NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 D 4.6164 8.3649 120.5354 54.0692 42.2749 174.4009 2 I 4.0705 8.2607 123.0687 60.3998 38.0386 170.3392 3 V 4.5251 9.4818 121.7257 59.6287 35.0483 174.3534 4 L 5.2223 8.4119 122.7831 53.3856 44.4839 175.3393 5 T 4.6997 9.2428 120.2241 61.9214 71.3086 173.0863 6 Q 5.4168 8.8454 125.3311 54.5656 31.0852 175.1815 7 S 4.8732 9.2141 116.8119 56.2516 66.8357 172.1798 8 P 4.8680 0.0000 0.0000 62.0897 32.4267 176.0711 9 A 4.5417 8.4833 120.2490 54.7367 19.3744 177.5817 10 S 5.1619 7.7701 107.7105 57.2018 66.1390 173.8862 11 L 4.8104 9.3030 123.8838 53.6711 45.6746 174.7883 12 S 5.3948 8.7958 121.4125 57.1285 64.5681 173.2784 13 A 4.9076 9.6158 125.2630 50.9090 23.1651 175.1041 14 S 5.0381 8.7385 114.8835 56.4785 65.7702 174.3634 15 V 4.1145 8.4011 121.6113 64.6975 31.9292 176.5152 16 G 4.0616 9.9332 115.0297 45.6199 0.0000 173.6256 17 E 4.4244 7.9692 119.0716 56.5978 30.9834 175.8750 18 T 4.8697 8.2567 118.3926 62.1349 70.3604 174.4460 19 V 4.5489 8.6743 119.1452 59.7412 36.1366 174.6998 20 T 5.0685 8.3006 118.2291 61.7192 71.8131 173.4226 21 I 4.6441 8.9983 119.2967 59.3547 40.9781 174.4935 22 T 5.3804 8.9240 120.4343 62.1243 72.2471 172.3933 23 C 5.4620 9.8250 126.7901 55.7266 42.7861 173.3703 24 R 5.4595 9.6214 126.9922 55.0656 32.1339 171.0876 25 A 5.2160 8.9548 125.4661 49.7434 21.3977 177.4892 26 S 4.5878 8.8550 114.9679 58.6380 63.6949 174.1196 27 G 4.1404 7.5044 107.7733 44.2378 0.0000 172.7819 28 N 4.2099 8.5937 119.6713 53.5661 39.4201 174.7472 29 I 4.0241 8.0771 117.4535 59.9422 38.5817 175.0933 30 H 3.6949 8.9646 117.4892 57.3378 26.5125 175.2051 31 N 4.3589 8.2802 111.9836 53.9285 37.3218 175.7896 32 Y 4.6254 7.6631 118.6492 56.7444 36.6758 173.0106 33 L 5.2307 7.6585 122.2981 52.9482 46.0923 174.6462 34 A 5.3348 9.1326 127.5606 49.9671 22.5001 174.8753 35 W 5.3007 9.0263 119.7267 55.1627 32.6218 174.5686 36 Y 5.2745 9.6470 120.4839 56.3304 42.0805 174.0617 37 Q 4.6634 9.3605 123.3287 54.2637 32.4491 174.0721 38 Q 4.8132 8.8438 126.2676 54.4253 32.0700 174.4283 39 K 4.7274 8.5916 125.5844 54.6508 34.7411 175.9897 40 Q 3.9551 8.6886 122.8544 58.2208 28.9865 177.5331 41 G 3.9385 9.0500 112.5399 45.5452 0.0000 172.4283 42 K 4.6352 8.0146 118.3592 53.9874 35.3178 175.7747 43 S 4.4790 8.2006 114.7614 56.8739 64.1396 172.2098 44 P 4.7073 0.0000 0.0000 62.9324 32.1018 175.9499 45 Q 4.7621 9.2684 121.2536 53.7110 32.2935 174.7883 46 L 4.1875 8.9946 126.3290 55.8084 42.5261 175.3340 47 L 4.5513 9.0189 125.1538 55.8541 44.1011 176.5403 48 V 5.1412 7.6338 117.4839 61.3468 35.4127 173.2045 49 Y 5.0564 8.5872 124.1025 55.1150 42.0181 173.7131 50 Y 3.8169 9.4623 117.9878 59.1934 37.1189 171.3433 51 T 3.8580 8.5667 123.5363 64.5995 68.0373 174.4532 52 T 4.6096 7.5509 105.7763 61.3273 70.4416 173.6042 53 T 4.1252 7.6873 121.0558 62.7985 69.3531 174.3062 54 L 4.6958 8.4082 126.7213 54.4108 42.7872 176.9695 55 A 4.6019 9.3257 127.2928 51.8857 20.0893 177.4676 56 D 4.5716 8.6294 118.3491 54.7187 40.2206 178.0048 57 G 4.0197 8.8775 110.9199 44.8203 0.0000 173.7318 58 V 3.8694 7.6389 120.1777 61.1629 32.3034 174.1323 59 P 4.5233 0.0000 0.0000 62.8383 31.7400 177.0016 60 S 4.5487 8.5679 113.6117 59.3809 63.4288 175.1001 61 R 4.0335 7.9279 118.5165 58.3538 30.4110 175.9650 62 F 5.1231 7.8760 119.7343 56.3713 40.3781 175.6435 63 S 4.6494 9.2479 117.6877 56.8609 66.4225 173.2088 64 G 4.5521 8.9530 109.6459 43.9903 0.0000 171.9845 65 S 4.7418 9.5493 115.8217 56.8406 67.2555 172.8148 66 G 4.2546 8.1939 106.4604 43.1498 0.0000 172.2139 67 S 4.3497 7.7730 113.6090 58.5430 66.8573 180.0890 68 G 3.6859 7.6997 111.9714 47.4107 0.0000 175.3582 69 T 4.6747 8.4644 115.5627 60.7601 69.2378 172.5781 70 Q 4.7767 7.7421 124.2909 54.7996 31.8463 173.6876 71 Y 5.1862 9.1062 122.9567 56.5048 42.7883 174.5470 72 S 5.3997 10.0278 117.8009 56.8467 68.0766 172.7586 73 L 4.6224 8.6044 