NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 R 4.1451 8.2544 117.2801 55.0516 29.6182 172.6160 10 L 4.4942 7.8160 123.9433 53.4351 44.6661 171.2519 11 K 4.6218 7.5446 125.0163 56.2565 36.5838 174.4428 12 S 4.6740 8.5312 113.9734 58.2357 64.0591 173.4378 13 S 4.4724 8.7927 113.3968 57.7652 64.1654 174.4762 14 C 4.8816 8.6843 121.2144 57.4056 38.2852 172.6598 15 K 4.5129 8.8499 123.6636 56.0811 36.1723 174.1042 16 R 4.7198 8.3607 121.2577 55.9554 31.0667 174.9929 17 H 4.9906 8.9900 122.7904 53.1465 32.2324 171.8117 18 P 4.4894 0.0000 0.0000 62.8284 32.5215 176.2676 19 L 4.0772 7.6975 121.7601 54.8485 44.7097 172.4252 20 Y 4.4962 8.2913 128.5980 56.0871 40.9867 174.0640 21 V 3.9194 7.1453 126.2189 60.8553 34.2361 173.6149 22 D 4.6363 8.2020 128.2981 52.7417 41.5568 177.0612 23 F 4.6341 8.4370 126.0764 60.4699 39.3841 177.9554 24 S 5.2968 8.6117 116.6687 60.7156 62.9974 176.3376 25 D 4.3235 8.2546 119.7619 56.8526 40.6060 177.5033 26 V 3.9275 7.7465 109.5677 60.2587 31.8990 175.7172 27 G 4.0595 7.5845 107.6196 47.1967 0.0000 174.6927 28 W 5.4600 9.6668 118.1483 55.5556 31.5147 178.0047 29 N 4.5655 8.3970 116.0148 54.7421 36.8892 176.7498 30 D 4.4106 8.4464 119.7389 55.4771 40.0209 177.7674 31 W 4.5200 8.1647 115.4040 56.1678 29.7102 175.1662 32 I 3.7308 6.8351 120.6302 59.3957 36.6324 175.7956 33 V 3.6584 8.4990 126.4379 65.3449 31.8056 176.0668 34 A 4.6628 7.3227 120.5369 50.0287 21.8327 174.2772 35 P 4.7772 0.0000 0.0000 61.5039 33.0887 174.3002 36 P 4.5829 0.0000 0.0000 65.3390 31.8676 175.6955 37 G 3.1786 7.5339 104.0696 47.2356 0.0000 171.2226 38 Y 4.4689 6.1595 114.7533 56.5417 41.6314 173.7671 39 H 4.5574 9.0884 118.2841 55.4168 27.9551 174.6527 40 A 4.3416 8.2652 126.5875 52.1978 20.1854 178.5658 41 F 4.2702 8.3615 114.0475 57.4294 38.2400 172.7553 42 Y 4.9379 8.3159 117.3507 57.1250 41.2992 172.5490 43 C 5.4177 8.5719 116.9220 55.8223 43.8255 172.9626 44 H 4.5692 8.5813 118.9317 56.1377 33.6650 171.6155 45 G 4.2583 8.6414 108.4332 43.2900 0.0000 173.7013 46 E 3.9668 8.3239 125.1264 56.5654 30.1596 175.5596 47 C 4.9469 8.3333 122.9069 54.1133 39.5498 171.8588 48 P 4.5428 0.0000 0.0000 62.5409 31.8472 177.1490 49 F 4.4601 8.8746 121.7795 61.1407 39.4981 175.4733 50 P 3.5568 0.0000 0.0000 62.4448 30.7357 176.6329 51 L 3.3297 7.6310 112.6507 54.8579 38.0823 173.0866 52 A 3.8286 8.0124 124.1146 52.4688 18.5134 177.6936 53 D 4.1409 8.4276 123.4210 56.8951 41.9634 176.9236 54 H 4.1227 8.1662 114.9537 58.2207 28.5709 175.3118 55 L 4.1828 6.5907 122.1565 54.5157 42.6411 175.7001 56 N 4.9803 8.7189 124.3437 52.3753 41.1148 173.5566 57 S 5.6264 8.6023 120.1128 55.7042 67.1214 174.1332 58 T 4.2461 8.4672 113.4202 60.9783 69.9106 175.1755 59 N 4.3150 8.7905 119.0905 56.6928 38.4210 177.0236 60 H 4.0062 8.2513 118.7599 59.2870 29.9926 176.6745 61 A 4.0587 7.8051 122.3494 55.4712 18.1233 179.7086 62 I 3.6514 7.7953 117.9347 64.5051 37.1964 178.7285 63 V 3.5778 7.9543 119.2671 66.2323 31.2786 177.8967 64 Q 3.9322 8.5366 119.5327 59.2452 28.6182 178.1672 65 T 3.8869 8.0963 116.5756 66.4654 68.9558 175.9959 66 L 4.0860 8.1031 122.1189 58.1535 42.1450 178.8962 67 V 3.5097 7.8209 118.2136 66.2688 31.2839 177.2116 68 N 5.0388 8.5490 118.2019 56.1657 38.4889 176.2894 69 S 4.1877 7.5386 112.7557 59.4943 63.3253 174.6185 70 V 4.1317 7.2823 120.7571 62.2346 32.7253 174.6021 71 N 4.3337 7.5716 114.6204 54.1586 41.6964 174.6288 72 S 4.5494 8.4218 121.2692 59.0086 63.5265 175.9191 73 K 3.8754 7.9218 120.0691 57.8296 32.0325 176.8065 74 I 4.4127 6.8605 120.1813 58.4711 38.6054 174.0502 75 P 4.3787 0.0000 0.0000 62.3899 31.7664 176.2799 76 K 4.2887 8.2611 120.1699 55.5497 33.0284 176.5458 77 A 4.2555 8.2071 122.0692 52.2598 18.8926 177.2310 78 C 4.2779 8.6956 121.8424 59.3202 33.5751 173.2355 79 C 5.0801 8.7146 124.4290 55.5252 39.0016 172.6017 80 V 4.6089 8.5191 118.7579 58.1180 35.3888 173.0051 81 P 4.9614 0.0000 0.0000 