NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9056 8.3544 109.7366 45.3857 0.0000 173.0983 2 S 4.0642 8.4083 113.5226 57.0838 62.9877 168.9770 3 V 3.9285 8.5050 127.1853 61.8550 33.0185 175.0014 4 A 4.3687 8.1010 130.3715 50.3424 19.5846 175.1368 5 P 4.1392 0.0000 0.0000 63.0822 31.2605 173.6930 6 V 3.0502 8.4235 129.0967 62.0914 28.9261 171.0037 7 E 4.1333 8.3970 125.3415 56.3294 28.3212 177.0797 8 T 4.2975 8.1217 120.4502 63.0710 69.7333 174.3288 9 L 4.6425 8.4818 122.8588 55.9820 44.3820 176.8093 10 E 4.5870 7.8306 115.8399 54.4064 34.5833 176.0902 11 V 3.4147 8.5083 112.4847 62.2928 30.3889 172.1102 12 E 4.7123 7.2893 117.0569 55.5748 32.2035 174.5996 13 K 3.3242 8.9910 127.3448 57.0476 31.0289 177.9264 14 W 4.3702 8.0377 114.6338 59.5712 29.1180 174.9874 15 F 4.9170 7.6332 126.9116 56.3329 38.3541 174.0021 16 F 4.9765 8.3548 122.9360 55.7563 42.7082 173.6745 17 R 4.6059 7.6738 117.7668 54.3908 33.4148 176.2384 18 T 4.4809 8.0027 111.9524 62.9157 63.7975 174.2279 19 I 4.0924 7.4583 124.2086 59.4598 39.8714 175.0906 20 S 4.2969 8.4107 118.0221 57.8167 62.7560 174.7868 21 R 3.9061 8.8185 125.0116 59.6494 29.5136 178.7950 22 K 4.1922 7.9336 115.4804 59.0721 33.1551 178.3823 23 D 4.4857 8.2157 121.0027 57.4326 40.9157 178.3842 24 A 4.1364 8.0230 120.6676 55.1631 18.3332 179.3293 25 E 4.0045 8.0136 116.5201 59.2156 29.3226 179.5275 26 R 3.9385 7.6166 115.3460 59.3515 29.5356 178.6429 27 Q 4.1633 7.9882 117.2095 57.9874 28.7220 177.7550 28 L 4.2545 7.4021 119.6715 57.3309 41.8302 178.8837 29 L 4.4536 8.1972 118.1858 55.1897 42.1180 177.6579 30 A 4.1675 7.2361 122.3506 51.3059 18.8048 176.4449 31 P 4.5937 0.0000 0.0000 64.2051 31.5465 177.3873 32 M 4.2380 7.8829 118.8391 57.4909 32.2511 174.9998 33 N 5.2218 7.4477 115.6317 53.1061 42.2186 172.9713 34 K 4.0398 8.4373 114.7200 57.2781 35.3764 174.0623 35 A 4.6952 7.4373 122.2148 56.1817 17.5300 176.0983 36 G 3.9377 9.4081 115.0963 46.8025 0.0000 173.3877 37 S 5.0199 8.3510 116.8352 58.0541 63.9757 173.9307 38 F 5.4849 8.8520 121.5523 55.7572 43.6853 173.7756 39 L 5.1108 8.6123 118.3902 52.2861 45.7468 176.0756 40 I 5.5091 9.1373 124.6972 58.1361 38.6486 174.4156 41 R 5.0823 8.6867 123.8709 54.7485 31.3010 175.9273 42 E 3.8835 8.4480 118.6670 55.4222 31.5945 175.5531 43 S 4.4524 8.0859 116.6287 57.6029 63.2092 174.6234 44 E 4.1942 9.0133 124.6113 57.5934 29.6168 177.0974 45 S 4.7105 7.4132 112.5812 57.8800 63.4567 173.9101 46 N 4.5241 7.9749 118.4540 53.3608 37.7442 175.1975 47 K 4.4110 8.4912 119.5773 56.8132 32.9997 177.2747 48 G 4.0062 8.9839 104.7865 47.5712 0.0000 173.7510 49 A 4.6336 7.7164 121.0681 51.8469 20.0151 177.1901 50 F 5.2078 9.0738 117.3492 56.6001 43.6674 173.7606 51 S 5.1139 9.2202 114.1972 58.6555 68.2817 173.2574 52 L 5.0797 8.6550 121.5094 54.4788 45.7465 173.8732 53 S 5.8003 9.0319 121.9904 56.1802 65.9333 173.3573 54 V 4.1041 7.9096 122.1033 60.9389 35.5532 174.2813 55 K 4.1422 8.3063 128.4152 55.7151 32.2021 174.3408 56 D 4.6418 9.1444 127.8556 53.7708 42.0567 175.4794 57 I 4.4407 8.2024 129.3833 60.1965 35.1692 175.1934 58 T 4.3318 7.6055 120.9476 60.6000 69.0605 174.9729 59 T 3.9603 8.1955 117.2122 63.4488 67.7398 175.3915 60 Q 3.9821 7.9272 119.9360 59.1288 28.8780 174.9699 61 G 3.2440 7.8859 114.1303 45.5024 0.0000 173.4426 62 E 3.7101 6.9162 123.7894 56.7963 26.9653 175.1377 63 V 4.5381 8.2465 119.8995 58.8375 35.3819 176.4977 