NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.9305 8.3393 109.7366 45.1352 0.0000 174.9091 2 S 4.2140 8.3564 114.6956 58.6556 61.4716 175.0803 3 S 3.1633 9.1746 129.9833 61.0284 62.4859 174.6941 4 G 3.3529 10.1934 112.1986 46.8113 0.0000 172.0933 5 S 3.5868 8.3684 121.2879 59.0815 59.7435 171.7644 6 S 4.4409 7.5049 112.1943 56.1387 63.5442 173.1618 7 G 4.0478 7.6558 114.3892 45.8526 0.0000 170.7998 8 E 4.5369 8.5619 114.5923 53.9223 29.5770 174.5426 9 H 4.3955 7.9783 117.7516 55.2646 30.8053 172.6779 10 A 4.5408 8.0897 129.3737 50.6696 19.7063 174.7140 11 K 4.5624 8.1914 119.1009 55.4427 35.1631 176.3344 12 Q 4.0148 8.2890 125.1024 56.4491 29.3391 177.3091 13 A 4.5425 7.5235 123.2421 50.7814 21.3802 176.3140 14 S 4.7038 8.1288 114.6849 57.8783 64.6456 173.8163 15 S 4.5894 7.9534 111.7810 59.3929 67.9666 175.5334 16 Y 4.0810 8.0949 117.7900 59.7211 37.4969 175.9776 17 I 2.2620 6.7156 123.2578 60.0231 34.0681 171.4898 18 P 4.3310 0.0000 0.0000 61.8014 30.3134 177.2067 19 L 3.8591 8.5020 125.1895 58.2027 41.6960 178.9648 20 D 4.4532 7.9244 115.7420 56.8954 41.5926 177.3765 21 R 4.0060 7.9261 117.4759 59.1476 30.1213 176.7350 22 L 4.5328 7.2946 115.8822 54.6357 43.1807 176.5308 23 S 4.8730 9.2999 115.8926 57.4527 64.9769 173.9668 24 I 4.8781 8.1612 122.8328 59.6693 40.4753 175.1159 25 S 4.2575 8.8432 119.8397 56.9496 65.5030 173.2820 26 Y 5.0546 7.6055 124.6386 58.6960 39.1671 174.0903 27 C 4.7667 8.8444 119.8187 59.2088 34.7290 173.5346 28 R 4.2421 8.7650 112.7965 55.2189 30.9523 173.0259 29 S 4.1874 8.3371 120.5675 58.2879 62.2228 168.3385 30 S 4.7812 8.0532 119.1014 56.3093 64.4537 173.3437 31 G 3.9892 7.9828 110.5323 44.6625 0.0000 171.7963 32 P 4.4878 0.0000 0.0000 63.7400 32.0841 176.0721 33 G 4.5217 7.4137 107.7925 45.6891 0.0000 174.4711 34 G 3.7873 8.6309 112.6670 45.8627 0.0000 177.7892 35 Q 4.4114 8.8503 125.0303 54.5490 30.6903 174.1294 36 N 4.2256 8.3410 115.7094 54.1477 39.4884 176.1521 37 V 3.2484 7.3443 116.8433 63.3321 30.4230 173.5672 38 N 4.5040 7.8604 123.2565 56.4792 39.2520 177.0394 39 K 4.5632 7.6721 112.3429 55.4991 34.4129 177.9388 40 V 3.8315 7.5932 118.4326 61.8605 29.7530 176.0501 41 N 4.8740 8.0983 132.4917 53.2513 37.8230 177.6059 42 S 4.5683 7.4010 113.0676 56.2087 64.8750 174.2395 43 K 4.8864 9.2997 129.1097 55.1184 35.2946 174.0668 44 A 5.3940 8.2569 125.3756 50.1668 21.9066 174.9612 45 E 5.1860 9.4072 122.6366 54.4326 33.8454 174.7184 46 V 4.9657 8.6426 124.2549 61.3326 35.5388 173.7921 47 R 5.2821 8.8322 126.9786 54.6354 33.4762 173.9077 48 F 5.2924 8.5071 119.3055 55.6441 42.1370 173.4829 49 H 4.7190 9.1555 121.0169 55.6100 29.3139 175.2503 50 L 4.1730 8.4797 129.9698 58.4350 41.6630 178.7545 51 A 3.9415 7.5331 118.7383 54.4952 18.4250 178.3333 52 S 4.5230 7.4510 109.1544 58.0522 63.9851 175.6456 53 A 4.2117 7.6698 124.6318 51.4346 15.1731 177.7156 54 D 4.3267 8.1898 122.8322 56.0592 41.5141 177.9536 55 W 4.6132 7.9929 113.9629 57.0849 28.8592 175.9737 56 I 4.2613 6.8018 120.5613 59.3434 38.7987 175.9506 57 E 4.1032 8.2931 122.6794 55.9519 30.8738 177.6370 58 E 3.8739 8.8740 123.6713 59.2990 29.7639 177.7195 59 P 4.3820 0.0000 0.0000 65.0374 31.5843 178.1857 60 V 3.8152 7.4671 117.7836 65.3348 31.8328 177.3239 61 R 3.7970 8.3420 118.3718 59.7685 29.6968 178.9535 62 Q 4.0677 7.8934 115.6331 58.8036 28.4788 178.2601 63 K 3.8807 7.5367 121.3442 59.5973 32.3008 178.5261 64 I 3.6415 7.9394 119.7882 64.6006 36.8354 178.1275 65 A 3.9910 7.7869 120.5839 54.5754 18.5105 178.6470 66 L 4.3745 7.2616 115.7435 57.3863 42.6114 179.3266 67 T 4.0917 8.5556 114.4414 65.5536 68.5914 175.1014 68 H 4.9002 7.8081 117.2053 55.0581 30.1935 175.3537 69 K 3.7824 7.9162 124.1540 59.6595 32.0046 178.4120 70 N 4.3672 8.1258 115.6938 56.1356 39.1876 175.6617 71 K 4.1793 8.1953 117.6390 58.4043 32.6221 177.4118 72 I 4.1771 7.2546 119.6188 61.2856 37.3895 176.0890 73 N 4.4726 8.3552 121.7063 54.4435 38.0647 175.0092 74 K 4.1957 8.2302 123.6019 56.7921 28.8750 176.5802 75 A 4.1260 8.4021 120.0428 52.6749 18.2106 178.5473 76 G 3.9464 8.1327 104.4619 45.2972 0.0000 173.3190 77 E 4.4265 7.7539 120.5679 56.0123 30.7744 175.6605 78 L 4.2713 8.3993 