NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.4172 8.2985 121.7428 55.9508 31.4317 174.4521 3 A 4.5268 8.6174 128.6111 50.9653 19.3455 171.4852 4 V 4.1154 8.9197 123.5380 61.8000 33.0416 173.6786 5 K 4.8489 8.4551 128.1937 55.0463 35.0131 175.1018 6 T 4.5593 9.0342 120.3437 61.3057 70.5304 172.5342 7 D 4.7723 8.6508 126.6273 53.5735 39.6332 177.0283 8 R 4.2923 7.7635 116.8261 56.8404 30.4271 175.7965 9 A 4.7219 7.3777 119.4643 49.3309 22.3744 174.0821 10 P 4.1722 0.0000 0.0000 62.8706 31.7630 176.8252 11 A 3.9979 8.5093 125.5196 52.2173 18.8500 177.6268 12 A 3.9515 8.0365 123.9700 50.4290 17.1573 176.3395 13 I 4.0338 9.0555 121.2397 63.4625 37.0603 176.2960 14 G 3.9329 7.9822 113.8965 44.0145 0.0000 170.2814 15 P 4.6612 0.0000 0.0000 62.2686 31.0905 175.3970 16 Y 4.8319 7.5292 114.2686 55.9027 41.0226 172.8643 17 A 4.7717 8.2602 122.1665 49.9615 21.9095 176.3482 18 Q 4.4118 8.6402 119.1311 59.4108 29.9772 176.5110 19 A 5.0330 7.5986 117.0855 51.4285 22.7680 175.4252 20 V 5.0103 9.2028 119.3198 60.9733 35.3481 174.2237 21 K 5.2637 8.8494 126.6546 55.2662 34.2638 175.4073 22 A 4.5982 9.5609 126.3434 51.5708 22.3478 175.5361 23 G 4.2875 9.9772 105.9679 46.4203 0.0000 174.7828 24 G 3.7553 8.6492 108.0025 44.3421 0.0000 173.2142 25 F 5.2030 8.8365 117.8120 55.4031 43.6967 174.0548 26 V 4.7564 8.8989 119.2343 61.4197 34.3326 174.0749 27 F 4.9745 9.9560 128.0948 56.1676 40.8446 174.9252 28 V 4.8606 8.5751 124.5867 61.0370 33.4516 175.5466 29 S 4.5655 9.1843 124.4500 58.0990 63.6707 174.4465 30 G 3.9141 8.6280 109.3108 46.5596 0.0000 172.5900 31 Q 5.0340 9.3502 123.9133 53.9777 31.5526 174.7964 32 I 4.9370 8.1220 115.3212 57.3082 41.3310 174.2198 33 P 4.7117 0.0000 0.0000 62.9614 28.7940 176.6124 34 L 5.1156 7.5337 118.1684 52.6625 44.9260 177.3696 35 A 4.3137 8.8003 126.6162 50.9212 19.1589 176.3655 36 P 4.2456 0.0000 0.0000 65.8209 31.4974 176.9965 37 D 4.6682 8.1487 116.3948 53.3450 39.3950 178.4075 38 G 3.9934 8.1689 109.5768 46.3211 0.0000 174.8244 39 S 4.1531 7.4986 115.5592 58.4394 63.6632 173.2427 40 L 4.6178 8.4257 129.0281 53.8814 42.0235 175.9451 41 V 3.8572 8.4352 127.7852 62.8127 31.9335 175.2986 42 E 4.6452 9.9647 126.5439 54.4041 32.4310 175.4002 43 G 3.9872 8.3145 106.2568 43.5213 0.0000 172.3916 44 D 4.7024 8.2656 120.6293 52.1953 40.7086 176.8701 45 I 3.7230 8.4922 112.5367 64.5780 36.6693 177.8224 46 R 3.8452 7.5124 118.7156 59.0361 29.6991 178.3831 47 V 3.7673 8.0403 117.6382 65.3645 31.7193 178.0984 48 Q 4.1358 7.9733 117.4631 59.1588 28.5005 178.3542 49 T 4.0009 8.5114 116.2970 66.6253 68.5519 175.8067 50 E 4.0020 7.5326 120.1485 59.3257 29.9158 178.6383 51 R 4.0640 7.5900 117.3270 59.1296 30.1168 179.2595 52 V 3.4681 7.7658 115.4570 63.6453 31.3100 177.3094 *54 E 4.1824 8.1899 118.7095 55.9450 31.6223 178.0621 55 N 4.3196 8.1557 116.2379 56.2839 38.5079 177.3234 56 L 3.9918 7.9648 120.3763 57.5980 41.6171 179.5015 57 K 3.8468 7.9119 118.7036 59.5141 32.2516 178.4729 58 A 3.9806 8.1166 121.0817 55.1560 18.1669 179.8480 59 V 3.5592 8.0543 116.8517 66.1159 31.6877 178.2594 60 L 4.0374 8.0990 118.8083 57.7936 41.4013 179.3472 61 E 4.1878 8.7999 119.9123 58.9789 29.2855 179.3331 62 A 4.0816 7.9832 118.7367 54.4820 18.3916 178.4066 63 A 4.4855 7.4476 117.6373 51.4126 18.6324 177.3302 64 G 3.8910 8.4986 106.9444 46.9372 0.0000 173.3740 65 S 4.6599 7.8390 116.3774 58.1829 64.1933 171.9949 66 G 3.9557 8.0061 105.8443 45.3723 0.0000 173.7972 67 L 4.0606 7.9864 118.7467 57.7464 41.5687 179.9467 68 S 4.3359 8.0578 111.1853 60.2808 63.2554 174.7097 