NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.4212 8.2985 121.7429 55.9779 31.1947 174.9800 3 A 4.4998 8.7344 128.4828 51.0851 19.5824 171.1273 4 V 4.3667 9.3109 121.4638 61.0229 33.8407 173.5626 5 K 4.8258 8.7131 126.7443 54.9746 34.4885 175.7979 6 T 4.6523 9.2739 121.5620 61.8595 72.0630 173.7450 7 D 4.5237 8.6615 123.3167 55.6960 41.6832 176.9896 8 R 4.3230 7.8831 115.6066 56.7172 30.5267 175.7434 9 A 4.7174 7.4309 119.7058 49.2811 22.2850 174.0523 10 P 4.2267 0.0000 0.0000 62.7663 31.8461 176.3666 11 A 3.9708 8.4782 125.7267 51.8659 18.9084 177.3748 12 A 4.2043 8.1631 124.6738 50.9102 17.3106 177.2822 13 I 4.0323 9.4705 123.1680 63.8100 37.0166 176.3261 14 G 4.1810 8.0791 112.7657 43.2661 0.0000 170.1575 15 P 4.6926 0.0000 0.0000 61.8266 31.0466 175.8172 16 Y 4.8396 7.4677 113.9230 55.7506 41.0425 173.4047 17 A 4.8756 8.2240 123.1652 50.1979 21.7628 177.0087 18 Q 4.3916 8.5795 118.4781 59.1911 29.9291 176.2715 19 A 5.0106 7.5321 117.3570 51.2891 22.8438 175.3396 20 V 4.8327 8.5874 118.8998 61.1460 34.8476 174.4964 21 K 5.0391 9.2257 127.9292 55.4885 33.1281 176.3088 22 A 4.3935 9.7257 124.9587 52.7530 22.4855 176.1581 23 G 4.2776 10.3815 109.1551 46.4892 0.0000 174.5533 24 G 3.7763 8.6285 107.0173 44.3920 0.0000 173.1781 25 F 5.2589 8.3823 117.7948 55.4173 43.4820 174.1041 26 V 4.7552 8.8238 119.7698 61.3553 34.3358 174.1915 27 F 4.8925 9.3215 127.5194 56.0048 40.0800 174.8812 28 V 4.6565 8.5873 125.3061 61.7157 32.6974 175.9372 29 S 4.3823 9.1703 124.7340 58.1408 63.7806 174.4408 30 G 3.8409 8.6135 109.4037 46.5431 0.0000 172.7528 31 Q 4.9704 9.2370 125.2781 54.3402 31.2206 174.8496 32 I 4.9240 8.0797 115.1243 57.3764 41.2670 174.1962 33 P 4.7305 0.0000 0.0000 62.9289 28.5564 176.5288 34 L 5.0038 7.4944 118.2979 52.6469 44.9027 177.3708 35 A 4.3207 8.4910 126.0965 50.9192 19.2956 176.4114 36 P 4.3314 0.0000 0.0000 65.9371 31.3573 178.1035 37 D 4.4021 7.9643 115.3909 54.3151 39.5174 176.6863 38 G 4.0891 8.1678 107.6762 45.2904 0.0000 174.4962 39 S 4.3268 7.8880 113.8184 58.3736 64.3512 173.1146 40 L 4.6609 8.3629 123.7492 54.3061 43.0110 175.8704 41 V 4.1535 8.5274 127.2962 61.7842 31.9064 175.3264 42 E 4.4086 9.6023 127.7160 54.9539 31.2289 175.1341 43 G 3.9613 8.4662 105.8994 43.5305 0.0000 173.2160 44 D 4.6533 8.3986 120.7959 52.6965 40.9406 176.8184 45 I 3.7467 8.3392 113.1667 64.3765 37.1508 178.0673 46 R 4.0883 8.0880 119.1618 59.1997 29.8032 179.0018 47 V 3.6084 8.0399 117.6571 66.1078 31.5254 178.1724 48 Q 4.0114 8.0611 117.6131 59.3521 28.3975 178.6400 49 T 3.9991 8.9759 116.2220 66.6637 68.5355 175.8536 50 E 4.0392 8.0285 120.3797 59.1986 29.9424 178.6151 51 R 4.0523 7.7953 118.6538 59.2775 30.1776 179.3404 52 V 3.7294 7.7081 115.4863 63.8845 31.6566 177.2098 *54 E 4.1866 8.1605 118.4132 55.9954 31.6437 178.0140 55 N 4.3206 8.3194 116.1410 56.2230 38.4919 177.2930 56 L 3.9795 7.8684 120.3178 57.6850 41.6682 179.2642 57 K 3.7522 8.0070 118.6385 59.6050 31.9826 178.0064 58 A 3.9599 8.0160 120.6514 55.3096 18.3915 179.4886 59 V 3.5311 7.8819 116.2063 66.2841 31.6504 177.9669 60 L 3.9980 8.2494 118.8315 58.0196 41.4950 179.4500 61 E 4.1848 8.6733 119.4399 58.9552 29.2828 179.4337 62 A 4.1810 8.0689 118.7059 54.4101 18.4607 178.4650 63 A 4.3789 7.6687 117.2539 51.6382 19.0522 177.3270 64 G 3.8568 8.5177 105.8147 46.5948 0.0000 173.9795 65 S 4.3587 7.9745 116.7650 57.9969 63.9852 171.8053 66 G 3.9829 8.0156 105.8481 45.3996 0.0000 173.6610 67 L 4.0274 7.9462 118.6461 57.6978 41.5950 180.1277 68 S 4.2536 