NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4310 8.1933 115.4125 58.2807 64.4460 171.3347 2 I 4.2893 8.1116 120.6057 58.7630 39.0861 170.3621 3 V 4.2081 9.3505 129.5525 61.0050 33.4713 174.5492 4 A 5.1071 8.1594 129.9566 49.0965 17.7773 173.5197 5 P 4.3255 0.0000 0.0000 61.9457 32.6324 176.8464 6 S 4.6110 8.3619 115.4271 58.3885 64.2270 173.2764 7 I 4.6101 8.5083 122.5012 59.6972 40.0052 174.6072 8 S 5.2506 8.7014 121.3947 56.7811 65.7363 173.4254 9 I 4.7268 8.7492 125.2589 58.5344 40.0116 173.4127 10 P 4.9205 0.0000 0.0000 62.4342 31.9173 176.1930 11 E 4.1882 8.7308 120.6733 57.0543 30.5408 175.8219 12 N 4.3356 8.7933 115.4641 54.3860 36.4892 175.2295 13 Q 4.2154 8.2499 115.7217 56.3419 29.4419 176.5075 14 R 4.5453 8.0991 119.2761 54.3790 31.8008 176.4875 15 I 3.1548 8.0677 113.4974 60.5065 37.8366 173.6336 16 P 4.5705 0.0000 0.0000 61.6922 32.8109 174.8551 17 F 5.0534 8.1515 117.5035 54.9005 41.9021 173.5798 18 P 4.9746 0.0000 0.0000 62.8253 32.6998 175.4194 19 K 4.6919 8.7139 119.8634 54.4111 35.2931 175.9148 20 I 4.4162 8.4806 125.5208 61.7695 37.5170 176.1962 21 V 4.4384 9.4109 117.4541 60.1042 33.8519 175.1855 22 G 4.1522 7.3172 107.9105 46.2444 0.0000 171.8454 23 R 5.1797 8.2821 115.1675 54.2849 32.5114 175.0241 24 V 4.1891 9.1225 122.9107 62.4778 32.6758 175.3162 25 V 4.4147 8.7205 126.8944 61.5404 34.1507 175.2846 26 V 4.1085 8.5576 124.8190 63.8759 33.1317 175.8477 27 S 4.3594 8.3009 116.3997 58.6941 61.9586 170.0437 28 D 4.6614 7.6580 119.0054 51.9949 38.1585 175.4522 29 R 4.6194 7.3260 119.5993 54.9954 32.9893 175.0783 30 I 4.1084 7.9425 124.0875 60.0102 38.1414 173.6273 31 P 4.7713 0.0000 0.0000 62.4369 31.6748 177.1962 32 G 4.0337 8.3120 113.5374 43.4693 0.0000 172.4134 33 S 4.6274 9.4486 120.7058 58.3224 64.4957 174.2111 34 K 4.8943 8.9976 120.5556 55.3356 36.0084 174.5570 35 I 4.8490 8.4398 122.1882 59.7353 39.4853 174.9047 36 K 4.8462 9.3026 126.1495 54.4111 35.2993 174.8332 37 L 5.3307 8.5664 125.1624 53.6223 44.8991 174.5950 38 Y 4.7792 9.3240 125.3756 56.6551 43.2855 173.2856 39 G 3.8843 7.8423 108.8180 42.9812 0.0000 172.9729 40 K 4.3347 8.3576 119.6625 58.5171 32.6725 176.7375 41 G 4.6380 8.8957 112.3286 44.3075 0.0000 173.5993 42 V 4.3155 7.8160 117.2636 61.9851 34.1926 175.0930 43 D 4.8844 7.9656 120.3826 53.2121 40.9464 176.5403 44 Q 4.7074 7.5040 117.9618 53.7219 32.9013 174.5894 45 E 4.4530 8.8039 121.3914 56.3039 30.4787 174.9156 46 P 4.5332 0.0000 0.0000 62.2898 32.8216 175.6515 47 K 4.3288 8.5386 124.9940 57.0793 32.5992 177.7014 48 G 3.8738 8.9040 112.4185 45.7990 0.0000 174.5196 49 I 3.6234 7.3868 121.8615 62.6235 38.0175 175.9644 50 F 5.4679 8.1056 118.7712 55.4974 42.2224 174.8098 51 K 4.8071 9.1353 119.8514 55.6628 36.6444 174.4982 52 I 5.0182 8.0777 119.4156 59.0585 41.4717 173.9033 53 N 4.7319 9.2487 128.3404 53.0802 39.3945 175.6451 54 E 4.6072 9.0184 123.7420 57.7635 30.4168 178.1124 55 N 4.5068 8.2879 116.6096 55.4180 39.5024 176.5638 56 S 4.1713 9.4732 112.2591 58.9698 63.6612 175.2282 57 G 3.9150 8.3356 109.0488 45.9986 0.0000 172.6421 58 E 4.5938 8.0404 120.1240 56.0445 30.7248 175.9964 59 V 4.8703 9.4078 125.3990 61.4732 34.0158 174.6443 60 S 5.3677 9.1156 122.8083 56.7514 67.0396 173.4102 61 V 4.5055 8.7149 123.3367 60.9026 33.3358 176.4377 62 T 4.6258 8.1329 111.9735 61.6921 70.3565 173.7382 63 K 2.7145 6.8801 119.2608 55.0467 34.9879 174.4811 64 A 4.1787 7.4237 121.1932 51.9966 19.0039 177.0464 65 L 4.7121 8.4980 120.5590 53.0536 45.4194 174.9264 66 D 5.0656 8.3199 119.8001 52.4389 43.1342 176.5101 67 R 3.9847 9.0448 127.5393 59.4199 30.3865 177.6715 68 E 4.0384 8.1577 116.2810 59.0843 29.3619 178.0189 69 A 4.0676 7.7365 121.1317 54.0120 18.8961 177.0366 