69 R 4.3932 7.7622 119.4493 55.8486 30.3089 175.8738 70 V 4.2035 7.7729 119.6961 63.0247 31.9071 175.9366 71 V 4.2829 8.7336 120.4715 62.3257 33.5420 175.5885 72 Q 5.2041 7.7400 120.6186 54.9838 32.5079 173.1482 73 T 5.1728 8.9950 114.9049 60.2978 72.9704 172.7331 74 T 4.4910 9.1884 120.7809 62.1467 71.4150 172.6960 75 C 5.0607 8.8261 125.4170 57.8842 30.8354 172.9870 76 F 5.2297 9.0353 123.0122 55.6436 41.2182 174.8885 77 L 5.2268 8.8551 122.5329 52.9705 44.8426 177.1309 78 A 4.3645 8.4455 121.8910 53.9279 19.7293 176.7068 79 D 4.3181 7.4191 113.0330 53.8002 43.3376 174.5402 *81 E 4.5726 8.6527 115.3546 56.6206 31.4810 176.6551 82 D 4.7637 8.5129 118.0630 54.2102 40.8574 177.7667 83 F 4.1409 8.1501 123.2611 60.9007 39.3353 174.8493 84 P 4.4634 0.0000 0.0000 65.7257 31.2300 178.6566 85 G 3.6410 8.0844 103.7208 47.7139 0.0000 175.1169 86 F 4.1262 8.2579 123.0081 61.2024 39.4191 176.7455 87 N 3.6839 8.3336 117.6803 56.1928 38.3188 176.3711 88 E 3.8207 7.9785 120.2851 59.3065 30.1127 178.7628 89 V 3.7454 7.5064 117.7391 66.0028 31.4776 176.9892 90 Y 4.0010 7.9901 119.5132 60.9885 38.1671 178.0909 91 A 4.0705 8.2983 121.4140 55.3915 18.0940 179.8930 92 R 3.8170 7.7293 115.7178 59.6403 30.2583 177.9492 93 Y 3.8986 7.5279 114.0792 59.0727 38.2912 175.5677 94 F 4.9270 7.2366 118.5038 55.8301 41.1411 175.1685 95 T 4.5382 8.2037 119.2527 60.6414 71.6565 172.3916 96 P 3.7800 0.0000 0.0000 61.8796 31.7448 174.5950 97 P 4.2744 0.0000 0.0000 62.2617 31.6045 176.1776 98 Y 4.4077 8.2161 121.2387 57.3671 38.4749 174.0308 99 P 4.6672 0.0000 0.0000 62.2228 32.6998 175.8354 100 A 4.4204 8.8055 123.4466 51.8997 19.7283 176.7370 101 R 5.2363 8.6321 119.1773 53.5274 34.0896 174.1249 102 A 4.6802 8.2581 123.7560 50.5668 22.6074 175.0611 103 T 4.9491 8.3611 118.0583 61.8811 72.0711 173.8126 104 V 4.5336 8.4192 117.7757 59.7030 36.8316 173.7444 105 A 5.0232 8.4980 124.0651 50.7234 20.3348 176.9657 106 V 4.3417 8.5461 116.1466 59.1154 34.2797 176.3644 107 K 3.9760 8.7564 122.4840 59.3589 32.1854 176.6624 108 A 4.4604 7.2932 116.6469 51.3865 21.6484 174.9010 109 L 4.7353 7.8801 119.5090 51.6214 45.0652 174.4687 110 P 4.2417 0.0000 0.0000 64.6074 31.5753 176.9989 111 R 3.9861 9.3544 120.1358 57.3667 27.6274 176.8445 112 G 3.9404 8.0388 102.6283 45.9085 0.0000 175.0867 113 V 3.8120 7.2605 118.1626 62.0124 32.0434 176.2733 114 R 4.5194 9.0439 119.1978 57.3880 31.3848 176.8229 115 V 4.9152 7.5272 117.1498 60.1944 34.5953 173.7790 116 E 4.9861 9.2693 123.8812 54.6231 33.2551 174.0952 117 V 4.8718 8.9531 125.9167 61.1839 34.9236 174.0199 118 A 5.3622 8.9653 128.9927 50.6594 22.6698 174.3566 119 C 5.1315 8.3933 111.8861 57.3714 33.9843 172.8032 120 V 4.8371 9.0720 118.8241 61.1301 34.3547 174.1180 121 A 5.2918 8.7286 127.7172 50.1502 23.2426 174.7654 122 L 4.4949 8.6177 118.9874 54.3315 42.6450 177.2792 123 A 4.4536 8.2381 124.4965 51.0219 20.6918 177.5190 124 E 4.1340 7.8479 114.4724 56.6567 29.6992 176.6550 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 E 8.30 4.42 0.00 2.09 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 2.30 2.35 0.00 3 A 8.62 4.53 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 4 V 8.92 4.12 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 0.77 0.00 0.00 1.02 0.00 0.00 5 K 8.46 4.85 0.00 1.73 1.61 0.00 1.83 0.00 0.00 1.62 0.00 0.00 2.88 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.38 7.81 6 T 9.03 4.56 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 1.31 0.00 0.00 7 D 8.65 4.77 0.00 2.80 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 