NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.3822 8.2493 123.5862 52.7237 20.0088 177.1279 3 T 4.2183 7.9261 111.7845 62.1055 70.7926 173.2302 4 L 4.4218 7.5980 124.5214 53.4131 41.5106 176.3186 5 R 4.8517 8.1934 118.3569 53.7492 32.4848 175.7554 6 S 5.0010 8.6667 114.4539 59.3678 63.8370 172.9547 7 F 4.8293 8.4186 114.4393 56.0171 41.5178 173.0882 8 V 3.9255 8.3941 120.5473 62.5338 31.2069 175.5475 9 L 3.9569 8.6305 131.3964 56.7925 42.4580 176.9265 10 V 4.1119 7.3293 118.5081 60.9310 33.1683 173.4978 11 D 4.9593 8.5455 127.6386 53.0296 41.0839 176.0447 12 N 4.6808 9.1145 131.1056 52.2986 38.0560 175.7166 13 G 3.9606 8.8996 109.7992 45.3639 0.0000 174.3516 14 G 4.1105 7.8406 107.0559 45.5008 0.0000 173.2125 15 T 4.0384 7.5156 110.1615 62.9137 68.8967 175.7903 16 G 4.0652 8.2606 109.8792 44.8679 0.0000 173.4786 17 N 4.4540 8.0157 117.9364 53.2356 39.4584 175.3772 18 V 3.9233 8.4771 124.1234 61.8750 32.4846 174.7313 19 T 4.8251 8.1901 124.8355 62.0745 70.6223 174.8220 20 V 4.5578 8.2414 123.2298 60.0525 34.7280 174.9159 21 V 5.0077 8.9515 116.6549 58.6706 35.4241 173.3033 22 P 4.2920 0.0000 0.0000 62.9537 31.1522 176.5958 23 V 4.4735 8.6071 122.0522 63.0970 34.0204 174.9713 24 S 4.5672 7.6567 112.6886 57.1792 66.1776 174.5877 25 N 5.3231 8.2494 116.5409 52.2105 38.9605 174.0944 26 A 4.3592 7.8882 121.4509 52.5984 20.2542 177.5181 27 N 4.0790 9.6389 117.1669 54.3496 36.2907 175.0820 28 G 3.7958 8.4403 102.1569 46.1892 0.0000 174.1483 29 V 4.5102 7.5947 120.1900 60.6081 33.4857 174.6734 30 A 4.5686 8.8611 131.0890 51.6266 20.0391 175.7799 31 E 5.1811 8.4857 121.6409 54.6162 32.9490 174.6535 32 W 5.3741 10.0871 127.3291 55.7500 32.2450 175.3067 33 L 5.3641 9.2533 120.9602 53.2957 45.9809 176.5232 34 S 4.6820 8.7050 117.7191 57.8919 64.6905 174.6369 35 N 4.6309 8.5002 119.3467 52.0692 36.9719 172.9134 36 N 4.9560 7.6799 119.2769 51.1670 43.4324 174.3922 37 S 4.3655 8.3374 113.6462 58.0648 63.7435 175.4557 38 R 4.0151 8.6797 121.4330 59.4966 29.8893 178.3714 39 S 4.3178 7.9967 110.7796 60.5676 63.1331 174.6737 40 Q 4.3905 8.5088 119.1963 55.4841 30.2332 174.3656 41 A 4.6578 7.8440 118.9288 50.8833 20.6571 177.7810 42 Y 4.1415 9.3371 118.7494 58.1412 39.3272 175.2056 43 R 5.2481 8.9026 122.4750 54.8214 34.3703 173.8801 44 V 5.2039 8.9522 124.3399 61.5463 35.3555 174.1447 45 T 5.6257 9.2231 115.9280 60.4535 72.6312 172.4492 46 A 5.9400 9.4862 123.3605 51.1083 23.2941 175.2763 47 S 5.0627 8.6807 112.9871 57.2687 66.8205 172.4256 48 Y 5.1270 8.6173 122.3203 56.2046 40.9507 174.3794 49 R 4.6173 8.4520 124.3093 54.0946 35.2043 174.5171 50 A 4.3706 8.2301 121.8375 51.8331 19.5040 177.1586 51 S 4.2234 8.4203 114.4414 57.7288 65.7720 175.4992 52 G 3.9159 8.8046 117.0462 45.0778 0.0000 172.5041 53 A 4.5693 8.3868 120.9208 52.2403 19.4964 177.7582 54 D 4.6905 7.5411 115.5780 53.0277 40.8209 174.7680 55 K 5.1129 8.0775 116.8278 56.1457 37.3972 175.1317 56 R 4.9302 8.9007 119.0905 54.5656 35.1483 174.6129 57 K 5.0949 8.8470 121.7630 55.3877 35.7192 174.5125 58 Y 5.2050 9.3715 125.6332 57.1407 40.5182 174.9500 59 T 5.1594 9.2155 119.2576 62.1057 72.4588 172.9309 60 I 5.2517 9.0117 127.4922 59.4060 40.9183 174.9679 61 K 5.1449 9.3518 125.0035 54.5487 36.3750 174.9659 62 L 5.1998 9.1435 125.6531 53.2805 45.7518 174.9007 63 E 4.7429 9.2326 124.6991 54.5810 32.9255 175.0032 64 V 4.1680 8.4398 126.2437 60.3796 33.2977 173.2550 65 P 4.5927 0.0000 0.0000 61.8982 33.3227 175.9540 66 K 3.6896 7.6634 122.6836 54.3213 32.5710 174.6798 67 I 4.0538 7.7333 127.7942 61.2474 37.5287 175.7577 68 V 4.4712 8.5722 119.6317 60.2071 36.9370 174.5271 69 T 4.7847 8.2638 118.4480 61.9472 69.6676 174.4315 70 Q 4.2680 8.7686 128.6392 55.9537 30.8163 175.4773 71 V 4.6742 8.1763 116.2549 59.9240 35.2570 175.5497 72 V 4.0743 8.5078 126.9245 