128.3154 54.4489 43.2637 175.5492 79 V 4.9707 8.3882 126.6558 61.0023 33.9079 174.4223 80 L 5.0930 8.7497 126.8795 54.4066 44.5334 175.1394 81 T 5.1374 8.3383 108.4388 60.1935 72.2963 173.3303 82 S 4.7163 9.0184 118.6400 56.8570 65.7156 172.3761 83 E 5.1608 8.6503 124.2539 55.4846 32.1381 175.4502 84 S 4.5736 9.3311 115.0694 59.2425 69.1752 174.7519 85 S 4.7442 8.0126 115.6267 56.2104 66.1893 174.1699 86 R 4.2083 7.6539 116.7191 57.5094 29.7501 176.6746 87 Y 4.4670 6.9632 116.0773 57.3584 38.3158 175.0035 88 Q 3.9137 8.0016 119.6861 58.7367 28.9228 177.8496 89 F 4.2825 8.0803 123.1975 59.8865 39.5657 177.6180 90 R 3.4204 7.8423 118.2278 59.3178 30.0304 178.0255 91 N 4.3212 7.9857 115.7630 56.2695 38.7108 176.9118 92 L 4.0115 7.7112 121.6290 58.2368 42.0542 178.8305 93 A 3.9024 7.9705 121.0412 55.0310 18.1003 179.2827 94 E 3.8109 7.8777 117.8990 59.4339 29.7224 178.4259 95 C 3.9886 7.9702 116.8828 63.3520 28.3398 176.5175 96 L 4.0850 8.0983 119.9635 57.5580 41.1255 179.3516 97 Q 3.9779 8.2742 120.0289 58.9940 28.9691 178.5585 98 K 3.9358 8.3632 119.5819 59.6640 32.2992 179.0849 99 I 3.8043 7.7596 120.0792 64.8789 36.9934 178.5545 100 R 3.9491 8.1238 118.3410 59.4654 29.8629 178.9153 101 D 4.3636 8.1388 118.6839 57.6784 40.9570 178.7901 102 M 4.1931 8.7324 119.4660 58.2415 31.8171 178.8584 103 I 3.8996 7.6462 119.4406 63.8323 37.3695 178.0609 104 A 3.9873 8.2150 122.2358 55.2731 18.0766 179.6343 105 E 3.9242 8.3260 114.5171 59.2170 29.7230 178.6318 106 A 4.2027 7.4926 119.7990 53.9783 18.7294 179.1562 107 S 4.3516 7.7813 111.4163 58.4144 63.0906 174.4042 108 G 4.0745 6.8943 109.1869 44.4439 0.0000 170.9068 109 P 4.5603 0.0000 0.0000 62.9479 32.3716 175.2179 110 S 4.6806 7.9278 111.7255 58.2653 69.3940 174.4483 111 S 4.3863 7.4799 108.7199 57.2320 64.8008 176.0827 112 G 3.4420 9.2031 116.1365 45.2853 0.0000 172.4671 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 8.34 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 0.00 0.00 0.00 2 S 8.36 4.21 0.00 4.07 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 3 S 9.17 3.16 0.00 3.99 3.70 0.00 0.00 0.00 0.00 0.00 0.00 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 G 10.19 3.35 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 0.00 5 S 8.37 3.59 0.00 3.99 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 6 S 7.50 4.44 0.00 3.76 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 7 G 7.66 4.05 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 0.00 0.00 0.00 0.00 0.00 0.00 8 E 8.56 4.54 0.00 1.88 1.81 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 2.18 2.28 0.00 9 H 7.98 4.40 0.00 3.12 3.14 0.00 5.79 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 A 8.09 4.54 1.24 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 11 K 8.19 4.56 0.00 1.72 1.72 0.00 1.66 0.00 0.00 1.74 0.00 0.00 2.77 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.34 1.41 7.81 12 Q 8.29 4.01 0.00 2.06 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.47 6.86 0.00 0.00 0.00 0.00 0.00 2.38 2.37 0.00 13 A 7.52 4.54 1.25 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 14 S 8.13 4.70 0.00 3.24 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 15 S 7.95 4.59 0.00 3.87 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 16 Y 8.09 4.08 0.00 3.01 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 17 I 6.72 2.26 1.70 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.75 0.52 0.00 0.00 18 P 0.00 4.33 0.00 2.00 2.13 0.00 2.31 0.00 0.00 3.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.52 0.00 19 L 8.50 3.86 0.00 1.63 1.80 1.01 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 20 D 7.92 4.45 0.00 2.59 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 21 R 7.93 4.01 0.00 1.78 1.93 0.00 3.59 0.00 0.00 3.32 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.49 0.00 22 L 7.29 4.53 0.00 1.65 1.92 0.84 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 23 S 9.30 4.87 0.00 3.90 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 24 I 8.16 4.88 1.66 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 1.24 0.50 0.57 0.00 0.00 25 S 8.84 4.26 0.00 3.74 