123.9959 52.9952 44.4836 174.8525 74 K 4.7243 9.0222 128.2050 54.5652 34.8252 174.6355 75 I 4.3291 8.4574 128.3525 59.3392 39.4634 174.4874 76 N 4.5132 9.0044 126.4231 54.1587 39.2088 176.6240 77 S 4.1311 8.4192 111.2031 57.8148 61.8102 170.7812 78 L 3.8783 8.5992 129.0078 56.1995 42.4066 176.8473 79 Q 4.6945 8.7523 121.1782 53.2681 31.4104 174.9562 80 P 4.6640 0.0000 0.0000 65.9953 31.4972 178.6092 81 D 4.5598 8.1976 115.9882 55.8290 39.3350 176.7163 82 D 4.7758 8.1383 118.6763 55.1950 41.3019 176.7015 83 F 4.5755 8.0970 118.5263 56.4284 40.1480 176.7718 84 G 3.8692 7.5561 109.3930 45.7222 0.0000 171.0025 85 S 5.2734 7.7864 116.0497 57.1009 65.5141 173.1534 86 Y 5.0209 8.9948 121.3645 56.3781 41.0051 174.3314 87 Y 5.5254 9.4510 121.0019 56.4189 41.8956 172.3305 88 C 5.0098 9.0982 116.9564 53.9549 44.7188 172.2063 89 Q 4.8368 8.6354 120.4606 54.9206 32.3850 173.2123 90 H 5.4734 8.0651 120.4286 53.6412 31.4293 173.6391 91 F 4.7354 8.9669 116.1692 57.0066 40.1842 175.2480 92 W 4.4792 8.9752 129.7270 56.8802 31.4376 176.2952 93 S 2.9217 7.6186 123.6056 59.1802 61.3372 172.0097 94 T 4.6077 7.8349 106.7478 58.9402 71.3409 171.7901 95 P 4.4409 0.0000 0.0000 62.5252 32.2887 175.9678 96 R 4.1559 7.9384 118.0669 56.0297 31.3426 175.7177 97 T 4.6574 7.5327 109.9634 60.5748 72.7293 172.2081 98 F 5.0914 8.6690 119.9982 55.4603 41.8640 176.0118 99 G 4.0673 9.0302 110.9837 44.6696 0.0000 174.5901 100 G 3.7165 8.5723 108.0732 46.8318 0.0000 175.0742 101 G 3.6680 8.8514 106.0997 45.6027 0.0000 173.0289 102 T 4.7556 8.1905 116.5375 61.4027 72.3386 172.8655 103 K 4.6222 9.0548 129.1746 55.1242 34.0013 174.8895 104 L 5.2971 9.4918 131.3763 53.6668 43.5520 174.7794 105 E 5.2281 9.3357 125.0693 54.0666 33.0386 175.1988 106 I 3.4928 7.8859 122.3655 60.6504 38.7646 175.4638 107 K 4.1933 8.6531 130.0111 56.7296 31.6608 176.3859 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 D 8.36 4.62 0.00 2.68 2.69 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 2 I 8.26 4.07 1.82 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.68 0.85 0.00 0.00 3 V 9.48 4.53 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 0.75 0.00 0.00 0.96 0.00 0.00 4 L 8.41 5.22 0.00 1.68 1.56 0.90 0.62 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 5 T 9.24 4.70 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 1.26 0.00 0.00 6 Q 8.85 5.42 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.50 6.72 0.00 0.00 0.00 0.00 0.00 2.41 2.44 0.00 7 S 9.21 4.87 0.00 3.84 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 8 P 0.00 4.87 0.00 2.39 2.12 0.00 3.78 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 2.00 1.97 0.00 9 A 8.48 4.54 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 10 S 7.77 5.16 0.00 3.87 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 11 L 9.30 4.81 0.00 1.71 1.51 0.92 0.81 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 12 S 8.80 5.39 0.00 3.81 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 13 A 9.62 4.91 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 14 S 8.74 5.04 0.00 3.82 3.80 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 15 V 8.40 4.11 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 0.89 0.00 0.00 1.11 0.00 0.00 16 G 9.93 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 17 E 7.97 4.42 0.00 1.98 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 2.33 2.50 0.00 18 T 8.26 4.87 4.17 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 1.20 0.00 0.00 19 V 8.67 4.55 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 0.61 0.00 0.00 0.67 0.00 0.00 20 T 8.30 5.07 4.17 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 1.14 0.00 0.00 21 I 9.00 4.64 1.87 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.91 0.76 0.00 0.00 22 T 8.92 5.38 4.48 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 1.30 0.00 0.00 23 C 9.82 5.46 0.00 2.84 2.94 