61.6597 31.9425 175.0303 73 N 4.5069 9.1567 127.2211 54.4407 35.0754 176.3051 74 G 3.8949 8.2824 104.7596 45.8862 0.0000 174.8640 75 V 4.0483 7.1438 120.6449 61.7868 31.0016 173.0788 76 E 4.7235 8.4487 123.3146 55.5979 30.5480 176.0800 77 L 4.8715 8.7901 125.3434 52.0471 44.7619 173.8605 78 P 4.9016 0.0000 0.0000 62.4355 32.6047 175.4416 79 V 4.5829 8.6830 117.6279 60.0536 36.6073 173.3121 80 S 4.9664 8.3628 114.5796 56.7765 64.5531 174.1186 81 A 4.2195 8.5396 126.6000 54.6705 18.9001 176.9368 82 W 4.5112 6.6531 109.7890 56.3120 30.9398 173.5041 83 K 5.2414 9.1767 118.1073 54.6812 35.6962 175.7256 84 A 5.0191 8.8925 124.0265 50.5291 21.8730 175.2336 85 Y 5.2115 8.8388 117.3621 56.1156 41.4026 174.9526 86 A 4.9422 9.0368 124.3862 50.2616 22.6535 175.0157 87 S 5.0168 8.6322 114.7425 56.8301 65.7060 173.1417 88 I 4.7419 9.3860 127.4274 59.6025 40.8108 173.8966 89 D 5.3810 8.9357 126.1370 52.3855 43.3255 175.0890 90 L 4.8259 9.2545 126.0490 53.5266 44.8473 174.9416 91 T 5.2141 8.7351 122.5642 61.8854 71.1923 173.5915 92 I 4.8356 8.8092 126.9136 58.5653 41.3044 173.5116 93 P 4.9727 0.0000 0.0000 62.7488 32.2361 177.1477 94 I 3.8740 7.7726 114.2151 62.9656 37.4076 177.1118 95 F 4.2704 7.7754 120.5567 59.2363 39.2439 175.3185 96 A 4.0748 7.7355 123.4038 52.5918 18.3409 177.8080 97 A 4.5001 9.9248 126.5635 51.1611 21.2278 177.8188 98 T 3.8263 8.4395 111.3289 65.6881 68.3863 175.6531 99 D 4.4164 8.2479 121.7672 56.8768 40.7628 178.8364 100 D 4.3277 7.9595 118.3920 57.3531 40.9187 178.6091 101 V 3.5899 8.0458 118.9486 66.4839 31.5030 177.8065 102 T 3.8318 8.2171 115.7064 66.8230 68.2531 176.2944 103 V 3.5409 7.5525 119.2539 66.2143 31.4365 177.6289 104 I 3.7983 7.4503 119.0456 64.7628 36.9366 177.6971 105 S 4.0046 8.1267 113.4337 61.7500 62.1159 176.6252 106 K 3.9229 8.5052 120.8641 59.5853 31.8004 179.2828 107 S 4.1130 8.8115 116.2764 61.7655 62.8216 176.8638 108 L 3.9966 8.2739 121.3463 57.9788 41.2366 179.3940 109 A 4.1810 7.6584 118.8925 55.1363 18.5486 179.7345 110 G 3.6199 8.6030 104.4931 47.8373 0.0000 175.3306 111 L 3.7667 7.7601 122.5814 57.7282 42.0795 178.4679 112 F 4.6370 7.6551 113.2318 56.1481 39.9056 176.1206 113 K 3.9406 7.5369 121.4454 56.3082 32.5578 176.0052 114 V 3.8767 8.2277 125.3323 63.8657 31.7952 175.0572 115 G 4.0962 8.9773 116.4811 46.2345 0.0000 174.3402 116 N 4.7262 8.1924 117.0574 51.4805 40.9259 174.1053 117 P 4.2712 0.0000 0.0000 66.2662 31.4341 178.6216 118 I 3.8532 7.8979 117.3346 64.5587 36.9854 178.0185 119 A 4.0816 8.0520 120.7189 55.5928 18.2892 178.7938 120 E 3.8597 8.5169 116.8161 59.6499 29.4954 179.1633 121 A 3.9587 8.5479 120.5494 55.5857 18.4461 179.5094 122 I 3.6804 7.8899 117.9491 64.6396 37.1161 178.4609 123 S 4.5799 8.0424 110.7729 59.4122 62.6043 174.3471 124 S 4.5996 7.2264 114.3069 58.0164 63.7126 173.8098 125 Q 3.1667 7.9058 117.1101 57.9921 26.5952 173.2502 126 S 4.6180 8.1551 110.9216 56.4831 65.3506 171.9513 127 G 3.9286 7.9738 110.7467 44.1928 0.0000 173.7519 128 F 4.6378 8.1289 119.6557 57.5589 39.0833 176.5803 129 Y 4.3352 7.7468 119.6486 60.1400 38.2238 175.4238 130 A 4.2156 7.9699 126.5482 52.3502 18.5183 176.9691 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 A 8.25 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 3 T 7.93 4.22 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 1.23 0.00 0.00 4 L 7.60 4.42 0.00 1.54 1.60 0.22 0.66 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 5 R 8.19 4.85 0.00 2.04 1.93 0.00 3.16 0.00 0.00 3.58 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.76 0.00 6 S 8.67 5.00 0.00 3.97 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 7 F 8.42 4.83 0.00 3.03 3.05 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 8 V 8.39 3.93 2.07 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 0.71 0.00 0.00 