NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 5.0856 8.4898 122.9982 51.9692 20.2271 175.8164 2 W 4.9084 8.3566 119.2640 53.7212 32.0553 168.6536 3 V 4.4570 8.6866 121.2074 61.4417 33.0516 175.4828 4 D 4.8605 8.7831 128.5591 52.7991 42.7562 174.4203 5 Q 5.2122 8.5770 127.5675 54.6956 32.0692 174.1108 6 T 5.0515 8.3373 114.2209 59.5881 72.4534 171.7173 7 P 4.7222 0.0000 0.0000 63.0012 32.2622 176.4303 8 R 4.5961 8.7597 117.9516 57.9221 31.3113 176.7049 9 T 5.1947 7.7950 106.4299 59.9580 72.2837 173.6963 10 A 4.6175 9.3180 125.2114 50.9873 22.9815 175.0772 11 T 4.7204 8.7002 119.3016 61.8843 70.7496 173.6100 12 K 4.7545 8.6618 125.1228 54.4587 36.5865 175.8012 13 E 5.0089 9.2425 122.0530 55.0404 31.6163 176.2814 14 T 4.0194 7.9625 112.2437 63.7518 68.9601 174.7947 15 G 3.9015 8.8654 113.6117 45.0470 0.0000 173.0762 16 E 4.4503 7.7360 119.4211 55.5629 31.8587 174.8287 17 S 5.0012 8.3937 114.4011 56.7183 65.1297 173.0325 18 L 4.6626 8.1771 125.4199 53.7373 45.4301 174.7651 19 T 4.8779 8.5432 122.3316 61.7592 71.3104 173.2791 20 I 4.5355 8.6627 127.7241 59.7085 39.6597 174.2390 21 N 5.1365 9.0002 125.3947 51.9463 40.5723 173.4150 22 C 5.1041 9.1364 121.5364 54.8690 39.9107 173.0303 23 V 4.3663 8.2808 123.5976 60.8767 33.9484 174.4576 24 L 4.5780 8.6014 131.1234 54.4561 41.1379 176.0067 25 R 3.8938 7.8734 124.0898 55.7922 31.7025 176.7074 26 D 4.1819 8.5932 119.6676 54.9915 38.1823 173.7247 27 A 4.2196 7.6988 122.5971 51.0666 18.7971 178.0385 28 S 4.2168 8.8602 119.8120 61.5680 63.0651 175.1791 29 L 4.7015 7.2356 116.9746 52.5977 44.2758 175.5593 30 E 4.2295 8.3362 121.0552 55.9507 31.3783 175.0241 31 L 4.6025 8.3575 126.4968 54.2041 42.2170 175.4543 32 K 4.4663 8.9561 127.8059 57.5563 34.0666 175.0525 33 D 5.0666 8.7315 118.3162 52.9995 45.4490 174.0457 34 T 4.9378 8.4814 110.0945 60.0342 71.8742 173.1696 35 G 4.6359 9.3885 109.6589 44.5448 0.0000 171.4146 36 W 5.6929 8.2172 119.0534 55.0291 33.4919 174.0051 37 Y 5.3072 9.6344 120.8412 56.2832 42.4311 174.2906 38 R 4.7522 8.8840 120.7398 55.0177 33.8837 174.1277 39 T 4.8277 8.7865 123.4349 60.7696 70.2444 173.8346 40 K 4.3500 8.3765 126.8078 55.8483 33.2442 177.0618 41 L 4.1979 8.4424 126.2783 56.2514 42.9554 175.2907 42 G 4.3169 9.1137 115.2162 45.7767 0.0000 174.0019 43 S 4.5033 7.3646 113.1390 57.3721 63.7034 174.3555 44 T 4.6097 7.9177 122.3541 60.9532 67.9523 173.1840 45 N 4.7423 7.5149 119.1067 52.5420 43.1497 172.8935 46 E 5.0781 8.9073 127.5643 54.7009 31.2696 174.7381 47 Q 4.9193 8.6283 123.9725 54.0790 32.3087 174.9768 48 S 4.5421 8.8475 117.3799 58.7200 63.4683 174.3246 49 I 3.9361 8.6109 126.2078 61.5094 37.8301 176.3410 50 S 4.5051 8.4922 120.9245 56.1490 61.7817 173.2778 51 I 3.7664 8.2203 128.3478 60.6077 37.4604 175.4907 52 G 4.3446 9.7223 111.0653 44.2518 0.0000 176.0480 53 G 3.9152 7.8390 111.5372 46.9494 0.0000 176.0543 54 R 4.1523 8.7036 124.9796 57.0613 30.2156 174.8824 55 Y 4.4491 7.8670 117.6329 56.2849 38.8811 173.8605 56 V 4.4612 8.4040 124.6068 60.9324 33.6094 173.6707 57 E 4.9164 8.7519 129.2935 55.2300 31.1648 174.9428 58 T 4.7789 8.9650 123.3849 61.8500 71.6145 173.6104 59 V 4.7604 8.3932 124.3018 61.3335 34.6737 173.9938 60 N 4.8378 9.2801 127.7538 51.8217 40.0699 175.1562 61 K 4.0693 8.8267 127.5282 59.2478 32.7979 180.0116 62 G 3.6758 8.3522 107.2144 48.5458 0.0000 174.1966 63 S 4.4717 7.8350 110.9234 56.7302 63.7239 173.9929 64 K 3.8968 7.6995 120.1541 57.1610 29.9633 174.2599 65 S 5.2745 7.9720 111.0687 57.5860 67.2513 173.8548 66 F 5.4923 8.8615 114.3719 56.6004 41.2693 172.8805 67 S 5.8810 9.5751 114.4691 56.6877 67.1598 172.3670 68 L 4.6628 8.1326 121.9954 53.1074 44.9941 174.7026 69 R 4.7484 8.7409 127.2602 54.9108 31.9996 174.6914 70 I 4.6800 8.7342 129.8957 59.5860 37.4970 175.7457 71 S 4.2209 8.5879 121.9011 56.7066 64.4953 173.4444 72 D 4.3689 8.4003 117.1507 54.7398 39.3866 173.6269 73 L 4.0762 7.7355 119.2529 55.5002 42.8931 177.5910 74 R 4.9779 8.6491 120.2560 54.2720 33.3154 177.7882 75 V 3.9855 8.0790 111.8622 64.0546 31.7963 178.1306 76 E 4.4434 8.1675 116.4743 57.0274 28.7772 177.0315 77 D 4.8834 7.6497 118.7153 54.9359 41.5854 177.4787 78 S 4.5047 7.8028 115.9369 57.8449 63.4461 173.7261 79 G 4.3223 7.6861 111.9788 44.1281 0.0000 