NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2456 8.2644 123.5872 51.4658 20.2981 176.0992 2 S 3.8929 8.2273 112.7163 58.5325 62.1474 172.3244 3 N 4.8739 8.9498 124.3656 52.7733 39.1363 175.2077 4 F 5.0468 7.9489 123.0509 57.5047 37.6646 173.3707 5 T 4.7594 7.8217 113.1842 58.7826 72.3269 174.3760 6 Q 4.8745 8.4995 119.9845 56.6439 29.8002 174.7985 7 F 4.9179 8.3488 114.5066 55.8021 42.1530 173.0381 8 V 4.0586 8.3388 119.6671 62.3545 31.3055 175.2855 9 L 4.0391 8.4393 130.6986 57.0249 42.4307 176.7334 10 V 4.0819 7.2861 120.4398 60.9337 32.3941 173.4611 11 D 4.9312 8.5563 127.6019 53.1478 41.6953 175.4894 12 N 4.8191 8.9886 124.7941 52.6108 39.2035 173.2772 13 G 3.6374 9.1725 113.0264 46.3510 0.0000 174.6566 14 G 3.9846 8.5952 114.4940 47.3138 0.0000 171.5907 15 T 4.1060 7.6747 116.0844 63.3091 69.0249 175.2867 16 G 3.9185 8.9284 114.2848 45.4427 0.0000 172.8124 17 D 4.5778 7.7902 118.7764 54.1719 41.9045 175.9116 18 V 4.0594 8.5603 122.9960 61.6868 33.0169 174.5475 19 T 4.9046 8.3079 124.9046 61.9064 70.6265 174.5454 20 V 4.5571 8.2006 124.1369 59.7966 34.3321 174.4109 21 A 5.2018 8.7271 125.3408 48.9732 22.7702 173.3593 22 P 4.2663 0.0000 0.0000 63.5680 31.2297 176.3965 23 S 4.6612 9.0612 116.6640 57.5564 64.8376 173.3753 24 N 4.5969 7.8295 116.6467 53.0418 42.0117 174.2791 25 F 5.3350 8.9956 123.7786 57.2181 40.6473 174.0184 26 A 3.9687 8.1392 122.2828 52.8010 18.3715 178.1022 27 N 4.0805 9.3060 119.7336 54.3217 35.7548 176.7065 28 G 3.5513 7.9176 106.2982 45.4819 0.0000 174.4216 29 V 4.1496 7.2445 120.8153 62.1772 32.4798 175.0355 30 A 4.2363 8.6372 130.8113 51.4299 19.9417 175.6039 31 E 5.3643 8.7995 121.2995 54.3133 33.6569 174.4239 32 W 5.7746 9.7974 125.3022 55.0782 33.4861 174.3354 33 I 5.9628 9.0485 116.1775 58.3397 41.0872 174.7807 34 S 4.6995 8.6691 118.2308 57.4946 64.6438 175.0600 35 S 4.4486 8.3132 115.7602 57.0604 60.2902 171.7420 36 N 5.0016 7.5262 119.9510 51.3256 43.1536 174.2593 37 S 4.4440 8.3236 112.6447 58.2431 63.8233 175.4722 38 R 4.1187 8.4253 120.6134 58.5704 30.0341 178.2448 39 S 4.3324 7.4653 112.1710 59.9812 63.3832 174.9604 40 Q 4.3957 7.7269 117.1878 55.2556 29.3204 175.2421 41 A 4.4358 7.7429 120.0401 51.8961 20.0989 176.5146 42 Y 4.5683 9.0010 117.3967 56.5607 39.7378 175.2074 43 K 5.3114 8.7985 125.1728 54.6684 35.9170 174.9059 44 V 5.1981 9.1942 125.6702 61.6397 35.1459 174.0626 45 T 5.9852 9.2074 117.0048 59.4999 72.7124 172.2867 46 C 5.5516 8.6832 121.6354 58.7372 35.2805 172.5531 47 S 4.9935 8.9317 118.3676 57.3584 66.4100 173.0062 48 V 4.7404 8.0617 119.9223 61.3984 34.5927 174.3897 49 R 4.4601 8.1017 120.3483 55.3340 33.2761 174.3410 50 Q 4.5442 8.5226 122.1969 54.5578 27.7904 175.1689 51 S 4.2382 8.3949 119.9730 60.8552 63.2208 174.4326 52 S 4.4728 7.5191 111.8964 57.0186 65.4975 173.4621 53 A 4.0474 8.6004 122.2810 55.0943 18.2774 178.4358 54 Q 4.2718 7.9816 115.3577 56.8424 30.1508 174.3336 55 N 5.5595 7.8818 114.3209 51.6211 43.1332 173.5409 56 R 4.9780 8.8494 119.3762 54.4932 34.1189 175.1181 57 K 4.9989 9.1400 122.4674 55.3582 35.8786 174.4083 58 Y 4.8544 9.2855 125.9891 57.2739 40.1313 174.6164 59 T 5.0238 9.0292 120.9435 61.9800 71.4727 173.0948 60 I 5.1476 9.0476 128.1299 59.3701 40.3541 174.9753 61 K 5.2073 9.1356 125.7388 54.6087 35.8945 175.4172 62 V 5.0025 8.9278 123.1733 61.1860 35.5854 173.8469 63 E 4.9868 9.2465 126.0772 54.4778 32.7360 174.8690 64 V 4.4260 8.2925 124.6989 60.1344 34.1884 172.9924 65 P 4.7819 0.0000 0.0000 62.2012 32.5691 175.5830 66 K 4.1176 8.9026 124.6020 56.4633 32.2226 176.7020 67 V 4.0159 8.5972 126.6313 64.2582 32.5225 175.7925 68 A 4.2578 7.9773 122.8983 53.6510 18.4049 176.9191 69 T 3.5027 8.8561 111.5319 62.2312 67.4736 171.8962 70 Q 4.0747 8.2622 122.5528 56.7497 29.6340 175.8672 71 T 4.2901 8.5187 121.6547 61.2944 68.9312 