64 V 4.4413 7.7918 125.9625 62.6025 31.5536 174.6684 65 K 4.4549 8.0070 115.9459 55.7620 37.0902 174.5706 66 H 5.2957 7.6993 117.3511 54.7490 32.4234 172.7855 67 Y 4.9159 8.9296 119.6216 56.0401 42.5799 174.7110 68 K 4.8197 8.8281 120.7329 55.2384 34.7853 174.7080 69 I 4.7175 8.1872 120.9109 60.0677 39.1658 174.8338 70 R 4.9467 8.2749 127.3111 54.3637 32.2878 175.7687 71 S 4.4203 8.6351 118.6300 57.3388 64.7283 172.8288 72 L 4.8458 8.2896 125.6295 52.8261 43.2143 177.8939 73 D 4.3488 8.9134 122.4872 55.5306 39.7629 176.7265 74 N 4.8421 8.0435 114.2657 52.5215 37.7985 175.8869 75 G 3.9833 7.8913 104.2778 46.3042 0.0000 173.3817 76 G 3.8681 8.6904 110.4649 45.4069 0.0000 173.4884 77 Y 5.3651 7.6882 113.9742 56.3587 43.3329 173.9396 78 Y 5.5644 8.8781 120.6000 55.7497 41.4215 175.1114 79 I 4.3955 8.3252 114.9471 61.2544 39.5930 176.0468 80 S 4.9848 8.0152 117.5292 55.4549 64.5278 173.3844 81 P 3.9901 0.0000 0.0000 64.6606 31.3930 177.8852 82 R 4.0003 8.1193 114.7686 57.7827 29.6550 176.5291 83 I 4.4087 7.9368 113.4322 59.0553 38.7315 174.6035 84 T 5.2982 8.0484 121.0531 61.7775 72.2092 173.3546 85 F 4.7379 8.9060 121.5038 55.1951 43.0977 174.1711 86 P 4.3804 0.0000 0.0000 64.9462 31.3703 175.4967 87 T 4.7120 7.3943 112.1184 60.3158 70.1199 173.5398 88 L 3.7568 8.0944 124.3540 57.5050 41.2912 179.7229 89 Q 3.6606 8.0301 117.0470 59.0013 28.0822 178.2135 90 A 4.1039 7.5188 122.1845 53.5881 18.5383 179.2143 91 L 2.4400 6.9967 118.8432 57.0295 42.0529 178.1389 92 V 3.2484 6.8554 116.0361 63.2745 31.1541 177.2302 93 Q 3.9643 6.8324 117.3252 59.7312 29.1479 177.4325 94 H 4.1164 7.1985 120.0879 58.9543 29.8813 176.9061 95 Y 4.6645 7.1807 119.2332 60.4005 37.2955 178.5099 96 S 3.9092 7.1648 115.0741 60.9251 63.0553 175.4448 97 K 4.2322 7.5376 117.1835 56.3046 33.2948 176.5195 98 K 4.1125 7.9662 118.3924 55.3765 33.2336 175.3434 99 G 3.4167 8.6176 117.0905 46.7830 0.0000 170.5340 100 D 4.3814 9.0381 117.1131 54.4931 38.6035 173.3826 101 G 3.9954 7.7942 108.5150 45.2692 0.0000 173.3419 102 L 3.5703 7.2344 118.1081 55.4055 41.6563 178.2669 103 C 3.8437 7.9859 111.6039 58.4175 29.1054 173.4479 104 Q 4.3408 7.5437 118.3939 55.3999 31.3183 173.9400 105 K 4.2387 8.3640 123.2692 55.5989 33.9244 176.8989 106 L 4.5421 8.0652 121.1617 54.7694 41.5776 175.7494 107 T 4.3934 7.4735 107.8674 62.0237 71.4927 173.9061 108 L 4.4607 7.4125 123.6489 51.2978 44.7724 173.5752 109 P 4.2533 0.0000 0.0000 63.6129 30.9184 177.7891 110 C 4.1253 8.2837 124.1866 59.5424 27.9064 174.5703 111 V 4.2700 8.0576 127.6162 60.2747 32.2457 175.4283 112 N 4.3682 8.8089 123.3319 52.8939 37.2894 174.8877 113 L 4.5902 8.2064 122.6533 52.7741 43.1564 176.3399 114 A 4.1510 8.2246 124.9598 52.5926 18.8653 176.1563 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 G 8.35 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2 S 8.41 4.06 0.00 3.92 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 3 V 8.50 3.93 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 0.80 0.00 0.00 0.93 0.00 0.00 4 A 8.10 4.37 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 5 P 0.00 4.14 0.00 2.19 2.10 0.00 3.88 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.95 0.00 6 V 8.42 3.05 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 0.86 0.00 0.00 0.93 0.00 0.00 7 E 8.40 4.13 0.00 2.00 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 2.31 2.27 0.00 8 T 