63.1054 31.2306 176.8123 82 T 4.5964 9.1014 113.2790 61.5144 70.9328 174.0240 83 E 4.6486 8.0608 121.7340 54.8638 33.3977 174.4448 84 L 5.5181 8.6411 123.5160 53.0542 45.8800 175.1918 85 S 4.7721 8.9466 113.1199 57.4661 66.8826 173.0348 86 A 5.3533 8.5153 122.3525 50.6593 21.4659 175.8412 87 I 4.7297 8.3552 111.1587 59.6608 41.3528 174.7103 88 S 5.2223 8.6306 119.1852 58.4620 64.4884 173.6777 89 M 4.9370 9.1094 121.7256 53.8466 36.6567 173.6171 90 L 5.1752 9.2112 126.4500 53.9516 44.1401 174.8793 91 Y 5.3919 8.8529 124.2797 55.7817 42.2839 173.2224 92 L 5.8088 8.9482 118.9798 52.0622 44.3076 177.3219 93 D 4.9052 8.5674 124.6129 52.6533 40.3968 176.4938 94 E 4.0183 8.7577 116.2042 58.8718 29.3614 177.1896 95 N 4.7391 9.5528 116.8713 52.6569 38.7406 174.5267 96 E 3.8328 8.2420 116.1853 57.3289 27.5833 174.2702 97 K 4.3916 7.9369 117.5407 55.4773 34.1481 176.1264 98 V 4.2244 8.2147 124.2689 62.2863 32.2519 175.1226 99 V 4.2001 8.5903 128.4078 60.7910 34.3883 174.1210 100 L 5.0846 8.4999 129.2136 53.4534 43.1618 174.8573 101 K 4.6537 9.1612 127.7263 54.4924 35.7122 174.6177 102 N 5.2119 8.6368 124.6870 52.4465 39.5126 173.4430 103 Y 4.3219 9.0058 125.5411 57.5159 39.0210 175.8468 104 Q 4.4675 8.8072 123.3966 55.3855 30.4197 174.8710 105 D 4.4969 8.5293 117.1728 56.1227 38.4971 175.0087 106 M 4.5314 8.3647 118.8848 56.3394 33.9444 177.2593 107 V 4.6403 8.1978 119.0935 60.9242 34.2805 175.2221 108 V 4.1309 8.7513 128.6072 63.0343 31.0565 175.2974 109 E 4.1137 9.5777 129.1882 58.2257 30.3105 177.3458 110 G 4.4926 7.6753 104.4981 43.3980 0.0000 171.9841 111 C 5.5357 8.5620 117.8115 55.3888 45.0826 173.0005 112 G 4.0752 9.1268 107.1855 46.2376 0.0000 170.9565 113 C 5.5148 8.8581 117.3610 55.4126 42.2905 174.9813 114 R 4.3017 8.7898 122.0384 56.4582 30.4929 175.0518 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 9 R 8.25 4.15 0.00 1.94 2.02 0.00 3.10 0.00 0.00 3.22 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.65 0.00 10 L 7.82 4.49 0.00 1.71 1.62 0.95 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 11 K 7.54 4.62 0.00 1.88 1.94 0.00 1.60 0.00 0.00 2.01 0.00 0.00 3.12 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.56 1.54 7.81 12 S 8.53 4.67 0.00 3.93 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 13 S 8.79 4.47 0.00 3.95 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 14 C 8.68 4.88 0.00 3.09 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 15 K 8.85 4.51 0.00 1.76 1.82 0.00 1.51 0.00 0.00 1.55 0.00 0.00 2.75 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.46 1.08 7.81 16 R 8.36 4.72 0.00 1.77 1.79 0.00 2.84 0.00 0.00 3.12 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 17 H 8.99 4.99 0.00 1.78 2.96 0.00 5.86 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 P 0.00 4.49 0.00 1.94 1.89 0.00 3.78 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.16 0.00 19 L 7.70 4.08 0.00 1.86 1.51 0.74 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.29 4.50 0.00 2.88 2.63 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 0.00 0.00 0.00 21 V 7.15 3.92 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 0.66 0.00 0.00 0.46 0.00 0.00 22 D 8.20 4.64 0.00 2.88 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 23 F 8.44 4.63 0.00 3.29 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 24 S 8.61 5.30 0.00 4.17 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 25 D 8.25 4.32 0.00 2.75 2.67 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 26 V 7.75 3.93 1.59 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 0.46 0.00 0.00 0.49 0.00 0.00 27 G 7.58 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 28 W 9.67 5.46 0.00 3.61 2.79 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 29 N 8.40 4.57 0.00 2.94 3.21 0.00 0.00 6.02 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 30 D 8.45 4.41 0.00 2.98 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 