174.2192 72 V 3.6987 8.2238 126.8365 64.5378 31.5975 176.4571 73 G 3.8384 9.6391 115.9701 45.4657 0.0000 173.3893 74 G 3.6885 7.8329 109.0695 44.4606 0.0000 173.5670 75 V 3.9004 7.9376 118.9875 61.2677 31.4224 174.8866 76 E 4.3592 8.3826 127.6518 54.4899 30.5684 175.5919 77 L 4.9628 8.2439 123.5434 51.9460 45.1735 174.8184 78 P 4.6415 0.0000 0.0000 62.1114 32.7829 177.2905 79 V 3.7287 8.6898 119.3228 66.5027 31.1255 178.1247 80 A 4.2968 8.1225 117.9581 54.2019 18.3580 178.3770 81 A 4.1980 8.0527 118.1224 52.9019 19.2177 177.8188 82 W 4.6693 8.0143 115.8510 56.4428 30.6257 175.7796 83 R 5.0051 7.9015 117.6893 54.6262 33.8728 174.4403 84 S 4.8063 8.6673 118.1009 56.9084 66.0754 172.6663 85 Y 5.1155 8.5897 120.2984 56.1351 40.6224 174.5416 86 L 4.7390 9.3175 126.7124 53.3124 44.7003 174.5971 87 N 5.2148 8.8409 123.7775 52.3699 41.4136 172.7406 88 M 4.8294 9.3860 126.8716 53.5084 34.9849 175.0740 89 E 5.1516 8.8211 121.8817 54.4386 33.0838 174.7510 90 L 4.6884 9.1770 127.0802 53.6670 44.6245 174.9391 91 T 5.0129 8.6126 123.4514 62.1880 70.1624 174.2824 92 I 4.6345 8.7073 127.2979 58.6119 40.7627 173.5218 93 P 5.4075 0.0000 0.0000 61.8632 32.0568 177.7082 94 I 3.6502 8.2539 116.9423 63.0944 37.4005 176.9943 95 F 4.3843 7.5926 118.1718 58.3981 39.3373 175.6553 96 A 4.2890 7.9458 125.3685 52.3380 18.5927 178.1735 97 T 4.4630 8.9099 114.5858 60.4382 72.0460 175.7770 98 N 4.3203 8.5538 117.4652 56.4670 38.4896 177.8427 99 S 4.1051 7.9920 116.0939 61.7277 63.1783 176.1084 100 D 4.4020 7.9373 121.0451 57.8352 40.7184 178.8905 101 C 4.2367 8.4567 117.2693 62.6771 28.0438 176.0276 102 E 3.9897 8.3142 120.6147 59.1654 29.0195 179.0680 103 L 3.9916 7.8961 120.2939 58.1143 42.0231 179.0821 104 I 3.7523 7.7254 119.6292 64.1635 36.9530 178.6192 105 V 3.5623 7.5927 118.8985 65.8085 31.3522 178.2575 106 K 4.1170 8.0886 118.1339 59.3637 31.8403 179.1478 107 A 4.0273 8.0958 121.0965 55.4725 18.0492 179.6572 108 M 4.0355 7.7941 117.0503 58.4834 31.7590 179.0992 109 Q 4.0828 8.0129 117.6953 58.8392 29.2981 178.5498 110 G 3.7289 8.5161 107.2461 47.6450 0.0000 175.2601 111 L 3.9876 7.8178 121.7861 57.5526 42.1554 178.2527 112 L 4.4628 7.1898 115.0064 53.3138 42.6406 176.7750 113 K 3.9966 7.2451 121.3774 55.9023 32.7804 175.5916 114 D 4.4866 8.5203 124.5606 56.1668 41.3636 176.6462 115 G 3.9844 9.0123 114.8782 45.5030 0.0000 173.7610 116 N 4.6801 7.8349 117.1815 52.0511 40.7652 173.2836 117 P 4.0762 0.0000 0.0000 66.5188 31.3541 178.5641 118 I 3.6845 7.7180 117.4391 64.3373 37.2877 176.7164 119 P 4.3090 0.0000 0.0000 66.0352 31.1700 178.5397 120 S 4.1272 8.1124 114.7236 61.1959 62.6044 176.5034 121 A 4.1331 8.2645 123.7158 55.1647 18.3080 179.7065 122 I 3.6338 7.8318 118.1198 64.5823 37.0532 178.5397 123 A 4.1909 8.1163 119.2797 53.7854 18.1478 178.3837 124 A 4.5881 7.1382 116.3761 50.8862 19.5875 175.9509 125 N 4.1479 7.9241 114.0841 55.4398 36.7432 174.1222 126 S 4.8777 8.3303 113.3583 56.8177 66.2966 172.9572 127 G 4.4923 8.3158 109.6290 44.6263 0.0000 172.1359 128 I 4.2824 8.1906 120.6570 60.3935 38.6770 175.3286 129 Y 4.3928 7.5876 121.0122 57.5981 37.3474 174.3679 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 8.26 4.25 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 2 S 8.23 3.89 0.00 3.96 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 3 N 8.95 4.87 0.00 2.91 2.94 0.00 0.00 6.24 7.43 0.00 0.00 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 F 7.95 5.05 0.00 2.64 2.83 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 5 T 7.82 4.76 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 1.27 0.00 0.00 6 Q 8.50 4.87 0.00 2.26 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.79 0.00 0.00 0.00 0.00 0.00 2.36 2.41 0.00 7 F 8.35 4.92 0.00 3.03 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 8 V 8.34 