NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8328 8.3544 109.7396 45.5305 0.0000 173.2096 2 D 4.5571 8.6180 118.8347 52.0718 42.2702 175.3233 3 A 4.1519 8.9541 131.8255 55.0351 18.1308 178.4441 4 A 3.9245 8.4533 119.8986 55.1035 18.5647 179.9696 5 K 4.3145 8.2318 117.1134 59.8068 32.9856 179.5822 6 G 3.6006 7.9947 107.0206 47.5984 0.0000 175.2171 7 E 2.5400 7.5959 120.7656 58.4248 29.3463 178.8432 8 K 4.0723 7.3542 118.9127 59.2678 32.0911 179.0773 9 E 3.8554 8.0685 118.2911 58.5592 29.4270 178.3332 10 F 4.2403 7.9421 120.3199 59.7744 39.1105 176.3082 11 N 4.2664 7.4649 115.4938 56.2715 37.0578 176.4716 12 K 3.9457 7.7147 118.8836 57.6454 32.5952 177.6892 13 C 4.0907 7.4399 117.1854 60.5600 28.9650 175.7563 14 K 4.1198 7.4072 119.7112 59.9338 31.6963 178.9585 15 T 3.8843 7.6673 115.9277 66.0775 68.5064 174.3383 16 C 4.7480 8.3780 116.4696 59.4984 31.6632 173.8423 17 H 5.2921 8.0683 114.1815 54.0291 32.3621 173.1326 18 S 5.1150 8.4857 114.1962 57.0788 67.9950 173.4546 19 I 4.7499 9.0281 121.8831 59.8124 39.4838 174.6788 20 I 4.9266 8.4593 127.1537 59.0836 39.9377 176.0084 21 A 2.7303 8.4630 130.0560 50.3764 18.9709 176.3542 22 P 4.3833 0.0000 0.0000 65.3500 31.4083 177.3042 23 D 4.5614 7.9168 115.1370 53.0652 39.5666 177.2137 24 G 3.9251 8.3588 109.4564 45.4510 0.0000 174.4736 25 T 3.7768 8.5018 117.9740 64.0357 68.7416 173.5558 26 E 4.6999 8.4454 126.2927 55.1098 28.4933 176.1746 27 I 3.8306 8.1248 124.6459 63.4365 37.8348 177.2646 28 V 4.1957 8.1116 120.4239 60.9412 33.6626 173.8500 29 K 4.7331 8.8269 129.4238 55.0928 32.4768 174.8176 30 G 4.3723 8.4990 119.2024 43.5666 0.0000 170.6586 31 A 4.4147 8.1128 125.8019 51.7358 19.6777 177.4804 32 K 4.6441 8.3849 115.5542 56.6262 32.7296 177.8017 33 T 4.2973 8.0818 110.3523 62.4550 69.4916 174.6934 34 G 3.9174 7.7496 110.9489 42.3733 0.0000 171.2693 35 P 3.8721 0.0000 0.0000 61.3321 32.0133 175.7969 36 N 4.2510 7.9061 117.9235 54.2361 39.3063 174.6179 37 L 4.2688 8.5145 124.1587 54.4914 42.4584 175.8703 38 Y 3.9771 8.2637 121.8521 58.9169 39.1933 176.1284 39 G 3.7865 8.2426 114.2339 45.9672 0.0000 175.5201 40 V 3.4337 7.4387 121.7043 64.0499 31.4509 176.0944 41 V 3.8451 6.8340 118.2313 66.0466 30.7144 175.4816 42 G 4.0262 8.7658 116.2156 45.0527 0.0000 172.6998 43 R 4.4900 8.0633 121.1371 55.2395 31.8309 175.7480 44 T 4.3759 8.4814 122.3318 63.3211 69.3863 174.1675 45 A 4.0651 8.9680 128.8083 52.3804 19.7542 177.5526 46 G 2.9165 8.6005 107.9457 46.7502 0.0000 174.1087 47 T 4.5917 7.5817 104.2973 60.4640 70.5553 173.4169 48 Y 4.1958 8.5583 124.4838 56.9925 39.3717 173.9401 49 P 4.3467 0.0000 0.0000 63.7807 32.0126 175.4863 50 E 3.8495 8.7716 118.1235 57.5917 27.1392 174.5946 51 F 4.4495 8.2454 118.5660 56.1994 41.8650 174.3589 52 K 4.1855 7.1466 127.8980 55.3793 30.9549 176.0971 53 Y 4.6794 8.3649 121.5338 56.7493 39.0564 175.8838 54 K 4.4538 8.5608 120.3625 56.0476 33.4378 178.3076 55 D 4.3455 8.8891 120.5671 57.8607 40.7442 179.0675 56 S 4.1479 8.2394 115.0170 62.0365 62.9157 176.7623 57 I 3.7505 7.8973 120.3130 64.0271 37.6849 177.8916 58 V 3.4960 7.4374 118.8306 65.7393 31.0918 177.9154 59 A 3.9579 7.9049 119.9868 54.7814 18.5282 179.0856 60 L 4.0984 7.5173 120.4512 57.7915 42.2092 179.5690 61 G 3.9668 8.1621 106.3429 47.1279 0.0000 175.4994 62 A 4.3634 8.0073 122.3043 54.2248 18.7922 178.8617 63 S 4.3983 7.7259 111.3651 58.6886 63.3082 175.4851 64 G 4.1208 8.2755 110.9984 44.9441 0.0000 173.6683 65 F 4.2820 8.1850 123.0733 57.8894 40.4926 173.7329 66 A 4.8036 7.3619 126.6012 49.5492 21.9047 175.6815 67 W 4.3730 8.7260 121.3125 56.7609 30.7090 175.5238 68 T 5.0085 8.3943 111.5673 59.3232 71.7913 174.8678 69 E 3.9779 8.8226 120.9576 59.2918 29.4347 179.2434 70 E 3.9774 8.1593 119.0024 59.5630 29.8146 178.5532 71 D 4.6690 8.4538 118.9278 57.2834 40.9517 178.5998 72 I 3.3005 8.3396 120.6503 64.4393 36.9257 177.9457 73 A 4.0764 7.9949 120.0748 55.7204 18.5260 179.7007 74 T 4.0650 7.8919 113.6772 66.9446 68.8218 176.2378 75 Y 4.0444 8.3436 121.8188 61.0452 38.6087 178.3618 76 V 3.4015 7.9132 118.7026 66.2531 31.2180 178.1703 77 K 4.5074 7.6898 118.1863 58.1136 32.9245 176.9276 78 D 4.4470 7.8594 116.4422 51.5267 43.1495 173.5244 