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 26 Y 7.61 5.05 0.00 2.99 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 27 C 8.84 4.77 0.00 3.01 2.79 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 28 R 8.77 4.24 0.00 2.10 2.02 0.00 3.19 0.00 0.00 3.23 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.68 0.00 29 S 8.34 4.19 0.00 4.08 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 30 S 8.05 4.78 0.00 3.80 3.71 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 31 G 7.98 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 0.00 0.00 0.00 32 P 0.00 4.49 0.00 2.19 2.18 0.00 3.84 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 1.97 1.95 0.00 33 G 7.41 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.63 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 0.00 0.00 0.00 35 Q 8.85 4.41 0.00 2.05 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 7.05 0.00 0.00 0.00 0.00 0.00 2.32 2.31 0.00 36 N 8.34 4.23 0.00 2.70 2.77 0.00 0.00 7.02 7.67 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 37 V 7.34 3.25 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 0.68 0.00 0.00 0.92 0.00 0.00 38 N 7.86 4.50 0.00 2.70 2.90 0.00 0.00 6.99 7.60 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 39 K 7.67 4.56 0.00 1.66 1.76 0.00 1.74 0.00 0.00 1.75 0.00 0.00 3.02 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.32 1.38 7.81 40 V 7.59 3.83 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 0.68 0.00 0.00 0.85 0.00 0.00 41 N 8.10 4.87 0.00 2.73 2.84 0.00 0.00 6.96 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 42 S 7.40 4.57 0.00 3.77 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 43 K 9.30 4.89 0.00 1.83 1.75 0.00 1.63 0.00 0.00 1.69 0.00 0.00 2.88 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.38 1.54 7.81 44 A 8.26 5.39 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 45 E 9.41 5.19 0.00 2.01 1.96 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 2.19 2.22 0.00 46 V 8.64 4.97 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 1.15 0.00 0.00 1.00 0.00 0.00 47 R 8.83 5.28 0.00 1.91 1.73 0.00 3.29 0.00 0.00 3.21 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.56 0.00 48 F 8.51 5.29 0.00 3.24 3.17 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 49 H 9.16 4.72 0.00 3.24 3.37 0.00 5.70 0.00 0.00 0.00 0.00 6.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 50 L 8.48 4.17 0.00 1.56 1.79 0.91 1.27 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 51 A 7.53 3.94 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 52 S 7.45 4.52 0.00 4.01 4.11 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 53 A 7.67 4.21 0.57 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 0.00 0.00 54 D 8.19 4.33 0.00 2.77 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 55 W 7.99 4.61 0.00 3.71 3.29 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 56 I 6.80 4.26 1.46 0.00 0.00 0.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.39 -0.36 0.72 0.00 0.00 57 E 8.29 4.10 0.00 1.98 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 0.00 2.40 2.34 0.00 58 E 8.87 3.87 0.00 2.05 1.96 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 2.37 2.44 0.00 59 P 0.00 4.38 0.00 2.29 2.28 0.00 3.70 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.00 0.00 60 V 7.47 3.82 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 1.02 0.00 0.00 1.00 0.00 0.00 61 R 8.34 3.80 0.00 1.92 1.89 0.00 3.15 0.00 0.00 3.23 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.68 0.00 62 Q 7.89 4.07 0.00 2.30 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.54 6.80 0.00 0.00 0.00 0.00 0.00 2.49 2.35 0.00 63 K 7.54 3.88 0.00 2.22 1.84 0.00 1.53 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.52 7.81 64 I 7.94 3.64 1.88 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 1.48 0.90 0.92 0.00 0.00 65 A 7.79 3.99 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 66 L 7.26 4.37 0.00 1.83 1.68 0.93 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.56 4.09 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 1.06 0.00 0.00 68 H 7.81 4.90 0.00 3.27 3.22 0.00 5.64 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 69 K 7.92 3.78 0.00 2.03 1.82 0.00 1.63 0.00 0.00 1.56 0.00 0.00 2.86 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.43 1.38 7.81 70 N 8.13 4.37 0.00 2.71 2.83 0.00 0.00 6.98 6.68 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 71 K 8.20 4.18 0.00 1.90 1.95 0.00 1.74 0.00 0.00 1.66 0.00 0.00 2.94 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.47 1.57 7.81 72 I 7.25 4.18 2.01 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.36 0.91 0.00 0.00 73 N 8.36 4.47 0.00 2.82 2.92 0.00 0.00 7.