8.12 4.30 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 1.24 0.00 0.00 9 L 8.48 4.64 0.00 1.58 1.68 0.92 0.88 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 10 E 7.83 4.59 0.00 1.88 1.50 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 2.38 2.52 0.00 11 V 8.51 3.41 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 0.72 0.00 0.00 0.92 0.00 0.00 12 E 7.29 4.71 0.00 1.97 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 2.42 0.00 13 K 8.99 3.32 0.00 1.98 1.73 0.00 1.26 0.00 0.00 1.24 0.00 0.00 3.05 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.35 1.39 7.81 14 W 8.04 4.37 0.00 3.25 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 15 F 7.63 4.92 0.00 1.51 2.41 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 16 F 8.35 4.98 0.00 2.91 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 17 R 7.67 4.61 0.00 1.52 1.72 0.00 3.03 0.00 0.00 3.16 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.37 0.00 18 T 8.00 4.48 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 1.19 0.00 0.00 19 I 7.46 4.09 1.94 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 1.51 0.94 1.08 0.00 0.00 20 S 8.41 4.30 0.00 3.89 3.93 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 0.00 0.00 0.00 21 R 8.82 3.91 0.00 1.88 1.90 0.00 3.14 0.00 0.00 3.27 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 22 K 7.93 4.19 0.00 1.94 1.93 0.00 1.52 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.59 7.81 23 D 8.22 4.49 0.00 3.04 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 24 A 8.02 4.14 1.39 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 25 E 8.01 4.00 0.00 2.23 2.02 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 2.35 2.37 0.00 26 R 7.62 3.94 0.00 2.02 2.30 0.00 3.09 0.00 0.00 3.37 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.70 0.00 27 Q 7.99 4.16 0.00 2.03 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.15 0.00 0.00 0.00 0.00 0.00 2.40 2.69 0.00 28 L 7.40 4.25 0.00 1.82 1.70 0.94 0.58 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 29 L 8.20 4.45 0.00 1.66 1.73 0.93 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 30 A 7.24 4.17 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 31 P 0.00 4.59 0.00 2.19 2.18 0.00 3.77 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 1.99 1.99 0.00 32 M 7.88 4.24 0.00 2.04 2.17 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.61 2.56 0.00 33 N 7.45 5.22 0.00 2.74 2.73 0.00 0.00 6.44 8.39 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 34 K 8.44 4.04 0.00 1.88 1.85 0.00 1.25 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.23 1.33 7.81 35 A 7.44 4.70 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 36 G 9.41 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 37 S 8.35 5.02 0.00 4.04 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 0.00 38 F 8.85 5.48 0.00 2.74 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 39 L 8.61 5.11 0.00 1.50 1.60 0.93 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 40 I 9.14 5.51 2.35 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 1.08 2.84 1.34 0.00 0.00 41 R 8.69 5.08 0.00 2.22 2.18 0.00 3.25 0.00 0.00 3.37 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.63 0.00 42 E 8.45 3.88 0.00 1.16 1.35 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 2.17 2.07 0.00 43 S 8.09 4.45 0.00 3.92 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 