8.0800 111.6547 60.5588 63.2059 174.9051 69 R 4.4914 7.7161 119.1195 55.7083 30.0805 175.6051 70 V 4.2569 7.7926 119.2753 62.9974 32.0494 176.1488 71 V 4.4120 8.8702 119.5816 61.7760 33.8252 175.2205 72 Q 5.1491 7.7133 120.4665 55.1742 32.5855 172.8838 73 T 5.1220 8.6564 114.3472 60.3586 72.9362 172.7593 74 T 4.6225 9.0465 121.2449 62.2047 71.1891 172.8080 75 C 4.8979 8.9022 125.6657 57.9583 30.5514 172.9992 76 F 5.3133 9.0047 123.3532 55.6808 41.0548 174.8942 77 L 5.2173 9.0230 123.4113 52.9494 44.8408 176.9336 78 A 4.3526 8.3997 121.7448 52.4587 19.3798 177.3635 79 D 4.2244 7.3741 113.5868 54.4039 44.9353 175.5617 *81 E 4.2949 8.9139 114.6074 56.7779 31.4734 176.8762 82 D 4.6460 8.3121 117.0236 54.7477 40.8933 177.7921 83 F 4.0660 8.2912 122.4653 61.0188 39.2724 174.7422 84 P 4.3467 0.0000 0.0000 65.8089 31.2912 178.8135 85 G 3.5934 8.0428 103.7413 47.5471 0.0000 175.2818 86 F 4.1380 8.3880 123.2387 61.1957 39.4194 176.7005 87 N 3.7168 8.2915 117.0845 56.3266 38.3403 176.2766 88 E 3.8374 7.8689 119.8360 59.2948 29.9941 178.8053 89 V 3.7552 7.5662 117.6991 66.0263 31.5102 177.0339 90 Y 4.0426 8.0710 119.5850 60.9998 38.2887 178.3083 91 A 4.1661 8.1230 119.7801 54.9904 18.4235 179.4971 92 R 3.8798 7.8961 116.4637 59.2584 30.1825 177.4953 93 Y 3.9935 7.6075 114.3026 58.5234 38.4620 175.4297 94 F 4.9362 7.8106 117.5232 55.9483 41.4609 174.8492 95 T 4.6438 8.1535 117.9838 60.7869 72.2353 172.3695 96 P 3.8016 0.0000 0.0000 61.7759 31.7804 174.7326 97 P 4.2859 0.0000 0.0000 62.1441 31.7117 176.1733 98 Y 4.5521 8.1931 121.2154 57.3300 38.5221 174.2079 99 P 4.6317 0.0000 0.0000 62.4241 32.5318 176.1811 100 A 4.3782 8.6787 123.6876 52.3210 19.7113 176.5997 101 R 5.0425 8.2394 117.9480 54.8895 33.8285 174.0817 102 A 4.6746 8.6011 125.0936 50.4597 22.1022 175.0764 103 T 4.9395 8.3841 118.6114 61.9932 71.8906 173.8513 104 V 4.5032 8.4630 116.8037 60.2569 36.9464 172.6680 105 A 5.1634 8.4906 124.1807 50.6214 20.6981 176.7617 106 V 4.2909 8.4244 116.2366 59.3041 34.3737 176.4898 107 K 3.9850 8.7449 121.5881 59.1631 32.1235 176.3023 108 A 4.6566 7.4207 117.8562 50.9008 22.2197 174.6622 109 L 4.8015 7.9966 118.2316 51.6089 45.6374 174.5823 110 P 4.3502 0.0000 0.0000 64.8927 31.5868 176.8377 111 R 3.9175 9.5797 119.3409 57.1904 27.7771 176.8371 112 G 3.9195 8.1191 102.2052 46.2624 0.0000 175.0607 113 V 3.8927 7.4430 112.4449 61.2332 32.2200 176.1868 114 R 4.6113 8.6610 116.2768 56.7036 30.6248 176.3650 115 V 5.0135 7.4905 118.4873 60.6374 34.1246 173.5467 116 E 5.5357 9.2237 123.5089 54.2583 33.4618 173.8983 117 V 5.0704 8.6754 125.2919 61.2153 35.0467 173.8768 118 A 5.3731 8.7886 128.9192 50.7823 22.7410 174.3654 119 C 5.1136 8.2775 112.0177 57.6899 33.9942 172.8156 120 V 4.8989 8.9083 118.2433 61.1522 34.4063 174.0226 121 A 5.2512 8.9163 128.2154 49.7698 23.0022 175.1037 122 L 4.1237 8.8352 119.6773 54.7049 41.9388 177.5367 123 A 4.0770 8.7582 126.1299 55.1985 18.5919 177.6804 124 E 4.0652 7.8982 117.3630 56.6929 29.6845 176.8856 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 2.10 1.93 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 2.30 2.35 0.00 3 A 8.73 4.50 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 9.31 4.37 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 0.88 0.00 0.00 0.98 0.00 0.00 5 K 8.71 4.83 0.00 1.63 1.67 0.00 1.71 0.00 0.00 1.69 0.00 0.00 2.92 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.29 1.39 7.81 6 T 9.27 4.65 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 1.27 0.00 0.00 7 D 