4.06 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 0.72 0.00 0.00 0.90 0.00 0.00 9 L 8.44 4.04 0.00 1.22 1.33 0.97 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 10 V 7.29 4.08 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 1.00 0.00 0.00 0.76 0.00 0.00 11 D 8.56 4.93 0.00 2.63 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.99 4.82 0.00 2.92 2.78 0.00 0.00 7.05 7.45 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 13 G 9.17 3.64 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 14 G 8.60 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 15 T 7.67 4.11 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 1.20 0.00 0.00 16 G 8.93 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 17 D 7.79 4.58 0.00 2.51 2.55 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 18 V 8.56 4.06 1.57 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 0.17 0.00 0.00 0.63 0.00 0.00 19 T 8.31 4.90 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 1.17 0.00 0.00 20 V 8.20 4.56 1.59 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 -0.03 0.00 0.00 0.90 0.00 0.00 21 A 8.73 5.20 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 22 P 0.00 4.27 0.00 1.38 0.49 0.00 3.50 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.36 0.00 23 S 9.06 4.66 0.00 3.78 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 24 N 7.83 4.60 0.00 2.93 2.70 0.00 0.00 6.57 7.71 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 25 F 9.00 5.33 0.00 2.99 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 26 A 8.14 3.97 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 27 N 9.31 4.08 0.00 2.90 2.89 0.00 0.00 7.10 7.82 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 28 G 7.92 3.55 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 29 V 7.24 4.15 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 1.00 0.00 0.00 30 A 8.64 4.24 0.13 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 31 E 8.80 5.36 0.00 2.11 1.92 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 2.31 2.41 0.00 32 W 9.80 5.77 0.00 3.35 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 33 I 9.05 5.96 1.95 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 0.98 1.31 1.01 0.00 0.00 34 S 8.67 4.70 0.00 3.94 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 35 S 8.31 4.45 0.00 3.85 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 36 N 7.53 5.00 0.00 2.73 2.70 0.00 0.00 7.27 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 37 S 8.32 4.44 0.00 3.98 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 38 R 8.43 4.12 0.00 1.84 2.06 0.00 3.23 0.00 0.00 3.30 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 39 S 7.47 4.33 0.00 3.88 3.97 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 40 Q 7.73 4.40 0.00 2.01 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.99 0.00 0.00 0.00 0.00 0.00 2.15 2.16 0.00 41 A 7.74 4.44 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 42 Y 9.00 4.57 0.00 2.92 2.88 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 43 K 8.80 5.31 0.00 1.92 1.69 0.00 1.88 0.00 0.00 1.66 0.00 0.00 3.04 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.61 7.81 44 V 9.19 5.20 2.36 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 1.09 0.00 0.00 1.01 0.00 0.00 45 T 9.21 5.99 4.38 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 1.36 0.00 0.00 46 C 8.68 5.55 0.00 3.23 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 47 S 8.93 4.99 0.00 3.93 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 48 V 8.06 4.74 1.79 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 -0.45 0.00 0.00 0.76 0.00 0.00 49 R 8.10 4.46 0.00 1.81 1.89 0.00 2.78 0.00 0.00 3.06 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.52 0.00 50 Q 8.52 4.54 0.00 1.95 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 7.08 0.00 0.00 0.00 0.00 0.00 2.27 2.53 0.00 51 S 8.39 4.24 0.00 4.00 3.97 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 52 S 7.52 4.47 0.00 3.96 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 53 A 8.60 4.05 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 54 Q 7.98 4.27 0.00 2.