NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 5 P 4.3438 0.0000 0.0000 62.3557 32.8372 176.5101 6 T 3.8839 8.1541 111.8260 60.9149 70.5599 173.7639 7 I 3.6897 8.3013 120.4558 64.0921 38.3824 178.1204 8 N 4.2636 8.1800 117.4816 56.9386 38.6882 176.2987 9 Q 3.9699 9.2554 120.0640 59.2301 29.0203 178.7217 10 L 3.9379 7.7740 119.1556 58.1709 41.4522 180.0403 11 V 3.5755 7.5341 116.8681 66.8553 31.6834 177.6756 12 R 3.8940 8.2731 117.6998 58.1088 29.7019 178.3047 13 K 3.9755 8.0290 123.5112 58.5109 33.0058 178.6613 14 G 3.9741 7.2692 100.9997 45.4859 0.0000 173.3220 15 R 4.2303 8.0999 118.4363 54.1718 29.6806 176.4261 16 E 4.0341 8.6354 124.7262 55.9893 30.6905 178.4137 17 K 4.5588 8.4059 127.1242 55.9799 32.0822 174.6398 18 V 4.1568 8.2245 117.9651 63.3233 34.2244 174.1488 19 R 5.1193 8.1115 133.5332 57.2333 32.2062 174.6043 20 K 4.4296 8.2689 125.1557 55.5949 34.2715 175.9839 21 K 4.3174 8.2135 120.2444 54.6842 33.3801 176.5443 22 S 4.1319 8.4970 118.1430 58.3939 61.1342 174.3285 23 K 3.8592 8.4231 124.0676 56.9631 31.8765 177.6541 24 V 3.9050 8.1486 116.2884 61.8337 33.5619 171.4696 25 P 4.5274 0.0000 0.0000 61.8676 29.3489 177.3096 26 A 4.1986 7.8951 119.5070 52.9752 18.4036 174.7551 27 L 3.1119 8.8239 125.2778 55.9128 40.6159 174.6967 28 K 3.8328 8.9195 122.5031 56.0798 30.5584 175.0156 29 G 4.0383 8.2450 102.0444 45.7408 0.0000 173.8849 30 A 4.1174 7.4327 120.9378 50.7652 18.7197 176.7000 31 P 3.7345 0.0000 0.0000 65.1255 31.6309 177.0947 32 F 5.0114 7.2361 114.0864 56.9067 43.4092 172.9543 33 R 4.7430 8.6526 117.4197 55.7280 33.7486 175.1196 34 R 4.8137 8.8398 125.5673 56.6741 31.8603 174.9288 35 G 4.3870 8.5326 109.1537 45.7962 0.0000 172.1414 36 V 4.9740 8.3522 120.1562 60.6933 34.4656 174.6169 37 C 4.6197 9.2890 125.2374 60.6164 28.4836 173.9954 38 T 4.2469 9.2037 118.7597 63.4732 68.4174 174.8148 39 V 4.5803 7.4674 118.8202 61.2515 35.7054 173.9786 40 V 4.7101 8.2744 124.3017 61.3982 34.1001 174.1472 41 R 4.7289 9.1473 127.4024 55.2965 34.6912 172.8354 42 T 5.0043 8.4885 115.2110 60.3797 69.1302 173.4892 43 V 4.6797 8.8288 122.8653 59.4106 34.9390 175.4423 44 T 4.4788 8.4886 114.8965 60.9394 69.6178 172.4324 45 P 4.6505 0.0000 0.0000 61.5242 32.6132 178.4792 46 K 4.5755 8.2404 128.1161 56.1812 31.8774 178.3035 47 K 3.8264 9.1448 121.3640 57.7965 30.8295 175.1037 48 P 4.4867 0.0000 0.0000 63.2910 31.9247 176.3273 49 N 5.0312 7.8747 116.0629 51.6695 41.0241 173.8540 50 S 4.7189 8.2793 115.7794 56.1279 65.9208 173.7471 51 A 4.4668 8.0300 128.2161 53.0295 23.0272 178.0565 52 L 4.8914 8.2659 106.2200 54.4728 43.3182 175.4668 53 R 4.1654 8.6675 120.6717 56.3984 32.0707 176.6428 54 K 4.8678 8.8594 122.9165 55.7555 33.5398 176.1455 55 V 5.0112 8.8040 117.9466 59.8862 36.7214 174.4084 56 A 4.9378 8.7751 121.4293 51.1891 23.0176 175.8753 57 K 4.5614 8.8403 122.7514 55.9753 33.6413 176.2640 58 V 4.7731 9.0915 125.0460 61.0305 34.7900 174.3774 59 R 4.6258 9.0026 128.5052 55.0558 30.7604 175.8424 60 L 4.8183 9.2062 127.9771 54.3427 42.2357 177.8934 61 T 4.0547 8.2728 111.1489 64.8634 69.0155 175.9206 62 S 4.4392 8.0325 117.2681 58.2324 62.9705 177.1643 63 G 4.0083 8.4236 111.4904 48.4261 0.0000 174.5987 64 Y 4.2377 8.6490 117.2245 57.9152 39.3873 175.1716 65 E 5.4606 8.6139 121.7273 53.8750 32.0098 174.8601 66 V 4.7638 8.1296 119.6262 59.3317 36.2578 175.1912 67 T 4.6934 8.5595 112.6909 61.7049 69.8127 173.7585 68 A 5.1044 9.0472 125.2881 50.5072 22.9773 174.5144 69 Y 4.8319 9.2829 122.1715 56.8328 41.0557 174.7243 70 I 4.2491 6.6657 125.2986 58.5819 38.9816 173.8628 71 P 3.8932 0.0000 0.0000 62.5944 31.8833 176.7758 72 G 3.6230 7.8587 108.4027 45.1073 0.0000 172.6537 73 E 4.3495 8.8032 118.0320 57.1373 30.2069 176.1153 74 G 3.9845 9.7582 112.6198 46.2287 0.0000 171.1804 75 H 