70 I 4.4139 7.7084 116.1192 58.9342 40.1889 173.9356 71 P 4.7642 0.0000 0.0000 63.3038 32.5269 175.2380 72 S 5.0652 7.1119 112.7252 58.1794 65.4494 174.1520 73 Y 4.7947 9.1743 118.0688 56.3135 42.2789 174.6391 74 Q 4.8511 8.7553 122.5031 54.7501 31.7435 174.1172 75 L 5.0153 8.8303 126.6590 53.0392 45.5153 175.2533 76 Q 5.2527 8.8457 118.3388 54.4631 31.2912 174.9852 77 V 5.1661 8.7702 122.0672 60.0554 34.8494 174.2992 78 E 5.1095 9.1480 120.4961 55.5478 33.8845 173.3886 79 T 5.1781 9.0459 110.4113 60.1820 71.1679 173.6250 80 T 5.1500 9.0710 113.6815 59.9113 73.0076 173.2014 81 D 4.6030 8.5908 122.6277 52.9894 41.9668 177.1607 82 E 4.1637 8.6933 120.4162 59.1789 29.4292 177.0863 83 N 4.7236 8.1969 114.6037 52.5850 38.7579 176.2263 84 G 4.0143 8.5686 105.7335 45.5211 0.0000 174.5173 85 K 4.0780 7.5603 122.1854 55.9580 32.7726 176.3541 86 T 4.4013 8.4326 123.0462 64.1084 68.7224 173.0117 87 I 4.2512 8.3536 126.9378 61.9317 39.1640 175.3545 88 E 4.6258 8.2781 117.8598 54.9462 31.8789 174.7203 89 G 4.3208 8.4377 107.4349 43.2044 0.0000 171.2372 90 P 5.0503 0.0000 0.0000 61.4632 33.8776 174.8435 91 V 4.6094 8.2950 111.7943 59.4789 36.0799 175.1552 92 D 4.8682 8.8081 123.6400 54.3880 41.9160 175.6237 93 L 4.5928 9.0762 124.7953 53.4999 44.5284 174.7412 94 E 4.9560 8.6568 126.2947 55.0999 31.9883 175.2647 95 I 4.9165 8.8533 124.7034 59.4374 40.4898 174.0100 96 L 4.9002 8.9398 129.9964 53.2731 44.2050 175.1236 97 V 4.7407 8.6333 127.4990 61.9458 32.2057 175.2193 98 I 4.4481 8.5237 122.2535 58.9304 40.3648 175.6623 99 D 4.4939 8.5698 121.4649 54.7932 41.0480 176.0477 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 S 8.19 4.43 0.00 4.02 4.10 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 2 I 8.11 4.29 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 1.36 0.76 0.91 0.00 0.00 3 V 9.35 4.21 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 0.94 0.00 0.00 0.93 0.00 0.00 4 A 8.16 5.11 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 5 P 0.00 4.33 0.00 2.05 2.01 0.00 3.67 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 2.03 2.08 0.00 6 S 8.36 4.61 0.00 3.87 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 7 I 8.51 4.61 1.82 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.94 0.96 0.00 0.00 8 S 8.70 5.25 0.00 3.73 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 9 I 8.75 4.73 2.01 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.81 1.03 0.00 0.00 10 P 0.00 4.92 0.00 2.11 2.08 0.00 3.83 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 2.03 2.00 0.00 11 E 8.73 4.19 0.00 2.20 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 2.51 2.33 0.00 12 N 8.79 4.34 0.00 2.95 3.02 0.00 0.00 6.98 7.25 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 13 Q 8.25 4.22 0.00 2.36 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.76 6.90 0.00 0.00 0.00 0.00 0.00 2.43 2.69 0.00 14 R 8.10 4.55 0.00 1.73 1.80 0.00 3.43 0.00 0.00 3.30 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.54 0.00 15 I 8.07 3.15 1.80 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.45 1.04 0.00 0.00 16 P 0.00 4.57 0.00 2.11 1.99 0.00 3.50 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.88 0.00 17 F 8.15 5.05 0.00 2.93 2.97 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 18 P 0.00 4.97 0.00 2.12 2.09 0.00 3.73 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.02 0.00 19 K 8.71 4.69 0.00 1.80 1.73 0.00 1.84 0.00 0.00 1.57 0.00 0.00 2.13 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.21 1.27 7.81 20 I 8.48 4.42 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.48 0.97 0.00 0.00 21 V 9.41 4.44 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 1.12 0.00 0.00 22 G 