44 E 9.01 4.19 0.00 2.05 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 2.24 2.31 0.00 45 S 7.41 4.71 0.00 3.99 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 46 N 7.97 4.52 0.00 2.90 2.81 0.00 0.00 6.61 6.35 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 47 K 8.49 4.41 0.00 1.87 1.92 0.00 1.49 0.00 0.00 1.73 0.00 0.00 3.09 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.34 1.48 7.81 48 G 8.98 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 49 A 7.72 4.63 1.35 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 50 F 9.07 5.21 0.00 3.17 3.12 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 51 S 9.22 5.11 0.00 3.81 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 52 L 8.66 5.08 0.00 1.87 1.73 1.23 1.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 53 S 9.03 5.80 0.00 3.79 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 54 V 7.91 4.10 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 0.95 0.00 0.00 -0.71 0.00 0.00 55 K 8.31 4.14 0.00 1.77 1.81 0.00 1.79 0.00 0.00 1.58 0.00 0.00 2.77 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.44 1.56 7.81 56 D 9.14 4.64 0.00 2.97 2.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 I 8.20 4.44 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 0.96 0.91 0.00 0.00 58 T 7.61 4.33 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 1.30 0.00 0.00 59 T 8.20 3.96 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 60 Q 7.93 3.98 0.00 2.04 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.09 0.00 0.00 0.00 0.00 0.00 2.38 2.34 0.00 61 G 7.89 3.24 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 0.00 0.00 0.00 0.00 62 E 6.92 3.71 0.00 2.08 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 0.00 2.33 2.35 0.00 63 V 8.25 4.54 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 0.77 0.00 0.00 0.98 0.00 0.00 64 V 7.79 4.44 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 1.14 0.00 0.00 0.92 0.00 0.00 65 K 8.01 4.45 0.00 1.76 1.27 0.00 1.54 0.00 0.00 1.65 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.35 1.59 7.81 66 H 7.70 5.30 0.00 2.77 2.99 0.00 5.64 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 Y 8.93 4.92 0.00 3.00 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 68 K 8.83 4.82 0.00 1.77 1.97 0.00 1.55 0.00 0.00 1.95 0.00 0.00 2.92 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.42 1.37 7.81 69 I 8.19 4.72 2.16 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.09 1.05 0.00 0.00 70 R 8.27 4.95 0.00 1.33 1.83 0.00 3.06 0.00 0.00 2.59 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.55 0.00 71 S 8.64 4.42 0.00 3.50 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 72 L 8.29 4.85 0.00 1.67 1.65 1.16 1.02 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 73 D 8.91 4.35 0.00 2.78 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 74 N 8.04 4.84 0.00 2.80 2.93 0.00 0.00 5.76 7.01 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 75 G 7.89 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 76 G 8.69 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 77 Y 7.69 5.37 0.00 3.13 2.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 78 Y 8.88 5.56 0.00 3.40 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 79 I 8.33 4.40 2.03 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.61 1.11 0.00 0.00 80 S 8.02 4.98 0.00 4.03 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 P 0.00 3.99 0.00 1.92 1.70 0.00 3.77 0.00 0.00 3.