31 W 8.16 4.52 0.00 3.61 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 32 I 6.84 3.73 0.97 0.00 0.00 -0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 0.34 0.00 0.00 33 V 8.50 3.66 2.19 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 0.73 0.00 0.00 0.91 0.00 0.00 34 A 7.32 4.66 1.24 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 0.00 0.00 35 P 0.00 4.78 0.00 2.45 2.21 0.00 3.83 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.38 2.08 0.00 36 P 0.00 4.58 0.00 2.33 2.42 0.00 3.83 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 2.18 2.03 0.00 37 G 7.53 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 0.00 0.00 0.00 38 Y 6.16 4.47 0.00 2.96 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 39 H 9.09 4.56 0.00 3.14 3.09 0.00 5.88 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.27 4.34 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 F 8.36 4.27 0.00 3.23 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 42 Y 8.32 4.94 0.00 3.02 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 43 C 8.57 5.42 0.00 3.00 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 44 H 8.58 4.57 0.00 3.23 2.81 0.00 5.57 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 45 G 8.64 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 0.00 0.00 0.00 0.00 46 E 8.32 3.97 0.00 2.08 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 2.40 2.30 0.00 47 C 8.33 4.95 0.00 3.13 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 48 P 0.00 4.54 0.00 2.17 2.08 0.00 3.76 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 1.97 1.96 0.00 49 F 8.87 4.46 0.00 3.09 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 50 P 0.00 3.56 0.00 1.95 1.88 0.00 3.84 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.92 0.00 51 L 7.63 3.33 0.00 1.60 1.57 0.89 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.01 3.83 1.09 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 0.00 0.00 53 D 8.43 4.14 0.00 2.61 2.63 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 0.00 0.00 0.00 54 H 8.17 4.12 0.00 3.25 3.47 0.00 5.77 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 6.59 4.18 0.00 1.68 1.63 0.94 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 56 N 8.72 4.98 0.00 2.80 2.64 0.00 0.00 6.96 7.63 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 57 S 8.60 5.63 0.00 3.73 3.69 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 58 T 8.47 4.25 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 59 N 8.79 4.31 0.00 2.77 2.93 0.00 0.00 6.43 8.16 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 60 H 8.25 4.01 0.00 3.27 3.33 0.00 5.89 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 7.81 4.06 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 62 I 7.80 3.65 2.07 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 1.41 0.83 0.93 0.00 0.00 63 V 7.95 3.58 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 0.95 0.00 0.00 0.96 0.00 0.00 64 Q 8.54 3.93 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.58 0.00 0.00 0.00 0.00 0.00 2.48 2.39 0.00 65 T 8.10 3.89 4.51 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 1.47 0.00 0.00 66 L 8.10 4.09 0.00 2.01 1.90 1.12 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 67 V 7.82 3.51 2.19 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 0.96 0.00 0.00 0.98 0.00 0.00 68 N 8.55 5.04 0.00 2.84 3.08 0.00 0.00 6.51 7.72 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 69 S 7.54 4.19 0.00 3.40 3.31 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 70 V 7.28 4.13 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 0.74 0.00 0.00 0.79 0.00 0.00 71 N 7.57 4.33 0.00 2.69 2.69 0.00 0.00 7.10 7.