171.6853 80 T 4.8319 8.4117 118.2697 63.2726 69.6298 173.9030 81 Y 5.1759 9.2132 124.6223 56.5971 40.8826 175.2495 82 K 5.1535 9.3250 122.3070 55.2078 36.5503 173.6949 83 C 4.3351 8.7361 119.9467 54.9845 39.4469 172.1888 84 Q 5.0045 8.8622 120.0321 54.6105 32.8070 173.0856 85 A 4.7435 8.2707 126.0466 50.3243 21.7132 175.8293 86 F 5.3029 9.0806 120.1323 55.7471 42.3344 174.1837 87 Y 5.4278 8.7471 121.2506 54.8931 41.6542 174.8679 88 S 4.7516 8.6548 116.2791 58.5662 63.8391 174.5569 89 L 4.7113 8.9056 126.5589 51.8339 43.3020 173.1646 90 P 4.5721 0.0000 0.0000 62.7800 31.9179 175.8478 91 L 4.3117 8.0664 122.5440 53.7508 42.9288 176.6717 92 R 4.0554 8.4299 124.1573 58.0124 30.8752 173.9234 93 D 5.1817 9.3709 124.7045 54.2320 38.5056 174.6601 94 Y 4.7846 7.0330 116.4957 55.9000 41.3715 174.0370 95 N 5.0702 9.0632 120.1547 53.3728 39.1459 174.4771 96 Y 5.0690 7.9007 114.5818 55.9459 41.6657 173.5852 97 S 4.7759 8.6776 116.2036 57.1833 65.3344 173.7955 98 L 4.5624 8.4748 122.8141 53.6964 43.9809 175.4196 99 L 4.9594 8.2874 120.4509 53.7001 43.2400 175.9882 100 F 4.5429 9.0135 125.8322 55.8202 42.2065 173.9676 101 R 4.0254 7.8702 127.1933 56.7824 30.2770 176.4028 102 G 4.1976 8.2898 116.9470 45.8431 0.0000 172.5237 103 E 4.6203 8.8965 118.7085 55.4650 31.5052 176.0142 104 K 4.6122 8.3895 122.6353 54.4645 34.1554 176.2529 105 G 4.3333 8.7247 112.1115 44.9377 0.0000 173.3105 106 A 4.3454 8.3782 120.2515 51.7073 19.8983 178.0956 107 G 4.1274 8.4955 102.6971 45.1471 0.0000 172.5066 108 T 4.7340 8.8816 116.2613 61.4097 71.6903 173.2928 109 A 4.6409 9.0893 129.6826 51.2028 20.0060 175.5501 110 L 5.1257 8.6591 124.7189 54.1269 45.0777 175.3361 111 T 4.4923 8.7488 122.7442 61.9788 71.2604 173.4976 112 V 4.4095 8.6237 128.9496 61.3828 32.8701 175.3389 113 K 4.4142 8.6800 128.1090 55.7842 34.9861 177.3109 114 A 4.3613 8.6162 121.6463 53.7104 20.9905 177.0286 115 A 4.7303 7.3066 114.6309 51.5839 18.8842 175.6631 116 A 4.1731 9.0995 124.5058 54.7587 18.4042 178.1423 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 A 8.49 5.09 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 2 W 8.36 4.91 0.00 3.52 3.08 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 3 V 8.69 4.46 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 0.64 0.00 0.00 1.05 0.00 0.00 4 D 8.78 4.86 0.00 1.91 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 0.00 0.00 0.00 0.00 5 Q 8.58 5.21 0.00 2.10 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.37 2.32 0.00 6 T 8.34 5.05 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 1.22 0.00 0.00 7 P 0.00 4.72 0.00 2.40 2.10 0.00 3.81 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 1.98 1.97 0.00 8 R 8.76 4.60 0.00 1.82 2.04 0.00 3.37 0.00 0.00 3.38 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.49 0.00 9 T 7.79 5.19 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 1.23 0.00 0.00 10 A 9.32 4.62 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 T 8.70 4.72 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 1.22 0.00 0.00 12 K 8.66 4.75 0.00 1.65 1.63 0.00 1.64 0.00 0.00 1.63 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.32 1.48 7.81 13 E 9.24 5.01 0.00 1.87 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 0.00 2.28 2.39 0.00 14 T 7.96 4.02 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 1.26 0.00 0.00 15 G 8.87 3.90 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 0.00 16 E 7.74 4.45 0.00 2.04 1.88 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 2.28 2.24 0.00 17 S 8.39 5.00 0.00 3.80 3.66 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.18 4.66 0.00 1.60 1.24 0.63 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 19 T 8.54 4.88 4.18 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 1.16 0.00 0.00 20 I 8.66 4.54 1.88 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 1.19 0.47 1.20 0.00 0.00 21 N 9.00 5.14 0.00 2.61 2.68 0.00 0.00 6.37 7.18 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 22 C 9.14 5.10 0.00 1.34 2.03 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 23 V 8.28 4.37 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 0.67 0.00 0.00 0.81 0.00 0.00 24 L 8.60 4.58 0.00 1.89 1.55 0.71 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 