0.67 0.00 0.00 87 T 8.98 4.80 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 1.15 0.00 0.00 88 V 8.99 4.59 2.00 0.00 0.00 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 0.94 0.00 0.00 89 T 8.88 4.96 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 1.24 0.00 0.00 90 A 9.13 5.41 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 91 E 9.35 5.80 0.00 2.07 2.14 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 2.49 2.14 0.00 92 L 8.53 3.39 0.00 0.80 1.19 -0.20 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 93 R 8.37 4.26 0.00 1.70 1.88 0.00 3.28 0.00 0.00 3.28 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.53 0.00 94 S 7.17 4.57 0.00 3.75 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 95 V 8.35 4.65 1.93 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 0.62 0.00 0.00 0.87 0.00 0.00 96 E 8.89 4.41 0.00 1.96 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 2.17 2.18 0.00 97 G 8.02 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 0.00 0.00 0.00 98 R 8.56 4.09 0.00 1.89 2.12 0.00 3.14 0.00 0.00 3.55 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.62 0.00 99 R 7.82 4.70 0.00 1.95 1.94 0.00 3.10 0.00 0.00 3.16 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 100 L 8.83 5.08 0.00 1.76 1.34 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 101 S 8.83 5.07 0.00 3.78 3.67 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 0.00 0.00 0.00 0.00 102 W 9.14 5.48 0.00 3.46 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 0.00 103 R 9.16 5.07 0.00 1.97 1.87 0.00 3.13 0.00 0.00 3.21 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.69 0.00 104 V 8.80 5.20 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 0.81 0.00 0.00 1.03 0.00 0.00 105 S 8.76 5.17 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 0.00 106 A 8.86 5.62 1.26 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 0.00 0.00 107 H 8.69 5.18 0.00 3.16 3.05 0.00 5.66 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 108 D 8.09 5.32 0.00 2.78 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 0.00 109 G 8.68 4.06 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 0.00 0.00 0.00 110 V 7.90 4.21 2.20 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 0.86 0.00 0.00 0.91 0.00 0.00 111 D 8.25 4.89 0.00 2.66 2.45 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 0.00 112 E 8.68 4.44 0.00 1.99 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 2.53 0.00 113 I 9.68 4.45 2.16 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.75 1.02 0.00 0.00 114 G 7.74 4.88 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 0.00 115 S 7.42 5.04 0.00 3.93 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 0.00 116 G 7.28 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 0.00 117 T 8.05 5.27 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 1.26 0.00 0.00 118 H 9.24 5.44 0.00 3.26 3.21 0.00 5.72 0.00 0.00 0.00 0.00 6.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 119 E 9.02 5.34 0.00 2.00 1.80 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 2.23 2.32 0.00 120 R 9.21 5.20 0.00 1.82 1.79 0.00 3.01 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.54 0.00 121 A 8.55 5.08 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 0.00 122 V 8.69 4.29 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 0.85 0.00 0.00 0.96 0.00 0.00 123 I 8.81 4.73 1.81 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.02 0.72 0.00 0.00 124 H 8.70 4.77 0.00 3.21 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 125 L 8.26 4.06 0.00 1.73 1.73 0.89 0.84 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 0.00 126 E 8.24 4.02 0.00 2.15 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.41 0.00 127 K 8.41 3.97 0.00 1.88 1.92 0.00 1.58 0.00 0.00 1.67 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.55 1.32 7.81 128 F 8.36 4.06 0.00 3.22 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 0.00 129 N 8.42 4.18 0.00 2.95 3.02 0.00 0.00 7.12 7.01 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 0.00 130 A 7.34 4.00 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 0.00 131 K 7.89 4.02 0.00 1.69 1.53 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.86 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.28 1.36 7.81 132 V 7.17 3.53 1.86 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 0.95 0.00 0.00 0.39 0.00 0.00 133 R 8.05 3.95 0.00 1.85 1.95 0.00 3.33 0.00 0.00 3.14 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.82 0.00 134 Q 7.47 4.23 0.00 2.26 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.77 0.00 0.00 0.00 0.00 0.00 2.36 2.51 0.00 135 K 9.33 4.45 0.00 1.80 1.79 0.00 1.69 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.33 1.38 7.81 136 T 7.44 4.03 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