7.32 4.15 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 0.00 0.00 0.00 23 R 8.28 5.18 0.00 1.76 1.86 0.00 3.04 0.00 0.00 3.16 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.61 0.00 24 V 9.12 4.19 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 0.73 0.00 0.00 0.93 0.00 0.00 25 V 8.72 4.41 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 0.83 0.00 0.00 0.93 0.00 0.00 26 V 8.56 4.11 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 1.31 0.00 0.00 0.97 0.00 0.00 27 S 8.30 4.36 0.00 4.06 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 28 D 7.66 4.66 0.00 2.82 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 29 R 7.33 4.62 0.00 1.77 1.83 0.00 3.23 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 30 I 7.94 4.11 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 1.41 0.66 0.91 0.00 0.00 31 P 0.00 4.77 0.00 2.04 1.99 0.00 3.63 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.07 0.00 32 G 8.31 4.03 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 0.00 0.00 0.00 33 S 9.45 4.63 0.00 3.98 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 34 K 9.00 4.89 0.00 1.86 1.93 0.00 1.48 0.00 0.00 1.65 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.31 1.38 7.81 35 I 8.44 4.85 1.88 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 1.45 0.92 0.00 0.00 36 K 9.30 4.85 0.00 1.76 1.70 0.00 1.62 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.36 7.81 37 L 8.57 5.33 0.00 1.62 1.54 0.97 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 38 Y 9.32 4.78 0.00 3.11 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 39 G 7.84 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 0.00 0.00 0.00 40 K 8.36 4.33 0.00 2.06 1.88 0.00 1.54 0.00 0.00 1.72 0.00 0.00 3.06 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.49 1.61 7.81 41 G 8.90 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 42 V 7.82 4.32 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 1.17 0.00 0.00 0.99 0.00 0.00 43 D 7.97 4.88 0.00 2.62 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 44 Q 7.50 4.71 0.00 1.88 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 7.10 0.00 0.00 0.00 0.00 0.00 2.21 1.92 0.00 45 E 8.80 4.45 0.00 1.85 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 0.00 2.31 2.26 0.00 46 P 0.00 4.53 0.00 2.22 2.21 0.00 3.69 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 2.27 2.20 0.00 47 K 8.54 4.33 0.00 1.59 1.75 0.00 1.73 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.30 0.00 0.00 0.00 0.00 1.33 1.37 7.81 48 G 8.90 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 49 I 7.39 3.62 1.55 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 1.01 -0.05 0.00 0.00 50 F 8.11 5.47 0.00 2.81 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 51 K 9.14 4.81 0.00 1.78 1.87 0.00 1.26 0.00 0.00 1.57 0.00 0.00 2.82 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.40 7.81 52 I 8.08 5.02 1.90 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 1.25 1.16 0.96 0.00 0.00 53 N 9.25 4.73 0.00 2.79 2.69 0.00 0.00 6.91 7.40 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 54 E 9.02 4.61 0.00 2.20 2.20 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 2.37 2.30 0.00 55 N 8.29 4.51 0.00 2.86 2.90 0.00 0.00 6.99 7.57 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 56 S 9.47 4.17 0.00 3.88 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 57 G 8.34 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 58 E 8.04 4.59 0.00 1.99 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 0.00 2.34 2.26 0.00 59 V 9.41 4.87 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 1.08 0.00 0.00 0.98 0.00 0.00 60 S 9.12 5.37 0.00 3.80 