4.9813 8.3171 118.0879 53.9798 31.6774 172.6070 76 N 4.7591 8.5221 116.6898 52.7465 37.7979 175.2832 77 L 4.4725 7.6985 119.8629 54.7635 42.6873 176.0028 78 Q 4.6752 8.7478 127.3524 54.2249 31.0489 174.9815 79 E 3.6422 8.6187 114.3581 61.6878 29.2643 176.3976 80 H 5.0234 8.1898 117.7795 55.7614 30.4708 175.9758 81 S 4.2642 7.5763 114.7017 58.9654 64.1385 173.9342 82 V 4.3710 9.9119 125.9336 62.0500 32.8061 175.0445 83 V 4.8203 8.9605 127.0817 60.9390 35.9382 173.4734 84 L 5.0468 8.0986 123.8756 53.0615 44.6766 174.8465 85 I 4.4919 9.2413 127.8561 61.0275 38.8583 175.8758 86 R 4.5209 9.9154 130.8233 57.4998 31.3439 175.8672 87 G 3.7181 9.1840 109.3711 46.9098 0.0000 172.7043 88 G 4.0684 7.4972 113.6789 44.2385 0.0000 171.9996 89 R 4.1124 8.4053 122.5451 56.2036 30.0002 176.9890 90 V 4.1322 7.8451 116.0277 60.5335 31.8949 175.2668 91 K 3.6666 8.1385 127.8161 58.6287 32.4726 176.5739 92 D 4.7455 7.9921 116.5472 53.7238 41.5503 175.4538 93 L 4.7291 8.6689 120.6192 52.0077 43.8635 174.1540 94 P 4.3517 0.0000 0.0000 64.1274 31.6657 176.5649 95 G 3.9696 8.7980 109.1614 46.4194 0.0000 173.8968 96 V 4.2933 7.5679 120.4813 61.0104 30.8475 175.1418 97 R 4.5701 8.4568 123.6038 55.5051 31.7482 174.7078 98 Y 4.9213 7.9517 115.6658 56.8526 42.7294 173.6506 99 H 5.6088 9.0722 118.1666 54.2391 32.5746 173.0897 100 I 4.5444 8.4262 123.1364 60.0504 37.9935 175.8456 101 V 3.5961 8.2791 128.1605 62.7673 31.6171 176.0955 102 R 3.9048 8.3545 128.1184 57.4689 30.5099 177.0056 103 G 3.8339 8.9578 110.0226 45.7783 0.0000 173.2877 104 V 4.2226 6.9849 117.7123 61.7778 35.3318 173.9659 105 Y 3.6786 8.3886 123.6600 60.0380 36.0152 170.4975 106 D 4.5511 9.4675 128.6370 55.5966 40.7188 175.9392 107 A 4.3344 8.0853 124.5915 50.5150 18.4779 177.6452 108 A 4.3992 8.7586 125.5461 52.4468 19.1773 177.2960 109 G 4.3542 8.1389 107.4514 44.7776 0.0000 173.3853 110 V 3.9175 8.1462 120.4507 62.1816 32.3753 175.2593 111 K 3.9820 8.6977 130.1912 57.1570 32.7337 176.0033 112 D 4.4356 8.7869 126.0885 55.4157 38.0831 174.0457 113 R 4.3692 7.3918 117.4566 56.2219 31.0841 175.5259 114 K 4.7188 8.2717 116.7458 57.9217 38.8155 178.7157 115 K 4.2969 7.6971 119.8831 55.1725 31.3075 177.8785 116 S 3.9970 8.5974 124.5988 60.5643 62.5842 174.0265 117 R 4.4218 8.2289 124.0806 56.3493 31.7921 178.7519 118 S 4.0357 8.0932 113.0136 61.1859 62.5040 173.9026 119 K 4.4287 7.6663 118.4878 57.8656 32.4330 176.8405 120 Y 3.5794 8.9877 120.2022 58.2886 35.4860 169.9642 121 G 3.9547 7.9597 102.2972 47.1568 0.0000 173.0859 122 T 4.8778 8.2118 124.1486 61.1736 72.7083 174.7914 123 K 3.9365 8.5974 125.2422 56.1239 32.6407 176.8386 124 K 3.9066 8.4461 123.0561 55.4661 31.4984 174.4173 125 P 4.1011 0.0000 0.0000 62.5284 30.7667 176.1062 126 K 3.8342 8.5856 125.0157 56.5324 32.2746 175.8908 127 E 4.2127 8.7311 126.4446 55.8525 30.1824 176.6441 128 A 4.2735 8.3969 125.7108 52.3355 19.4011 175.3478 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 5 P 0.00 4.34 0.00 2.19 2.12 0.00 3.74 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 1.88 1.96 0.00 6 T 8.15 3.88 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 1.21 0.00 0.00 7 I 8.30 3.69 1.87 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 1.52 1.19 0.91 0.00 0.00 8 N 8.18 4.26 0.00 2.79 2.81 0.00 0.00 7.18 7.56 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 9 Q 9.26 3.97 0.00 2.15 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.46 0.00 0.00 0.00 0.00 0.00 2.38 2.41 0.00 10 L 7.77 3.94 0.00 1.92 1.75 0.96 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 11 V 7.53 3.58 2.26 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 0.83 0.00 0.00 1.02 0.00 0.00 12 R 8.27 3.89 0.00 1.95 1.82 0.00 3.24 0.00 0.00 3.15 8.