25 R 7.87 3.89 0.00 0.68 1.43 0.00 2.79 0.00 0.00 2.88 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.50 0.00 26 D 8.59 4.18 0.00 2.99 3.01 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 27 A 7.70 4.22 1.02 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 0.00 0.00 28 S 8.86 4.22 0.00 3.85 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 29 L 7.24 4.70 0.00 1.67 1.67 1.13 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 30 E 8.34 4.23 0.00 2.11 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 2.38 2.37 0.00 31 L 8.36 4.60 0.00 1.64 1.56 0.91 0.57 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 32 K 8.96 4.47 0.00 1.84 1.88 0.00 1.71 0.00 0.00 1.67 0.00 0.00 3.02 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.38 1.51 7.81 33 D 8.73 5.07 0.00 2.74 2.53 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 0.00 0.00 0.00 0.00 34 T 8.48 4.94 3.73 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 0.22 0.00 0.00 35 G 9.39 4.64 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 36 W 8.22 5.69 0.00 3.23 3.15 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 0.00 37 Y 9.63 5.31 0.00 3.02 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 38 R 8.88 4.75 0.00 1.34 1.62 0.00 2.95 0.00 0.00 2.65 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.26 0.00 39 T 8.79 4.83 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 1.30 0.00 0.00 40 K 8.38 4.35 0.00 1.71 1.73 0.00 1.68 0.00 0.00 1.75 0.00 0.00 2.81 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.66 1.42 7.81 41 L 8.44 4.20 0.00 1.59 1.58 0.93 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 42 G 9.11 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 0.00 0.00 0.00 43 S 7.36 4.50 0.00 3.94 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 44 T 7.92 4.61 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 45 N 7.51 4.74 0.00 2.73 2.61 0.00 0.00 6.58 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 46 E 8.91 5.08 0.00 2.00 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 2.37 2.34 0.00 47 Q 8.63 4.92 0.00 2.16 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.77 0.00 0.00 0.00 0.00 0.00 2.27 2.48 0.00 48 S 8.85 4.54 0.00 3.82 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 49 I 8.61 3.94 2.05 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.07 1.26 0.00 0.00 50 S 8.49 4.51 0.00 3.77 3.71 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 51 I 8.22 3.77 1.91 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 1.42 1.00 1.00 0.00 0.00 52 G 9.72 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 0.00 0.00 0.00 0.00 53 G 7.84 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 54 R 8.70 4.15 0.00 2.14 2.23 0.00 3.43 0.00 0.00 3.37 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.68 0.00 55 Y 7.87 4.45 0.00 2.90 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 56 V 8.40 4.46 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 1.00 0.00 0.00 0.93 0.00 0.00 57 E 8.75 4.92 0.00 1.96 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 2.51 2.50 0.00 58 T 8.97 4.78 4.30 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 1.25 0.00 0.00 59 V 8.39 4.76 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 0.78 0.00 0.00 1.03 0.00 0.00 60 N 9.28 4.84 0.00 2.85 2.72 0.00 0.00 6.78 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 61 K 8.83 4.07 0.00 1.88 1.85 0.00 1.75 0.00 0.00 1.84 0.00 0.00 3.12 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.76 1.45 7.81 62 G 8.35 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 63 S 7.84 4.47 0.00 4.02 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 64 K 7.70 3.90 0.00 1.89 1.84 0.00 1.59 0.00 0.00 1.58 0.00 0.00 3.04 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.31 1.32 7.81 65 S 7.97 5.27 0.00 3.93 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 66 F 8.86 5.49 0.00 3.39 3.17 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 67 S 9.58 5.88 0.00 3.92 4.13 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 68 L 8.13 4.66 0.00 0.27 0.23 0.36 -0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 69 R 8.74 4.75 0.00 1.79 1.66 0.00 3.06 0.00 0.00 3.11 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.48 0.00 70 I 8.73 4.68 1.47 0.00 0.00 -0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.05 0.39 0.67 0.00 0.00 71 S 8.59 4.22 0.00 3.90 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 72 D 8.40 4.37 0.00 2.75 2.