8 R 7.76 4.29 0.00 1.87 2.01 0.00 3.13 0.00 0.00 3.23 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.57 0.00 9 A 7.38 4.72 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 P 0.00 4.17 0.00 2.11 2.08 0.00 3.73 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.39 0.00 11 A 8.51 4.00 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 12 A 8.04 3.95 0.76 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 0.00 0.00 13 I 9.06 4.03 1.91 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 1.35 0.48 0.92 0.00 0.00 14 G 7.98 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 15 P 0.00 4.66 0.00 2.14 2.12 0.00 3.86 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.11 0.00 16 Y 7.53 4.83 0.00 3.20 3.02 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 17 A 8.26 4.77 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 18 Q 8.64 4.41 0.00 2.20 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.73 0.00 0.00 0.00 0.00 0.00 2.50 2.37 0.00 19 A 7.60 5.03 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 20 V 9.20 5.01 2.21 0.00 0.00 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 0.99 0.00 0.00 21 K 8.85 5.26 0.00 1.85 1.85 0.00 1.72 0.00 0.00 1.74 0.00 0.00 2.80 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.60 1.41 7.81 22 A 9.56 4.60 1.38 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 0.00 0.00 0.00 23 G 9.98 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 0.00 0.00 0.00 0.00 24 G 8.65 3.76 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 0.00 0.00 0.00 25 F 8.84 5.20 0.00 2.62 2.54 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 0.00 0.00 0.00 0.00 26 V 8.90 4.76 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 1.04 0.00 0.00 0.95 0.00 0.00 27 F 9.96 4.97 0.00 3.02 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 V 8.58 4.86 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 1.05 0.00 0.00 1.01 0.00 0.00 29 S 9.18 4.57 0.00 4.05 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 30 G 8.63 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 31 Q 9.35 5.03 0.00 1.99 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.54 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00 32 I 8.12 4.94 1.89 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 1.36 0.69 0.91 0.00 0.00 33 P 0.00 4.71 0.00 2.11 2.10 0.00 3.55 0.00 0.00 3.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.30 0.00 34 L 7.53 5.12 0.00 1.61 1.57 0.95 0.95 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 35 A 8.80 4.31 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 36 P 0.00 4.25 0.00 2.05 2.36 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.17 0.00 37 D 8.15 4.67 0.00 2.83 2.88 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 38 G 8.17 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 39 S 7.50 4.15 0.00 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 0.00 40 L 8.43 4.62 0.00 1.70 1.60 0.93 0.96 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 41 V 8.44 3.86 2.24 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 0.81 0.00 0.00 0.94 0.00 0.00 42 E 9.96 4.65 0.00 1.97 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 2.21 2.45 0.00 43 G 8.31 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 44 D 8.27 4.70 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 45 I 8.49 3.72 1.98 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.71 0.99 0.00 0.00 46 R 7.51 3.85 0.00 1.97 2.00 0.00 3.09 0.00 0.00 3.10 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 