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.64 0.00 13 K 8.03 3.98 0.00 1.85 1.85 0.00 1.73 0.00 0.00 1.71 0.00 0.00 3.12 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.46 1.52 7.81 14 G 7.27 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 15 R 8.10 4.23 0.00 1.81 1.91 0.00 3.38 0.00 0.00 3.15 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.55 0.00 16 E 8.64 4.03 0.00 1.92 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 2.29 2.34 0.00 17 K 8.41 4.56 0.00 1.78 1.61 0.00 1.77 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.41 7.81 18 V 8.22 4.16 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 0.69 0.00 0.00 0.93 0.00 0.00 19 R 8.11 5.12 0.00 1.84 1.89 0.00 3.22 0.00 0.00 3.28 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.35 0.00 20 K 8.27 4.43 0.00 1.88 1.77 0.00 1.62 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.35 1.38 7.81 21 K 8.21 4.32 0.00 1.75 1.78 0.00 1.75 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.38 1.40 7.81 22 S 8.50 4.13 0.00 3.83 3.78 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 23 K 8.42 3.86 0.00 1.72 1.78 0.00 1.80 0.00 0.00 1.59 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.41 7.81 24 V 8.15 3.90 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 0.52 0.00 0.00 0.49 0.00 0.00 25 P 0.00 4.53 0.00 2.09 2.23 0.00 3.87 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 2.23 2.11 0.00 26 A 7.90 4.20 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 27 L 8.82 3.11 0.00 1.68 1.54 -0.35 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 28 K 8.92 3.83 0.00 1.86 1.85 0.00 1.91 0.00 0.00 1.70 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.30 1.41 7.81 29 G 8.25 4.04 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 0.00 30 A 7.43 4.12 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 31 P 0.00 3.73 0.00 1.84 1.62 0.00 3.57 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.01 0.00 32 F 7.24 5.01 0.00 2.91 3.26 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 33 R 8.65 4.74 0.00 1.91 1.73 0.00 3.05 0.00 0.00 3.09 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 0.00 34 R 8.84 4.81 0.00 2.15 1.85 0.00 3.09 0.00 0.00 3.04 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.88 0.00 35 G 8.53 4.39 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 0.00 36 V 8.35 4.97 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 1.02 0.00 0.00 0.94 0.00 0.00 37 C 9.29 4.62 0.00 3.13 2.81 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 38 T 9.20 4.25 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 1.31 0.00 0.00 39 V 7.47 4.58 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 0.90 0.00 0.00 0.93 0.00 0.00 40 V 8.27 4.71 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 1.02 0.00 0.00 1.02 0.00 0.00 41 R 9.15 4.73 0.00 1.87 1.73 0.00 3.12 0.00 0.00 3.11 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.57 0.00 42 T 8.49 5.00 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 43 V 8.83 4.68 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 0.90 0.00 0.00 0.97 0.00 0.00 44 T 8.49 4.48 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 1.22 0.00 0.00 45 P 0.00 4.65 0.00 2.16 2.04 0.00 3.68 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 2.00 2.09 0.00 46 K 8.24 4.58 0.00 1.68 0.82 0.00 1.78 0.00 0.00 1.83 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.36 7.81 47 K 9.14 3.83 0.00 1.79 1.52 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.49 1.36 7.81 48 P 0.00 4.49 0.00 2.21 2.13 0.00 3.75 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 1.98 1.98 0.00 49 N 7.87 5.03 0.00 2.81 2.72 0.00 0.00 6.58 7.26 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 50 S 8.28 4.72 0.00 3.77 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 51 A 8.03 4.47 