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.10 6.74 0.00 0.00 0.00 0.00 0.00 2.50 2.60 0.00 55 N 7.88 5.56 0.00 2.57 2.63 0.00 0.00 6.62 7.53 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 56 R 8.85 4.98 0.00 1.82 1.68 0.00 2.94 0.00 0.00 3.02 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.46 0.00 57 K 9.14 5.00 0.00 1.72 1.56 0.00 1.62 0.00 0.00 1.86 0.00 0.00 2.87 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.35 1.55 7.81 58 Y 9.29 4.85 0.00 3.00 2.88 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 59 T 9.03 5.02 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 60 I 9.05 5.15 1.93 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.79 0.96 0.00 0.00 61 K 9.14 5.21 0.00 1.79 1.77 0.00 1.68 0.00 0.00 1.65 0.00 0.00 2.86 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.42 7.81 62 V 8.93 5.00 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 0.90 0.00 0.00 1.00 0.00 0.00 63 E 9.25 4.99 0.00 1.92 1.67 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 2.10 2.34 0.00 64 V 8.29 4.43 1.98 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 1.00 0.00 0.00 0.96 0.00 0.00 65 P 0.00 4.78 0.00 1.99 1.90 0.00 2.50 0.00 0.00 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.39 0.00 66 K 8.90 4.12 0.00 1.71 2.00 0.00 1.38 0.00 0.00 0.67 0.00 0.00 2.24 0.00 0.00 2.62 0.00 0.00 0.00 0.00 1.46 1.29 7.81 67 V 8.60 4.02 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 1.00 0.00 0.00 0.98 0.00 0.00 68 A 7.98 4.26 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 69 T 8.86 3.50 4.38 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 1.26 0.00 0.00 70 Q 8.26 4.07 0.00 2.37 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.35 6.83 0.00 0.00 0.00 0.00 0.00 2.30 2.20 0.00 71 T 8.52 4.29 4.08 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 1.15 0.00 0.00 72 V 8.22 3.70 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 0.75 0.00 0.00 0.92 0.00 0.00 73 G 9.64 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 74 G 7.83 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 75 V 7.94 3.90 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 0.81 0.00 0.00 0.89 0.00 0.00 76 E 8.38 4.36 0.00 1.16 1.12 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 1.53 1.79 0.00 77 L 8.24 4.96 0.00 1.64 1.60 0.95 1.11 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 78 P 0.00 4.64 0.00 2.29 2.23 0.00 3.83 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 1.99 0.00 79 V 8.69 3.73 2.17 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 1.18 0.00 0.00 0.99 0.00 0.00 80 A 8.12 4.30 1.37 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 0.00 0.00 0.00 81 A 8.05 4.20 1.16 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 0.00 0.00 82 W 8.01 4.67 0.00 3.34 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 83 R 7.90 5.01 0.00 1.47 1.29 0.00 3.31 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 1.49 1.85 0.00 84 S 8.67 4.81 0.00 3.62 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 85 Y 8.59 5.12 0.00 2.82 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 86 L 9.32 4.74 0.00 1.74 1.67 0.96 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 87 N 8.84 5.21 0.00 2.78 2.71 0.00 0.00 6.98 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 88 M 9.39 4.83 0.00 1.96 2.07 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 2.54 2.50 0.00 89 E 8.82 5.15 0.00 1.83 1.86 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 