8.66 4.52 0.00 2.61 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 8 R 7.88 4.32 0.00 1.84 1.95 0.00 3.22 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 1.61 1.62 0.00 9 A 7.43 4.72 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 10 P 0.00 4.23 0.00 2.11 2.10 0.00 3.72 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.41 0.00 11 A 8.48 3.97 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 8.16 4.20 0.65 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 0.00 0.00 0.00 0.00 0.00 0.00 13 I 9.47 4.03 1.93 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 1.34 0.87 0.92 0.00 0.00 14 G 8.08 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 0.00 0.00 0.00 0.00 15 P 0.00 4.69 0.00 2.13 2.12 0.00 3.87 0.00 0.00 3.81 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 7.47 4.84 0.00 3.19 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 17 A 8.22 4.88 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 18 Q 8.58 4.39 0.00 2.22 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.75 0.00 0.00 0.00 0.00 0.00 2.50 2.36 0.00 19 A 7.53 5.01 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 20 V 8.59 4.83 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 1.05 0.00 0.00 0.99 0.00 0.00 21 K 9.23 5.04 0.00 1.68 1.79 0.00 1.82 0.00 0.00 1.95 0.00 0.00 2.83 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.48 1.44 7.81 22 A 9.73 4.39 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 10.38 4.28 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 24 G 8.63 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 0.00 0.00 0.00 25 F 8.38 5.26 0.00 2.72 2.38 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 26 V 8.82 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 1.12 0.00 0.00 0.95 0.00 0.00 27 F 9.32 4.89 0.00 3.04 3.03 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 28 V 8.59 4.66 2.18 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 1.03 0.00 0.00 1.00 0.00 0.00 29 S 9.17 4.38 0.00 4.03 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 30 G 8.61 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 0.00 0.00 0.00 31 Q 9.24 4.97 0.00 2.02 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.53 0.00 0.00 0.00 0.00 0.00 2.54 2.48 0.00 32 I 8.08 4.92 1.89 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 1.37 0.95 0.92 0.00 0.00 33 P 0.00 4.73 0.00 2.12 2.09 0.00 3.56 0.00 0.00 3.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.16 0.00 34 L 7.49 5.00 0.00 1.62 1.57 0.95 0.96 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 35 A 8.49 4.32 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 36 P 0.00 4.33 0.00 2.05 2.34 0.00 3.69 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 2.19 0.00 37 D 7.96 4.40 0.00 2.79 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 G 8.17 4.09 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 0.00 39 S 7.89 4.33 0.00 3.97 4.14 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 40 L 8.36 4.66 0.00 1.69 1.62 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 41 V 8.53 4.15 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 0.83 0.00 0.00 0.94 0.00 0.00 42 E 9.60 4.41 0.00 2.00 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 2.26 2.30 0.00 43 G 8.47 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 44 D 8.40 4.65 0.00 2.94 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 8.34 3.75 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 1.70 0.71 0.98 0.00 0.00 46 R 8.09 4.09 0.00 2.20 