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 72 S 8.42 4.55 0.00 3.90 3.85 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 73 K 7.92 3.88 0.00 1.69 1.86 0.00 1.68 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.64 1.55 7.81 74 I 6.86 4.41 1.86 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 1.29 0.82 0.91 0.00 0.00 75 P 0.00 4.38 0.00 2.05 2.00 0.00 3.68 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 2.04 2.12 0.00 76 K 8.26 4.29 0.00 1.76 1.79 0.00 1.77 0.00 0.00 1.74 0.00 0.00 3.21 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.65 1.45 7.81 77 A 8.21 4.26 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 78 C 8.70 4.28 0.00 3.05 2.82 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 79 C 8.71 5.08 0.00 3.15 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 8.52 4.61 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 0.70 0.00 0.00 0.96 0.00 0.00 81 P 0.00 4.96 0.00 1.99 2.04 0.00 3.68 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 2.10 2.16 0.00 82 T 9.10 4.60 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 83 E 8.06 4.65 0.00 2.02 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 0.00 2.28 2.38 0.00 84 L 8.64 5.52 0.00 1.51 1.70 0.96 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 85 S 8.95 4.77 0.00 3.89 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 86 A 8.52 5.35 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 87 I 8.36 4.73 1.83 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.70 0.89 0.00 0.00 88 S 8.63 5.22 0.00 3.82 3.88 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 89 M 9.11 4.94 0.00 1.56 1.68 0.00 0.00 0.00 0.00 0.00 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.29 0.00 90 L 9.21 5.18 0.00 1.72 1.52 0.92 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.85 5.39 0.00 3.17 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 92 L 8.95 5.81 0.00 1.65 1.65 0.97 1.08 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 93 D 8.57 4.91 0.00 3.00 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 94 E 8.76 4.02 0.00 2.08 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 0.00 2.27 2.26 0.00 95 N 9.55 4.74 0.00 2.69 2.85 0.00 0.00 7.02 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 96 E 8.24 3.83 0.00 2.14 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 2.25 2.42 0.00 97 K 7.94 4.39 0.00 1.86 1.65 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.41 7.81 98 V 8.21 4.22 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 0.67 0.00 0.00 0.89 0.00 0.00 99 V 8.59 4.20 0.67 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 0.80 0.00 0.00 0.60 0.00 0.00 100 L 8.50 5.08 0.00 1.63 1.55 0.95 0.54 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 0.00 101 K 9.16 4.65 0.00 2.09 1.93 0.00 1.49 0.00 0.00 0.61 0.00 0.00 2.33 0.00 0.00 2.38 0.00 0.00 0.00 0.00 0.94 1.20 7.81 102 N 8.64 5.21 0.00 2.78 2.75 0.00 0.00 7.07 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 0.00 103 Y 9.01 4.32 0.00 2.92 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 0.00 104 Q 8.81 4.47 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.85 6.91 0.00 0.00 0.00 0.00 0.00 2.35 2.33 0.00 105 D 8.53 4.50 0.00 2.89 2.82 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 0.00 106 M 8.36 4.53 0.00 1.74 2.12 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.80 0.00 107 V 8.20 4.64 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 1.18 0.00 0.00 1.30 0.00 0.00 108 V 8.75 4.13 2.33 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 0.81 0.00 0.00 1.06 0.00 0.00 109 E 9.58 4.11 0.00 1.87 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 2.30 2.39 0.00 110 G 7.68 4.49 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 0.00 111 C 8.56 5.54 0.00 2.82 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 0.00 112 G 9.13 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 0.00 113 C 8.86 5.51 0.00 2.90 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 0.00 114 R 8.79 4.30 0.00 1.64 1.76 0.00 3.37 0.00 0.00 3.28 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.72 0.00