2.24 2.30 0.00 90 L 9.18 4.69 0.00 1.76 1.64 0.94 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.00 0.00 0.00 0.00 0.00 0.00 91 T 8.61 5.01 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 1.24 0.00 0.00 92 I 8.71 4.63 1.96 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 1.30 0.99 0.97 0.00 0.00 93 P 0.00 5.41 0.00 2.23 2.16 0.00 3.94 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 2.20 2.13 0.00 94 I 8.25 3.65 1.56 0.00 0.00 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.70 -0.36 0.75 0.00 0.00 95 F 7.59 4.38 0.00 3.12 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 96 A 7.95 4.29 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 97 T 8.91 4.46 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 1.30 0.00 0.00 98 N 8.55 4.32 0.00 2.76 2.92 0.00 0.00 6.83 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 99 S 7.99 4.11 0.00 3.87 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 0.00 100 D 7.94 4.40 0.00 2.98 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 C 8.46 4.24 0.00 3.11 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 0.00 102 E 8.31 3.99 0.00 2.18 1.98 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 2.31 2.60 0.00 103 L 7.90 3.99 0.00 1.75 1.85 0.92 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 104 I 7.73 3.75 2.01 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 1.41 1.44 0.89 0.00 0.00 105 V 7.59 3.56 2.19 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 0.96 0.00 0.00 0.93 0.00 0.00 106 K 8.09 4.12 0.00 2.03 1.83 0.00 1.71 0.00 0.00 1.64 0.00 0.00 2.92 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.44 1.63 7.81 107 A 8.10 4.03 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 0.00 108 M 7.79 4.04 0.00 2.00 2.22 0.00 0.00 0.00 0.00 0.00 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.80 2.56 0.00 109 Q 8.01 4.08 0.00 2.14 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.96 0.00 0.00 0.00 0.00 0.00 2.35 2.61 0.00 110 G 8.52 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 0.00 0.00 0.00 111 L 7.82 3.99 0.00 1.73 1.91 0.91 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 112 L 7.19 4.46 0.00 1.63 1.67 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 113 K 7.25 4.00 0.00 1.92 1.66 0.00 1.64 0.00 0.00 1.56 0.00 0.00 2.83 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.43 1.37 7.81 114 D 8.52 4.49 0.00 2.65 2.58 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 0.00 115 G 9.01 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 0.00 116 N 7.83 4.68 0.00 2.92 2.72 0.00 0.00 6.81 8.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 P 0.00 4.08 0.00 2.11 2.01 0.00 3.59 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 2.09 2.16 0.00 118 I 7.72 3.68 1.86 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 1.68 1.13 0.91 0.00 0.00 119 P 0.00 4.31 0.00 2.26 2.31 0.00 3.77 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.31 0.00 120 S 8.11 4.13 0.00 4.09 3.95 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 0.00 121 A 8.26 4.13 1.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.83 3.63 2.01 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 1.47 1.19 0.92 0.00 0.00 123 A 8.12 4.19 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 0.00 124 A 7.14 4.59 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 0.00 125 N 7.92 4.15 0.00 2.91 2.90 0.00 0.00 6.70 6.85 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 0.00 126 S 8.33 4.88 0.00 4.02 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 0.00 127 G 8.32 4.49 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 0.00 128 I 8.19 4.28 1.87 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 1.47 0.88 0.83 0.00 0.00 129 Y 7.59 4.39 0.00 3.04 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