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 73 L 7.74 4.08 0.00 1.76 1.59 0.87 0.90 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 74 R 8.65 4.98 0.00 1.88 1.84 0.00 3.30 0.00 0.00 3.19 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 75 V 8.08 3.99 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 1.06 0.00 0.00 0.95 0.00 0.00 76 E 8.17 4.44 0.00 2.00 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 2.34 2.29 0.00 77 D 7.65 4.88 0.00 3.03 2.84 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 78 S 7.80 4.50 0.00 3.94 3.90 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 79 G 7.69 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 0.00 0.00 0.00 80 T 8.41 4.83 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 1.27 0.00 0.00 81 Y 9.21 5.18 0.00 3.01 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 82 K 9.33 5.15 0.00 1.82 1.74 0.00 1.68 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.47 7.81 83 C 8.74 4.34 0.00 2.08 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 84 Q 8.86 5.00 0.00 2.07 1.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.82 0.00 0.00 0.00 0.00 0.00 1.31 2.19 0.00 85 A 8.27 4.74 1.32 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 0.00 0.00 86 F 9.08 5.30 0.00 3.01 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 87 Y 8.75 5.43 0.00 3.18 3.01 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 88 S 8.65 4.75 0.00 3.90 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 89 L 8.91 4.71 0.00 1.71 1.51 0.75 0.69 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 90 P 0.00 4.57 0.00 2.10 2.04 0.00 3.80 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.01 0.00 91 L 8.07 4.31 0.00 1.59 1.61 0.58 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 92 R 8.43 4.06 0.00 1.77 1.84 0.00 3.21 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.66 0.00 93 D 9.37 5.18 0.00 2.88 3.22 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 94 Y 7.03 4.78 0.00 2.83 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 95 N 9.06 5.07 0.00 2.89 2.90 0.00 0.00 6.73 7.46 0.00 0.00 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 Y 7.90 5.07 0.00 3.07 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 97 S 8.68 4.78 0.00 3.78 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 98 L 8.47 4.56 0.00 1.55 1.56 0.86 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 99 L 8.29 4.96 0.00 1.51 1.59 0.76 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 100 F 9.01 4.54 0.00 2.98 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 0.00 101 R 7.87 4.03 0.00 1.67 1.49 0.00 3.16 0.00 0.00 3.19 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.78 0.00 102 G 8.29 4.20 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 0.00 103 E 8.90 4.62 0.00 2.05 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 2.64 2.50 0.00 104 K 8.39 4.61 0.00 1.62 1.65 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.52 7.81 105 G 8.72 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 0.00 0.00 0.00 0.00 106 A 8.38 4.35 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 0.00 107 G 8.50 4.13 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 0.00 0.00 0.00 108 T 8.88 4.73 4.41 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 1.24 0.00 0.00 109 A 9.09 4.64 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 0.00 110 L 8.66 5.13 0.00 1.78 1.73 0.89 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 111 T 8.75 4.49 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 1.23 0.00 0.00 112 V 8.62 4.41 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 1.00 0.00 0.00 1.00 0.00 0.00 113 K 8.68 4.41 0.00 1.89 1.94 0.00 1.36 0.00 0.00 1.66 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.54 7.81 114 A 8.62 4.36 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 0.00 115 A 7.31 4.73 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 0.00 116 A 9.10 4.17 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