79 P 3.9893 0.0000 0.0000 65.1647 31.5425 178.1886 80 G 3.6798 8.0720 103.5943 47.6670 0.0000 175.4290 81 A 4.1131 8.4498 123.0808 54.5031 18.3329 179.2963 82 F 4.0413 8.3817 119.5316 61.6400 39.5002 177.2979 83 L 3.9642 8.3170 118.2698 57.9014 41.4904 179.5695 84 K 4.0556 8.0710 118.2750 59.5115 31.9454 179.0165 85 E 3.7972 7.9743 119.0776 59.2704 29.4589 178.8602 86 K 3.6148 7.5881 117.3447 59.2535 32.0812 178.1506 87 L 4.1060 8.2367 115.9642 54.3153 42.1126 175.8416 88 D 4.2501 7.6249 117.5485 55.1616 40.1526 173.5542 89 D 4.6583 8.1418 116.9868 52.0827 43.2199 175.8440 90 K 4.0377 8.7329 126.8520 58.7779 32.2271 178.1551 91 K 4.2358 8.3678 116.6227 56.0967 32.3863 176.7650 92 A 4.0652 7.9267 123.7970 52.2896 18.5610 177.1850 93 K 4.6589 8.3281 122.4848 54.8593 34.4059 175.8048 94 T 4.7334 8.3822 116.3227 60.5009 69.2941 174.4850 95 G 3.8626 8.7036 114.7944 46.3241 0.0000 173.4449 96 M 4.2225 8.0238 120.0678 54.7594 32.0927 176.6872 97 A 4.5385 8.2913 135.0000 50.2241 18.3017 176.5027 98 F 4.8641 7.3648 121.3818 56.8563 42.8528 173.0132 99 K 4.2879 7.3199 125.6177 54.2003 35.0724 175.4316 100 L 3.8615 8.1031 125.6610 53.6551 43.2536 177.2606 101 A 3.9302 8.4786 128.9052 54.4986 18.7737 177.7999 102 K 4.5319 8.0142 114.2556 55.1863 35.3674 174.5016 103 G 3.4908 9.5395 115.3674 45.5667 0.0000 175.8501 104 G 3.9754 8.5039 108.5791 48.3204 0.0000 175.2691 105 E 4.1389 8.1789 121.6803 58.5417 29.6144 178.5334 106 D 4.4071 7.9766 118.7027 57.4187 41.0825 178.6867 107 V 3.7310 8.2557 118.9411 65.7746 31.5989 177.8478 108 A 3.9450 8.3957 120.8399 55.2062 18.2898 179.4834 109 A 4.0699 8.2512 119.6152 55.3054 18.4310 179.0965 110 Y 4.1351 8.3298 118.2245 61.1086 38.7143 178.3401 111 L 3.4103 7.8408 118.1324 57.7313 41.7182 179.2179 112 A 4.0069 7.4727 119.6139 54.9073 18.5906 179.4754 113 S 4.1114 7.8705 112.9766 61.5884 62.8240 176.7587 114 V 3.4728 7.1333 120.8008 65.1306 31.0498 176.8073 115 V 3.9843 7.1731 109.0415 60.9237 31.7929 175.9641 116 K 4.1712 7.8692 125.6691 56.4892 32.0669 176.1009 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 G 8.35 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 0.00 0.00 0.00 2 D 8.62 4.56 0.00 2.75 2.56 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 3 A 8.95 4.15 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 4 A 8.45 3.92 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 5 K 8.23 4.31 0.00 1.97 2.06 0.00 1.50 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.63 7.81 6 G 7.99 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 E 7.60 2.54 0.00 1.30 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 2.11 1.95 0.00 8 K 7.35 4.07 0.00 2.07 1.79 0.00 1.86 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.41 7.81 9 E 8.07 3.86 0.00 2.22 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 0.00 2.60 2.46 0.00 10 F 7.94 4.24 0.00 3.22 3.11 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 11 N 7.46 4.27 0.00 2.70 2.93 0.00 0.00 6.93 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 12 K 7.71 3.95 0.00 1.71 1.66 0.00 1.82 0.00 0.00 1.80 0.00 0.00 3.30 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.46 1.42 7.81 13 C 7.44 4.09 0.00 1.23 2.35 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 14 K 7.41 4.12 0.00 2.05 2.20 0.00 1.52 0.00 0.00 1.88 0.00 0.00 2.97 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.49 7.81 15 T 7.67 3.88 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 1.09 0.00 0.00 16 C 8.38 4.75 0.00 2.63 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 17 H 8.07 5.29 0.00 3.12 3.22 0.00 5.56 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 S 8.49 5.11 0.00 3.74 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 19 I 9.03 4.75 1.75 0.00 0.00 -0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.59 0.92 0.00 0.00 20 I 8.46 4.93 1.85 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 1.28 0.61 0.92 0.00 0.00 21 A 8.46 2.73 0.77 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 0.00 0.00 22 P 0.00 4.38 0.00 2.01 2.14 0.00 3.22 0.00 0.00 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 23 D 7.92 4.56 0.00 2.72 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 24 G 8.36 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 25 T 8.50 3.78 4.14 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 1.18 0.00 0.00 26 E 8.45 4.70 0.00 1.94 1.92 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 2.28 2.31 0.00 27 I 8.12 3.83 2.06 0.00 0.00 1.00 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 0.45 0.89 0.00 0.00 28 V 8.11 4.20 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 1.03 0.00 0.00 0.89 0.00 0.00 29 K 8.83 4.73 0.00 1.77 1.75 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.37 1.61 7.81 30 G 8.50 4.