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 52 L 8.27 4.89 0.00 1.52 1.60 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 53 R 8.67 4.17 0.00 2.02 2.04 0.00 3.19 0.00 0.00 3.16 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.70 0.00 54 K 8.86 4.87 0.00 1.58 1.51 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.54 7.81 55 V 8.80 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 0.98 0.00 0.00 1.06 0.00 0.00 56 A 8.78 4.94 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 57 K 8.84 4.56 0.00 1.76 1.75 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.80 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.47 1.41 7.81 58 V 9.09 4.77 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 1.02 0.00 0.00 0.93 0.00 0.00 59 R 9.00 4.63 0.00 1.93 1.82 0.00 3.20 0.00 0.00 3.35 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.66 0.00 60 L 9.21 4.82 0.00 1.73 1.66 0.90 0.64 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 61 T 8.27 4.05 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 1.28 0.00 0.00 62 S 8.03 4.44 0.00 4.05 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 63 G 8.42 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 0.00 0.00 0.00 64 Y 8.65 4.24 0.00 2.81 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 65 E 8.61 5.46 0.00 1.92 1.81 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 2.18 2.20 0.00 66 V 8.13 4.76 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 0.90 0.00 0.00 0.52 0.00 0.00 67 T 8.56 4.69 4.31 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 1.25 0.00 0.00 68 A 9.05 5.10 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 69 Y 9.28 4.83 0.00 3.09 3.07 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 70 I 6.67 4.25 1.47 0.00 0.00 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.71 0.67 0.00 0.00 71 P 0.00 3.89 0.00 1.46 1.59 0.00 3.48 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 72 G 7.86 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 73 E 8.80 4.35 0.00 1.96 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 2.23 2.32 0.00 74 G 9.76 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 75 H 8.32 4.98 0.00 3.16 3.10 0.00 5.51 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 N 8.52 4.76 0.00 2.82 2.91 0.00 0.00 6.01 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 77 L 7.70 4.47 0.00 1.79 1.70 0.90 1.03 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 78 Q 8.75 4.68 0.00 2.04 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.31 6.64 0.00 0.00 0.00 0.00 0.00 2.28 2.28 0.00 79 E 8.62 3.64 0.00 1.92 1.60 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 2.27 2.28 0.00 80 H 8.19 5.02 0.00 3.11 3.33 0.00 5.95 0.00 0.00 0.00 0.00 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 S 7.58 4.26 0.00 3.84 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 82 V 9.91 4.37 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 0.81 0.00 0.00 0.96 0.00 0.00 83 V 8.96 4.82 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 0.87 0.00 0.00 0.95 0.00 0.00 84 L 8.10 5.05 0.00 0.99 1.09 0.48 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 85 I 9.24 4.49 1.89 0.00 0.00 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 1.06 1.25 1.06 0.00 0.00 86 R 9.92 4.52 0.00 1.85 2.18 0.00 3.44 0.00 0.00 3.31 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.93 0.00 87 G 9.18 3.72 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 0.00 0.00 0.00 88 G 7.50 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 89 R 8.41 4.11 0.00 1.82 1.87 0.00 2.98 0.00 0.00 3.15 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 90 V 7.85 4.13 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 0.71 0.00 0.00 0.79 0.00 0.00 91 K 8.14 3.67 0.00 1.70 1.81 