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.20 0.00 82 R 8.12 4.00 0.00 1.91 2.07 0.00 3.12 0.00 0.00 3.34 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.74 0.00 83 I 7.94 4.41 2.31 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.20 1.12 0.00 0.00 84 T 8.05 5.30 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 1.39 0.00 0.00 85 F 8.91 4.74 0.00 3.10 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 86 P 0.00 4.38 0.00 2.22 2.21 0.00 4.01 0.00 0.00 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.00 0.00 87 T 7.39 4.71 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 1.28 0.00 0.00 88 L 8.09 3.76 0.00 1.58 1.36 0.57 0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 89 Q 8.03 3.66 0.00 2.49 2.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.40 2.44 0.00 90 A 7.52 4.10 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.00 2.44 0.00 1.18 1.39 0.90 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 92 V 6.86 3.25 0.69 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 -0.42 0.00 0.00 -0.77 0.00 0.00 93 Q 6.83 3.96 0.00 2.14 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.08 6.56 0.00 0.00 0.00 0.00 0.00 2.32 2.26 0.00 94 H 7.20 4.12 0.00 3.09 2.76 0.00 5.61 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 Y 7.18 4.66 0.00 2.63 2.60 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 0.00 0.00 0.00 96 S 7.16 3.91 0.00 3.84 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 97 K 7.54 4.23 0.00 1.68 1.80 0.00 1.76 0.00 0.00 1.57 0.00 0.00 2.88 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.29 1.30 7.81 98 K 7.97 4.11 0.00 1.65 1.48 0.00 1.69 0.00 0.00 1.70 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.27 1.47 7.81 99 G 8.62 3.42 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 0.00 0.00 0.00 100 D 9.04 4.38 0.00 2.95 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 0.00 101 G 7.79 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 0.00 0.00 0.00 102 L 7.23 3.57 0.00 1.52 1.63 0.71 0.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 103 C 7.99 3.84 0.00 3.16 3.16 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 0.00 104 Q 7.54 4.34 0.00 2.10 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.49 7.02 0.00 0.00 0.00 0.00 0.00 2.36 2.36 0.00 105 K 8.36 4.24 0.00 2.10 1.88 0.00 1.34 0.00 0.00 1.88 0.00 0.00 3.10 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.48 7.81 106 L 8.07 4.54 0.00 1.33 1.30 0.26 -1.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 107 T 7.47 4.39 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 1.28 0.00 0.00 108 L 7.41 4.46 0.00 1.67 1.57 0.92 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 109 P 0.00 4.25 0.00 2.12 2.30 0.00 3.82 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 2.35 2.19 0.00 110 C 8.28 4.13 0.00 2.96 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 0.00 111 V 8.06 4.27 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 0.93 0.00 0.00 0.94 0.00 0.00 112 N 8.81 4.37 0.00 3.00 2.92 0.00 0.00 6.08 7.80 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 0.00 113 L 8.21 4.59 0.00 1.64 1.65 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 114 A 8.22 4.15 1.21 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 0.00 0.00