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 A 8.11 4.41 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 32 K 8.38 4.64 0.00 1.76 1.84 0.00 1.77 0.00 0.00 1.80 0.00 0.00 3.06 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.35 1.40 7.81 33 T 8.08 4.30 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 1.22 0.00 0.00 34 G 7.75 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 35 P 0.00 3.87 0.00 1.79 1.11 0.00 3.42 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.51 0.00 36 N 7.91 4.25 0.00 2.40 1.55 0.00 0.00 6.96 7.78 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 37 L 8.51 4.27 0.00 1.71 1.54 0.75 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 8.26 3.98 0.00 2.96 2.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 G 8.24 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 40 V 7.44 3.43 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 0.58 0.00 0.00 0.70 0.00 0.00 41 V 6.83 3.85 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 0.73 0.00 0.00 0.83 0.00 0.00 42 G 8.77 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 43 R 8.06 4.49 0.00 2.18 2.13 0.00 3.34 0.00 0.00 3.32 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 44 T 8.48 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 1.26 0.00 0.00 45 A 8.97 4.07 1.04 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 0.00 0.00 46 G 8.60 2.92 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 47 T 7.58 4.59 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 1.25 0.00 0.00 48 Y 8.56 4.20 0.00 3.20 3.25 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 49 P 0.00 4.35 0.00 1.88 1.86 0.00 2.20 0.00 0.00 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.86 0.00 50 E 8.77 3.85 0.00 2.15 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 2.24 2.27 0.00 51 F 8.25 4.45 0.00 3.12 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 52 K 7.15 4.19 0.00 1.39 1.61 0.00 1.71 0.00 0.00 1.66 0.00 0.00 2.86 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.32 1.30 7.81 53 Y 8.36 4.68 0.00 3.07 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 54 K 8.56 4.45 0.00 1.98 1.83 0.00 1.77 0.00 0.00 1.89 0.00 0.00 2.92 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.56 7.81 55 D 8.89 4.35 0.00 2.77 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 56 S 8.24 4.15 0.00 4.05 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 57 I 7.90 3.75 2.09 0.00 0.00 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 1.57 1.48 1.16 0.00 0.00 58 V 7.44 3.50 2.28 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 1.03 0.00 0.00 1.05 0.00 0.00 59 A 7.90 3.96 1.33 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 0.00 0.00 0.00 60 L 7.52 4.10 0.00 1.63 1.73 0.36 0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 61 G 8.16 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 0.00 0.00 0.00 62 A 8.01 4.36 1.33 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 0.00 0.00 0.00 63 S 7.73 4.40 0.00 4.06 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 64 G 8.28 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 65 F 8.18 4.28 0.00 3.04 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 66 A 7.36 4.80 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 W 8.73 4.37 0.00 3.42 2.95 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 68 T 8.39 5.01 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 1.18 0.00 0.00 69 E 8.82 3.98 0.00 2.05 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 2.38 2.36 0.00 70 E 8.16 3.98 0.00 2.06 2.04 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 2.45 2.41 0.00 71 D 8.45 4.67 0.00 3.44 3.30 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 72 I 8.34 3.30 2.03 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.67 0.59 0.74 0.00 0.00 73 A 7.99 4.08 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 T 7.89 4.06 4.