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 24 R 9.62 5.46 0.00 1.47 1.74 0.00 3.30 0.00 0.00 3.17 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.41 0.00 25 A 8.95 5.22 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 26 S 8.86 4.59 0.00 3.91 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 27 G 7.50 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 0.00 0.00 0.00 28 N 8.59 4.21 0.00 2.53 2.44 0.00 0.00 6.86 7.94 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 29 I 8.08 4.02 1.92 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.55 0.87 0.00 0.00 30 H 8.96 3.69 0.00 3.15 3.38 0.00 5.96 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 N 8.28 4.36 0.00 2.45 1.97 0.00 0.00 6.98 6.75 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 32 Y 7.66 4.63 0.00 3.43 3.21 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 33 L 7.66 5.23 0.00 0.91 0.89 0.45 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 34 A 9.13 5.33 1.41 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 0.00 0.00 0.00 35 W 9.03 5.30 0.00 3.22 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 36 Y 9.65 5.27 0.00 3.17 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 37 Q 9.36 4.66 0.00 1.83 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.06 1.68 0.00 38 Q 8.84 4.81 0.00 2.24 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.57 0.00 0.00 0.00 0.00 0.00 2.27 2.39 0.00 39 K 8.59 4.73 0.00 1.77 1.73 0.00 1.77 0.00 0.00 1.78 0.00 0.00 2.96 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.44 7.81 40 Q 8.69 3.96 0.00 2.01 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.88 0.00 0.00 0.00 0.00 0.00 2.37 2.47 0.00 41 G 9.05 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 42 K 8.01 4.64 0.00 1.81 1.71 0.00 1.72 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.36 1.49 7.81 43 S 8.20 4.48 0.00 3.93 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 44 P 0.00 4.71 0.00 1.77 1.98 0.00 3.50 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.97 0.00 45 Q 9.27 4.76 0.00 2.13 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 46 L 8.99 4.19 0.00 1.85 1.67 0.83 0.94 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 47 L 9.02 4.55 0.00 1.78 1.51 0.97 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 48 V 7.63 5.14 2.35 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 1.25 0.00 0.00 0.94 0.00 0.00 49 Y 8.59 5.06 0.00 2.95 2.94 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 50 Y 9.46 3.82 0.00 3.10 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 51 T 8.57 3.86 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 1.37 0.00 0.00 52 T 7.55 4.61 4.22 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 1.27 0.00 0.00 53 T 7.69 4.13 3.25 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 0.91 0.00 0.00 54 L 8.41 4.70 0.00 1.53 1.61 1.05 0.93 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 55 A 9.33 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 56 D 8.63 4.57 0.00 2.71 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 57 G 8.88 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 0.00 0.00 0.00 58 V 7.64 3.87 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 0.58 0.00 0.00 0.93 0.00 0.00 59 P 0.00 4.52 0.00 2.40 2.26 0.00 3.79 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 2.50 2.13 0.00 60 S 8.57 4.55 0.00 4.01 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 61 R 7.93 4.03 0.00 1.78 2.16 0.00 2.79 0.00 0.00 3.29 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 1.17 0.00 62 F 7.88 5.12 0.00 2.94 2.95 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 63 S 9.25 4.65 0.00 3.79 3.87 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 64 G 8.95 4.