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 61 V 8.71 4.51 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 0.98 0.00 0.00 0.55 0.00 0.00 62 T 8.13 4.63 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 1.18 0.00 0.00 63 K 6.88 2.71 0.00 1.39 1.40 0.00 1.38 0.00 0.00 1.51 0.00 0.00 2.87 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.92 1.06 7.81 64 A 7.42 4.18 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 65 L 8.50 4.71 0.00 1.67 1.67 1.10 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 66 D 8.32 5.07 0.00 2.68 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 67 R 9.04 3.98 0.00 1.86 2.04 0.00 3.32 0.00 0.00 3.24 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.73 0.00 68 E 8.16 4.04 0.00 2.14 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 2.26 0.00 69 A 7.74 4.07 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 70 I 7.71 4.41 1.76 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.66 0.11 0.00 0.00 71 P 0.00 4.76 0.00 2.08 2.26 0.00 3.60 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.91 0.00 72 S 7.11 5.07 0.00 3.90 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 73 Y 9.17 4.79 0.00 2.72 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 74 Q 8.76 4.85 0.00 2.01 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.82 0.00 0.00 0.00 0.00 0.00 2.24 2.36 0.00 75 L 8.83 5.02 0.00 1.59 1.73 0.63 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 76 Q 8.85 5.25 0.00 2.15 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.10 6.75 0.00 0.00 0.00 0.00 0.00 2.65 2.42 0.00 77 V 8.77 5.17 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 0.81 0.00 0.00 0.99 0.00 0.00 78 E 9.15 5.11 0.00 2.29 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 0.00 2.18 2.25 0.00 79 T 9.05 5.18 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 1.25 0.00 0.00 80 T 9.07 5.15 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 1.23 0.00 0.00 81 D 8.59 4.60 0.00 2.82 2.65 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 82 E 8.69 4.16 0.00 1.92 2.01 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 2.30 2.31 0.00 83 N 8.20 4.72 0.00 2.78 2.78 0.00 0.00 7.07 7.74 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 84 G 8.57 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 85 K 7.56 4.08 0.00 1.74 1.68 0.00 1.63 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.42 1.40 7.81 86 T 8.43 4.40 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 1.24 0.00 0.00 87 I 8.35 4.25 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 1.38 0.60 0.91 0.00 0.00 88 E 8.28 4.63 0.00 2.13 2.01 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 2.16 2.20 0.00 89 G 8.44 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 90 P 0.00 5.05 0.00 2.08 2.18 0.00 3.70 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 1.91 1.96 0.00 91 V 8.29 4.61 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 0.72 0.00 0.00 0.93 0.00 0.00 92 D 8.81 4.87 0.00 2.56 2.65 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 93 L 9.08 4.59 0.00 1.65 1.47 0.88 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 94 E 8.66 4.96 0.00 1.95 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 2.33 2.32 0.00 95 I 8.85 4.92 1.70 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.41 0.82 0.00 0.00 96 L 8.94 4.90 0.00 1.75 1.67 0.93 0.85 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 97 V 8.63 4.74 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 0.97 0.00 0.00 1.25 0.00 0.00 98 I 8.52 4.45 1.89 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.75 0.99 0.00 0.00 99 D 8.57 4.49 0.00 2.67 2.61 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 0.00 0.00 0.00 0.00