0.90 0.00 0.00 9 L 8.63 3.96 0.00 1.11 1.41 0.87 0.76 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 10 V 7.33 4.11 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 0.92 0.00 0.00 0.72 0.00 0.00 11 D 8.55 4.96 0.00 2.61 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 12 N 9.11 4.68 0.00 2.78 2.75 0.00 0.00 6.82 8.79 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 13 G 8.90 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 14 G 7.84 4.11 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 0.00 15 T 7.52 4.04 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 1.20 0.00 0.00 16 G 8.26 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 17 N 8.02 4.45 0.00 2.57 2.70 0.00 0.00 6.68 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 18 V 8.48 3.92 1.61 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 0.08 0.00 0.00 0.61 0.00 0.00 19 T 8.19 4.83 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 1.19 0.00 0.00 20 V 8.24 4.56 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 0.06 0.00 0.00 0.88 0.00 0.00 21 V 8.95 5.01 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 0.82 0.00 0.00 1.03 0.00 0.00 22 P 0.00 4.29 0.00 1.83 1.65 0.00 3.67 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.10 0.00 23 V 8.61 4.47 2.07 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 0.79 0.00 0.00 1.02 0.00 0.00 24 S 7.66 4.57 0.00 3.86 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 25 N 8.25 5.32 0.00 2.51 2.67 0.00 0.00 7.29 7.96 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 26 A 7.89 4.36 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 27 N 9.64 4.08 0.00 2.86 2.89 0.00 0.00 6.99 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 8.44 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 29 V 7.59 4.51 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 1.00 0.00 0.00 1.01 0.00 0.00 30 A 8.86 4.57 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 E 8.49 5.18 0.00 2.06 1.73 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 2.26 2.36 0.00 32 W 10.09 5.37 0.00 3.28 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 33 L 9.25 5.36 0.00 1.55 1.53 0.95 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 34 S 8.70 4.68 0.00 3.93 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 35 N 8.50 4.63 0.00 2.67 2.77 0.00 0.00 6.73 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 36 N 7.68 4.96 0.00 2.71 2.67 0.00 0.00 7.24 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 8.34 4.37 0.00 3.99 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 38 R 8.68 4.02 0.00 1.82 2.07 0.00 3.39 0.00 0.00 3.28 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 39 S 8.00 4.32 0.00 3.95 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 40 Q 8.51 4.39 0.00 1.88 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.81 0.00 0.00 0.00 0.00 0.00 2.34 2.23 0.00 41 A 7.84 4.66 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 Y 9.34 4.14 0.00 2.86 2.87 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 43 R 8.90 5.25 0.00 1.88 1.72 0.00 3.08 0.00 0.00 3.47 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.77 0.00 44 V 8.95 5.20 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 0.83 0.00 0.00 0.93 0.00 0.00 45 T 9.22 5.63 4.43 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 1.34 0.00 0.00 46 A 9.49 5.94 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 0.00 0.00 0.00 0.00 0.00 47 S 8.68 5.06 0.00 3.97 4.