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.55 4.74 0.00 3.79 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 66 G 8.19 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 0.00 0.00 0.00 0.00 67 S 7.77 4.35 0.00 3.84 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 68 G 7.70 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 0.00 0.00 0.00 69 T 8.46 4.67 4.45 0.00 0.00 0.00 0.00 0.00 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 70 Q 7.74 4.78 0.00 2.04 1.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.67 6.76 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 71 Y 9.11 5.19 0.00 3.24 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 72 S 10.03 5.40 0.00 3.66 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 73 L 8.60 4.62 0.00 0.27 0.31 0.62 -0.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 74 K 9.02 4.72 0.00 1.67 1.49 0.00 1.53 0.00 0.00 1.56 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.41 7.81 75 I 8.46 4.33 1.41 0.00 0.00 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.66 0.24 -0.09 0.00 0.00 76 N 9.00 4.51 0.00 2.53 2.64 0.00 0.00 7.31 7.61 0.00 0.00 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 S 8.42 4.13 0.00 4.02 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 78 L 8.60 3.88 0.00 1.57 1.32 0.67 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 8.75 4.69 0.00 2.07 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.99 6.74 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 80 P 0.00 4.66 0.00 2.27 2.21 0.00 3.68 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.19 2.21 0.00 81 D 8.20 4.56 0.00 2.88 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 82 D 8.14 4.78 0.00 2.49 2.66 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 83 F 8.10 4.58 0.00 3.03 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 G 7.56 3.87 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 0.00 0.00 0.00 85 S 7.79 5.27 0.00 3.84 3.58 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.99 5.02 0.00 3.02 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 Y 9.45 5.53 0.00 3.20 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 88 C 9.10 5.01 0.00 2.06 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 89 Q 8.64 4.84 0.00 1.97 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.71 0.00 0.00 0.00 0.00 0.00 1.45 1.16 0.00 90 H 8.07 5.47 0.00 3.26 3.19 0.00 5.75 0.00 0.00 0.00 0.00 6.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 F 8.97 4.74 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 92 W 8.98 4.48 0.00 3.63 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 93 S 7.62 2.92 0.00 3.06 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 94 T 7.83 4.61 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 1.11 0.00 0.00 95 P 0.00 4.44 0.00 2.15 2.05 0.00 3.75 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.04 0.00 96 R 7.94 4.16 0.00 1.38 1.32 0.00 3.02 0.00 0.00 3.07 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 1.29 0.00 97 T 7.53 4.66 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 1.29 0.00 0.00 98 F 8.67 5.09 0.00 2.85 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 99 G 9.03 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 0.00 100 G 8.57 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 0.00 101 G 8.85 3.67 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 0.00 0.00 0.00 102 T 8.19 4.76 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 1.31 0.00 0.00 103 K 9.05 4.62 0.00 1.86 1.73 0.00 1.84 0.00 0.00 1.63 0.00 0.00 2.84 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.44 7.81 104 L 9.49 5.30 0.00 2.14 1.78 0.61 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 105 E 9.34 5.23 0.00 2.01 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 0.00 2.47 2.24 0.00 106 I 7.89 3.49 0.72 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.12 0.66 0.00 0.00 107 K 8.65 4.19 0.00 1.78 1.66 0.00 1.89 0.00 0.00 1.74 0.00 0.00 2.94 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.44 1.39 7.81