0.00 1.66 0.00 0.00 1.68 0.00 0.00 2.86 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.55 7.81 92 D 7.99 4.75 0.00 2.71 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 93 L 8.67 4.73 0.00 1.54 1.53 0.72 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 94 P 0.00 4.35 0.00 2.04 2.01 0.00 3.83 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 2.03 2.09 0.00 95 G 8.80 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 96 V 7.57 4.29 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 1.12 0.00 0.00 1.02 0.00 0.00 97 R 8.46 4.57 0.00 1.33 1.55 0.00 3.07 0.00 0.00 3.34 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.65 0.00 98 Y 7.95 4.92 0.00 2.92 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 H 9.07 5.61 0.00 3.15 3.19 0.00 5.62 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 0.00 100 I 8.43 4.54 1.86 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 1.11 0.59 0.83 0.00 0.00 101 V 8.28 3.60 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 0.47 0.00 0.00 0.70 0.00 0.00 102 R 8.35 3.90 0.00 1.76 1.78 0.00 3.31 0.00 0.00 3.03 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.32 0.00 103 G 8.96 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 0.00 104 V 6.98 4.22 1.64 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 -0.03 0.00 0.00 0.65 0.00 0.00 105 Y 8.39 3.68 0.00 3.24 2.42 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 0.00 106 D 9.47 4.55 0.00 2.90 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 0.00 107 A 8.09 4.33 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 0.00 108 A 8.76 4.40 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 0.00 109 G 8.14 4.35 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 0.00 110 V 8.15 3.92 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 0.95 0.00 0.00 1.13 0.00 0.00 111 K 8.70 3.98 0.00 1.81 1.71 0.00 1.95 0.00 0.00 1.71 0.00 0.00 2.90 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.43 1.48 7.81 112 D 8.79 4.44 0.00 2.89 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 0.00 113 R 7.39 4.37 0.00 1.93 1.86 0.00 3.29 0.00 0.00 3.32 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.61 0.00 114 K 8.27 4.72 0.00 1.71 1.74 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.33 1.45 7.81 115 K 7.70 4.30 0.00 1.65 1.52 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.76 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.36 7.81 116 S 8.60 4.00 0.00 3.57 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 0.00 117 R 8.23 4.42 0.00 1.83 2.02 0.00 3.13 0.00 0.00 3.25 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.91 0.00 118 S 8.09 4.04 0.00 3.84 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 0.00 119 K 7.67 4.43 0.00 1.79 2.00 0.00 1.78 0.00 0.00 1.79 0.00 0.00 3.02 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.50 1.46 7.81 120 Y 8.99 3.58 0.00 3.03 3.32 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 0.00 121 G 7.96 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 0.00 0.00 0.00 122 T 8.21 4.88 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 1.22 0.00 0.00 123 K 8.60 3.94 0.00 1.74 1.75 0.00 1.76 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.44 1.38 7.81 124 K 8.45 3.91 0.00 1.69 1.76 0.00 1.68 0.00 0.00 1.75 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.48 7.81 125 P 0.00 4.10 0.00 2.21 2.11 0.00 3.82 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.97 0.00 126 K 8.59 3.83 0.00 1.71 1.79 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.08 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.53 7.81 127 E 8.73 4.21 0.00 2.00 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 2.30 2.45 0.00 128 A 8.40 4.27 1.18 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