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.62 5.13 0.00 2.70 2.78 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 49 R 8.45 4.62 0.00 1.68 1.64 0.00 3.15 0.00 0.00 3.14 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.52 0.00 50 A 8.23 4.37 1.08 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 51 S 8.42 4.22 0.00 3.83 3.62 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 0.00 52 G 8.80 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 53 A 8.39 4.57 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 54 D 7.54 4.69 0.00 2.61 2.80 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 55 K 8.08 5.11 0.00 1.88 1.68 0.00 1.61 0.00 0.00 1.67 0.00 0.00 2.87 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.37 1.42 7.81 56 R 8.90 4.93 0.00 1.67 1.41 0.00 2.97 0.00 0.00 2.88 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.60 0.00 57 K 8.85 5.09 0.00 1.73 1.57 0.00 1.63 0.00 0.00 1.66 0.00 0.00 2.88 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.61 7.81 58 Y 9.37 5.21 0.00 2.98 2.87 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 59 T 9.22 5.16 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 1.36 0.00 0.00 60 I 9.01 5.25 1.90 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.91 0.91 0.00 0.00 61 K 9.35 5.14 0.00 1.73 1.74 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.87 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.43 7.81 62 L 9.14 5.20 0.00 1.69 1.45 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.00 0.00 0.00 0.00 0.00 0.00 63 E 9.23 4.74 0.00 2.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.23 0.00 64 V 8.44 4.17 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 0.90 0.00 0.00 0.99 0.00 0.00 65 P 0.00 4.59 0.00 1.75 1.71 0.00 2.36 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 1.55 0.00 66 K 7.66 3.69 0.00 0.79 0.74 0.00 1.11 0.00 0.00 1.18 0.00 0.00 2.92 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.54 0.90 7.81 67 I 7.73 4.05 1.76 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.41 0.87 0.00 0.00 68 V 8.57 4.47 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 0.59 0.00 0.00 0.83 0.00 0.00 69 T 8.26 4.78 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 1.25 0.00 0.00 70 Q 8.77 4.27 0.00 2.13 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.75 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 71 V 8.18 4.67 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 0.74 0.00 0.00 0.93 0.00 0.00 72 V 8.51 4.07 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 1.00 0.00 0.00 0.93 0.00 0.00 73 N 9.16 4.51 0.00 2.92 2.92 0.00 0.00 7.18 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 74 G 8.28 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 75 V 7.14 4.05 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 0.95 0.00 0.00 1.00 0.00 0.00 76 E 8.45 4.72 0.00 2.00 1.95 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 2.27 2.33 0.00 77 L 8.79 4.87 0.00 1.59 1.57 0.92 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 78 P 0.00 4.90 0.00 2.16 2.04 0.00 3.72 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 1.93 1.97 0.00 79 V 8.68 4.58 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 0.95 0.00 0.00 80 S 8.36 4.97 0.00 3.59 3.59 0.00 0.00 0.00 0.00 0.00 0.00 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 8.54 4.22 0.97 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 82 W 6.65 4.51 0.00 3.41 3.20 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 0.00 83 K 9.18 5.24 0.00 1.50 1.18 0.00 1.75 0.00 0.00 1.50 0.00 0.00 2.65 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.15 1.39 7.81 84 A 8.89 5.02 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 85 Y 8.84 5.21 0.00 2.80 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 86 A 9.04 4.94 1.20 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 0.00 0.00 0.00 87 S 8.63 5.02 0.00 3.90 3.75 0.00 0.00 0.00 0.00 0.00 0.00 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 I 9.39 4.74 1.90 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.57 0.97 0.00 0.00 89 D 8.94 5.38 0.00 2.56 2.62 