47 V 8.04 3.77 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 1.01 0.00 0.00 1.04 0.00 0.00 48 Q 7.97 4.14 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.67 0.00 0.00 0.00 0.00 0.00 2.47 2.77 0.00 49 T 8.51 4.00 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 1.32 0.00 0.00 50 E 7.53 4.00 0.00 1.87 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 0.00 2.36 2.43 0.00 51 R 7.59 4.06 0.00 2.02 2.10 0.00 3.43 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 1.61 1.67 0.00 52 V 7.77 3.47 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 1.16 0.00 0.00 1.08 0.00 0.00 *54 E 8.19 4.18 0.00 2.01 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 2.41 2.29 0.00 55 N 8.16 4.32 0.00 2.96 2.88 0.00 0.00 6.96 6.87 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 56 L 7.96 3.99 0.00 1.63 1.75 1.09 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 57 K 7.91 3.85 0.00 1.77 1.97 0.00 1.80 0.00 0.00 1.85 0.00 0.00 3.23 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.51 7.81 58 A 8.12 3.98 1.37 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 59 V 8.05 3.56 2.12 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 1.08 0.00 0.00 1.04 0.00 0.00 60 L 8.10 4.04 0.00 1.95 1.81 1.06 0.84 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 61 E 8.80 4.19 0.00 2.21 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 2.33 2.26 0.00 62 A 7.98 4.08 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 63 A 7.45 4.49 1.38 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 0.00 0.00 0.00 64 G 8.50 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 65 S 7.84 4.66 0.00 3.83 3.77 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 66 G 8.01 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 67 L 7.99 4.06 0.00 1.63 1.61 0.90 0.28 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 68 S 8.06 4.34 0.00 3.97 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 69 R 7.76 4.39 0.00 2.05 2.08 0.00 3.65 0.00 0.00 3.07 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 70 V 7.77 4.20 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 0.80 0.00 0.00 1.20 0.00 0.00 71 V 8.73 4.28 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 0.73 0.00 0.00 1.05 0.00 0.00 72 Q 7.74 5.20 0.00 2.07 1.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.86 0.00 0.00 0.00 0.00 0.00 2.32 2.34 0.00 73 T 8.99 5.17 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 1.11 0.00 0.00 74 T 9.19 4.49 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 0.87 0.00 0.00 75 C 8.83 5.06 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 76 F 9.04 5.23 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 77 L 8.86 5.23 0.00 1.48 1.45 0.93 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 78 A 8.45 4.36 1.27 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 0.00 0.00 0.00 79 D 7.42 4.32 0.00 2.72 2.68 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 *81 E 8.65 4.57 0.00 2.23 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 0.00 2.23 2.45 0.00 82 D 8.51 4.76 0.00 2.79 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 83 F 8.15 4.14 0.00 3.19 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 84 P 0.00 4.46 0.00 2.22 2.12 0.00 3.84 0.00 0.00 4.01 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 85 G 8.08 3.64 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 0.00 86 F 8.26 4.13 0.00 3.06 3.10 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 87 N 8.33 3.68 0.00 1.57 2.37 0.00 0.00 6.95 7.53 