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 75 Y 8.34 4.04 0.00 2.06 2.91 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 76 V 7.91 3.40 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.05 0.00 0.00 0.96 0.00 0.00 77 K 7.69 4.51 0.00 2.00 1.82 0.00 1.78 0.00 0.00 1.49 0.00 0.00 3.02 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.41 7.81 78 D 7.86 4.45 0.00 2.66 2.50 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 0.00 0.00 0.00 0.00 79 P 0.00 3.99 0.00 2.05 1.31 0.00 3.46 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.58 0.00 80 G 8.07 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 81 A 8.45 4.11 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.38 4.04 0.00 3.45 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 83 L 8.32 3.96 0.00 2.00 1.78 1.15 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 84 K 8.07 4.06 0.00 1.93 1.85 0.00 1.67 0.00 0.00 1.57 0.00 0.00 3.08 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.69 1.44 7.81 85 E 7.97 3.80 0.00 1.97 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 2.10 2.24 0.00 86 K 7.59 3.61 0.00 1.29 1.44 0.00 1.24 0.00 0.00 1.37 0.00 0.00 2.84 0.00 0.00 2.57 0.00 0.00 0.00 0.00 0.56 0.30 7.81 87 L 8.24 4.11 0.00 1.59 1.65 0.94 0.96 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 88 D 7.62 4.25 0.00 2.71 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 89 D 8.14 4.66 0.00 2.67 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 90 K 8.73 4.04 0.00 1.78 1.86 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.45 7.81 91 K 8.37 4.24 0.00 1.95 1.85 0.00 1.71 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.44 1.38 7.81 92 A 7.93 4.07 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 93 K 8.33 4.66 0.00 1.81 1.77 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.41 1.37 7.81 94 T 8.38 4.73 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 1.35 0.00 0.00 95 G 8.70 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 96 M 8.02 4.22 0.00 2.07 2.19 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.53 0.00 97 A 8.29 4.54 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 98 F 7.36 4.86 0.00 2.86 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 99 K 7.32 4.29 0.00 1.43 1.68 0.00 1.69 0.00 0.00 1.51 0.00 0.00 2.93 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.16 1.21 7.81 100 L 8.10 3.86 0.00 1.79 1.56 1.06 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.48 3.93 1.23 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 0.00 102 K 8.01 4.53 0.00 1.65 1.62 0.00 1.77 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.32 1.43 7.81 103 G 9.54 3.49 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 0.00 0.00 0.00 104 G 8.50 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 0.00 0.00 0.00 105 E 8.18 4.14 0.00 2.07 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 2.40 2.43 0.00 106 D 7.98 4.41 0.00 2.98 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 0.00 107 V 8.26 3.73 2.16 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 1.29 0.00 0.00 1.12 0.00 0.00 108 A 8.40 3.95 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 A 8.25 4.07 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 0.00 110 Y 8.33 4.14 0.00 3.19 3.19 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 0.00 111 L 7.84 3.41 0.00 1.71 1.52 0.88 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 112 A 7.47 4.01 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 0.00 113 S 7.87 4.11 0.00 4.06 4.32 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 0.00 114 V 7.13 3.47 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 0.53 0.00 0.00 0.37 0.00 0.00 115 V 7.17 3.98 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 -0.40 0.00 0.00 0.74 0.00 0.00 116 K 7.87 4.17 0.00 1.72 1.67 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.36 1.38 7.81