2.06 0.00 3.14 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.73 0.00 47 V 8.04 3.61 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 1.12 0.00 0.00 1.00 0.00 0.00 48 Q 8.06 4.01 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.55 0.00 0.00 0.00 0.00 0.00 2.58 2.42 0.00 49 T 8.98 4.00 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 1.28 0.00 0.00 50 E 8.03 4.04 0.00 2.14 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 0.00 2.36 2.45 0.00 51 R 7.80 4.05 0.00 1.92 2.09 0.00 3.44 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.67 0.00 52 V 7.71 3.73 2.31 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 1.15 0.00 0.00 1.09 0.00 0.00 *54 E 8.16 4.19 0.00 2.16 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 2.42 2.30 0.00 55 N 8.32 4.32 0.00 2.91 2.88 0.00 0.00 7.00 6.29 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 56 L 7.87 3.98 0.00 1.63 1.73 1.06 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 57 K 8.01 3.75 0.00 1.74 1.99 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.97 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.51 1.51 7.81 58 A 8.02 3.96 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 59 V 7.88 3.53 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 1.07 0.00 0.00 0.99 0.00 0.00 60 L 8.25 4.00 0.00 1.91 1.82 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 61 E 8.67 4.18 0.00 2.24 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 8.07 4.18 1.34 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 63 A 7.67 4.38 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 64 G 8.52 3.86 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 0.00 0.00 0.00 65 S 7.97 4.36 0.00 3.82 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 0.00 66 G 8.02 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 67 L 7.95 4.03 0.00 1.60 1.50 0.90 0.49 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 68 S 8.08 4.25 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 7.72 4.49 0.00 1.89 1.95 0.00 3.08 0.00 0.00 3.27 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.53 0.00 70 V 7.79 4.26 2.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 1.17 0.00 0.00 71 V 8.87 4.41 2.15 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 0.70 0.00 0.00 1.11 0.00 0.00 72 Q 7.71 5.15 0.00 2.09 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.87 0.00 0.00 0.00 0.00 0.00 2.33 2.34 0.00 73 T 8.66 5.12 4.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 74 T 9.05 4.62 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 0.84 0.00 0.00 75 C 8.90 4.90 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 9.00 5.31 0.00 2.95 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 77 L 9.02 5.22 0.00 1.47 1.46 0.92 0.13 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 8.40 4.35 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 79 D 7.37 4.22 0.00 2.70 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 8.91 4.29 0.00 2.40 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 2.24 2.36 0.00 82 D 8.31 4.65 0.00 2.81 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 83 F 8.29 4.07 0.00 3.17 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 84 P 0.00 4.35 0.00 2.24 2.15 0.00 3.87 0.00 0.00 4.