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 88 E 7.98 3.82 0.00 2.00 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 0.00 2.30 2.29 0.00 89 V 7.51 3.75 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 1.10 0.00 0.00 1.07 0.00 0.00 90 Y 7.99 4.00 0.00 2.37 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 91 A 8.30 4.07 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.73 3.82 0.00 1.57 1.54 0.00 3.13 0.00 0.00 3.08 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.79 0.00 93 Y 7.53 3.90 0.00 2.35 2.51 0.00 0.00 0.00 0.00 0.00 0.00 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 F 7.24 4.93 0.00 3.11 3.12 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 95 T 8.20 4.54 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 96 P 0.00 3.78 0.00 1.82 1.72 0.00 3.43 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.17 0.00 97 P 0.00 4.27 0.00 2.04 2.00 0.00 3.64 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.07 0.00 98 Y 8.22 4.41 0.00 3.01 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 99 P 0.00 4.67 0.00 1.74 1.89 0.00 3.61 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.04 2.18 0.00 100 A 8.81 4.42 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 0.00 101 R 8.63 5.24 0.00 1.73 1.69 0.00 2.72 0.00 0.00 2.25 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.36 0.00 102 A 8.26 4.68 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 0.00 103 T 8.36 4.95 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 1.17 0.00 0.00 104 V 8.42 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 0.62 0.00 0.00 0.89 0.00 0.00 105 A 8.50 5.02 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 0.00 106 V 8.55 4.34 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 0.86 0.00 0.00 1.06 0.00 0.00 107 K 8.76 3.98 0.00 1.70 1.82 0.00 1.80 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.41 1.43 7.81 108 A 7.29 4.46 1.17 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 0.00 109 L 7.88 4.74 0.00 1.83 1.51 0.99 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.24 0.00 2.12 1.93 0.00 3.72 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 2.10 2.02 0.00 111 R 9.35 3.99 0.00 1.92 1.99 0.00 3.37 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.59 0.00 112 G 8.04 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 0.00 0.00 0.00 113 V 7.26 3.81 2.29 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 0.78 0.00 0.00 0.94 0.00 0.00 114 R 9.04 4.52 0.00 1.86 2.02 0.00 3.24 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.75 0.00 115 V 7.53 4.92 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 0.73 0.00 0.00 0.99 0.00 0.00 116 E 9.27 4.99 0.00 2.04 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 0.00 2.27 2.24 0.00 117 V 8.95 4.87 2.29 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 1.17 0.00 0.00 1.24 0.00 0.00 118 A 8.97 5.36 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.39 5.13 0.00 3.32 3.13 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 0.00 120 V 9.07 4.84 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 0.61 0.00 0.00 0.85 0.00 0.00 121 A 8.73 5.29 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 0.00 122 L 8.62 4.49 0.00 1.50 1.46 0.89 0.26 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 0.00 123 A 8.24 4.45 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 0.00 124 E 7.85 4.13 0.00 1.99 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 2.44 2.39 0.00 * Residues marked with a * may have inaccurate shift predictions.