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 0.00 90 L 9.25 4.83 0.00 1.80 1.72 0.99 0.48 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 91 T 8.74 5.21 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 1.30 0.00 0.00 92 I 8.81 4.84 2.02 0.00 0.00 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 1.39 0.91 1.01 0.00 0.00 93 P 0.00 4.97 0.00 2.36 2.32 0.00 3.76 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.08 0.00 94 I 7.77 3.87 1.60 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 0.42 -0.36 0.75 0.00 0.00 95 F 7.78 4.27 0.00 3.15 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 96 A 7.74 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 97 A 9.92 4.50 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 98 T 8.44 3.83 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 1.23 0.00 0.00 99 D 8.25 4.42 0.00 2.72 2.80 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 0.00 100 D 7.96 4.33 0.00 2.97 2.75 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.05 3.59 2.25 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 1.05 0.00 0.00 1.05 0.00 0.00 102 T 8.22 3.83 4.44 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 1.20 0.00 0.00 103 V 7.55 3.54 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 1.03 0.00 0.00 0.97 0.00 0.00 104 I 7.45 3.80 2.10 0.00 0.00 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 1.43 0.71 0.91 0.00 0.00 105 S 8.13 4.00 0.00 3.81 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 0.00 106 K 8.51 3.92 0.00 1.92 1.83 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.44 1.66 7.81 107 S 8.81 4.11 0.00 3.93 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 0.00 108 L 8.27 4.00 0.00 1.84 1.80 0.91 1.01 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 0.00 109 A 7.66 4.18 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 0.00 110 G 8.60 3.62 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 0.00 0.00 0.00 0.00 111 L 7.76 3.77 0.00 1.48 1.78 0.62 0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 112 F 7.66 4.64 0.00 3.13 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 0.00 113 K 7.54 3.94 0.00 2.00 1.85 0.00 1.64 0.00 0.00 1.58 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.46 1.41 7.81 114 V 8.23 3.88 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 0.86 0.00 0.00 0.96 0.00 0.00 115 G 8.98 4.10 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 0.00 0.00 0.00 116 N 8.19 4.73 0.00 2.91 2.72 0.00 0.00 6.82 8.07 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 0.00 117 P 0.00 4.27 0.00 2.17 2.22 0.00 3.60 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.24 0.00 118 I 7.90 3.85 1.94 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.57 0.94 0.00 0.00 119 A 8.05 4.08 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 0.00 120 E 8.52 3.86 0.00 2.29 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 2.35 2.37 0.00 121 A 8.55 3.96 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 0.00 122 I 7.89 3.68 2.09 0.00 0.00 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 1.65 0.86 0.96 0.00 0.00 123 S 8.04 4.58 0.00 4.03 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 0.00 124 S 7.23 4.60 0.00 3.97 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 0.00 125 Q 7.91 3.17 0.00 2.12 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.72 0.00 0.00 0.00 0.00 0.00 2.30 2.25 0.00 126 S 8.16 4.62 0.00 3.82 3.62 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 0.00 127 G 7.97 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 0.00 128 F 8.13 4.64 0.00 2.86 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 0.00 129 Y 7.75 4.34 0.00 3.05 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 0.00 130 A 7.97 4.22 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