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 85 G 8.04 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 0.00 0.00 0.00 86 F 8.39 4.14 0.00 2.99 3.11 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 87 N 8.29 3.72 0.00 1.75 2.40 0.00 0.00 6.93 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 88 E 7.87 3.84 0.00 2.05 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 2.31 2.30 0.00 89 V 7.57 3.76 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 1.06 0.00 0.00 90 Y 8.07 4.04 0.00 2.38 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 91 A 8.12 4.17 1.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 3.88 0.00 1.54 1.51 0.00 3.13 0.00 0.00 3.09 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.88 0.00 93 Y 7.61 3.99 0.00 2.25 2.48 0.00 0.00 0.00 0.00 0.00 0.00 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 7.81 4.94 0.00 3.08 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 95 T 8.15 4.64 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 3.80 0.00 1.82 1.71 0.00 3.44 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 4.29 0.00 2.04 1.99 0.00 3.64 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 98 Y 8.19 4.55 0.00 3.03 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 99 P 0.00 4.63 0.00 1.81 1.95 0.00 3.68 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 1.43 2.31 0.00 100 A 8.68 4.38 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 0.00 101 R 8.24 5.04 0.00 1.72 1.68 0.00 2.76 0.00 0.00 2.73 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.53 0.00 102 A 8.60 4.67 1.10 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 0.00 103 T 8.38 4.94 4.16 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 0.00 0.00 0.00 1.24 0.00 0.00 104 V 8.46 4.50 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 0.54 0.00 0.00 0.98 0.00 0.00 105 A 8.49 5.16 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 8.42 4.29 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 0.80 0.00 0.00 1.04 0.00 0.00 107 K 8.74 3.98 0.00 1.70 1.81 0.00 1.76 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.43 7.81 108 A 7.42 4.66 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 8.00 4.80 0.00 1.85 1.50 1.01 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 110 P 0.00 4.35 0.00 2.12 1.94 0.00 3.72 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 2.03 2.04 0.00 111 R 9.58 3.92 0.00 1.88 1.96 0.00 3.37 0.00 0.00 3.24 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 112 G 8.12 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 0.00 113 V 7.44 3.89 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 0.78 0.00 0.00 1.04 0.00 0.00 114 R 8.66 4.61 0.00 1.93 2.17 0.00 2.97 0.00 0.00 3.31 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.62 0.00 115 V 7.49 5.01 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 0.94 0.00 0.00 116 E 9.22 5.54 0.00 2.06 1.89 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 2.33 2.24 0.00 117 V 8.68 5.07 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 1.25 0.00 0.00 1.26 0.00 0.00 118 A 8.79 5.37 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 0.00 119 C 8.28 5.11 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 8.91 4.90 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 0.43 0.00 0.00 0.95 0.00 0.00 121 A 8.92 5.25 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 0.00 0.00 0.00 0.00 0.00 0.00 122 L 8.84 4.12 0.00 1.47 1.50 0.88 0.30 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 0.00 123 A 8.76 4.08 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 0.00 124 E 7.90 4.07 0.00 1.92 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 2.25 2.20 0.00 * Residues marked with a * may have inaccurate shift predictions.