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 K 8.23 4.20 0.00 1.89 2.06 0.00 1.67 0.00 0.00 1.81 0.00 0.00 2.88 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.31 1.11 7.81 75 A 8.40 4.13 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 76 G 8.13 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 0.00 0.00 0.00 77 E 7.75 4.43 0.00 1.92 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 2.44 2.29 0.00 78 L 8.40 4.27 0.00 1.23 0.27 0.85 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 79 V 8.39 4.97 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 0.84 0.00 0.00 0.94 0.00 0.00 80 L 8.75 5.09 0.00 1.75 1.69 0.96 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 81 T 8.34 5.14 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 1.23 0.00 0.00 82 S 9.02 4.72 0.00 3.91 3.71 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 83 E 8.65 5.16 0.00 2.06 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 2.18 2.40 0.00 84 S 9.33 4.57 0.00 3.82 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 85 S 8.01 4.74 0.00 3.96 3.74 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 86 R 7.65 4.21 0.00 1.70 1.78 0.00 2.21 0.00 0.00 3.51 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 1.23 0.00 87 Y 6.96 4.47 0.00 2.98 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 88 Q 8.00 3.91 0.00 1.76 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.44 2.38 0.00 89 F 8.08 4.28 0.00 3.13 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 90 R 7.84 3.42 0.00 1.99 2.03 0.00 3.06 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.73 0.00 91 N 7.99 4.32 0.00 2.91 3.05 0.00 0.00 6.81 7.02 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 92 L 7.71 4.01 0.00 1.90 1.92 1.06 1.28 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 93 A 7.97 3.90 0.82 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 0.00 0.00 94 E 7.88 3.81 0.00 1.97 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 0.00 2.30 2.33 0.00 95 C 7.97 3.99 0.00 3.31 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 96 L 8.10 4.09 0.00 1.82 1.69 0.94 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 97 Q 8.27 3.98 0.00 2.32 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.82 0.00 0.00 0.00 0.00 0.00 2.35 2.45 0.00 98 K 8.36 3.94 0.00 1.87 1.86 0.00 1.90 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.66 7.81 99 I 7.76 3.80 2.13 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.20 1.10 0.00 0.00 100 R 8.12 3.95 0.00 2.06 1.97 0.00 3.19 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.75 0.00 101 D 8.14 4.36 0.00 2.94 2.73 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 0.00 102 M 8.73 4.19 0.00 1.63 2.21 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.54 0.00 103 I 7.65 3.90 2.14 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 1.38 0.60 0.90 0.00 0.00 104 A 8.21 3.99 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 0.00 105 E 8.33 3.92 0.00 2.15 2.13 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 2.55 2.40 0.00 106 A 7.49 4.20 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 S 7.78 4.35 0.00 4.03 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 0.00 108 G 6.89 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 0.00 109 P 0.00 4.56 0.00 2.19 2.07 0.00 3.80 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 1.99 1.95 0.00 110 S 7.93 4.68 0.00 3.81 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 0.00 111 S 7.48 4.39 0.00 3.81 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 0.00 112 G 9.20 3.44 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 0.00