NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 12 S 4.4872 8.1933 115.5583 58.2652 63.7909 173.1325 13 S 4.8019 8.7368 123.5620 56.5917 64.3077 173.0839 14 C 4.1909 8.4848 121.8398 57.4904 43.7800 172.8714 15 K 4.4487 8.6934 123.7664 56.0103 36.1536 174.2978 16 R 4.6273 8.3318 120.9832 56.3511 30.9152 174.9874 17 H 5.0498 9.0855 122.2790 52.7705 32.7418 171.4125 18 P 4.7895 0.0000 0.0000 63.3485 32.2823 176.0380 19 L 4.1965 7.9605 122.7431 54.9065 44.6522 172.4569 20 Y 4.4218 8.4791 128.4579 55.9845 40.5300 174.7235 21 V 3.7399 7.3287 127.2119 61.2419 33.1263 173.6379 22 D 4.7013 7.9846 128.4714 52.5737 42.4663 177.3024 23 F 4.5493 8.6091 125.3845 60.4813 38.8873 178.0172 24 S 4.2311 8.5529 115.3420 61.8313 62.4840 176.4085 25 D 4.4365 7.9141 119.8161 56.3194 40.6032 178.0741 26 V 4.0155 7.6668 110.3582 60.3488 32.3244 176.0577 27 G 3.9072 7.8027 106.3775 46.2065 0.0000 174.0521 28 W 5.2113 8.7732 117.2294 56.2977 29.3248 178.1363 29 N 4.5218 8.4296 118.4678 55.8449 38.1136 175.8265 30 D 4.6773 8.2633 116.7243 54.1188 40.5420 177.0492 31 W 4.6422 8.1635 115.9194 56.6741 29.7624 175.4255 32 I 4.2868 6.7417 120.1439 59.6853 36.8196 175.7467 33 V 4.0855 8.4259 126.1241 63.6105 32.5485 176.4188 34 A 4.7258 7.5767 120.6593 50.2637 22.3889 174.4617 35 P 4.8734 0.0000 0.0000 61.2496 33.1290 174.5529 36 P 4.4591 0.0000 0.0000 64.2945 31.3838 176.5549 37 G 3.3094 7.4492 105.2877 45.8548 0.0000 170.8490 38 Y 4.6783 6.0755 115.5505 55.9316 41.7014 173.9569 39 H 4.5010 8.8598 117.8914 55.5616 28.6480 174.8536 40 A 4.3986 8.4557 126.7442 51.9929 20.4983 178.0045 41 F 4.4432 8.0294 114.6572 57.3551 38.4202 172.9507 42 Y 5.0492 8.3728 117.8357 56.7067 41.5489 172.7313 43 C 5.4208 8.7379 117.0822 55.8052 39.5440 173.0297 44 H 4.7771 8.8179 120.5458 55.7741 33.4702 172.3758 45 G 4.4907 8.5609 109.3106 42.5701 0.0000 172.9208 46 E 4.0773 8.6788 121.4693 56.3170 30.0457 175.3467 47 C 5.0301 8.3707 122.5311 54.6609 39.8070 172.0010 48 P 4.6454 0.0000 0.0000 61.4674 32.5466 175.8258 49 F 4.4579 8.4913 121.1494 56.3351 40.1715 173.5111 50 P 3.5180 0.0000 0.0000 61.0114 32.5000 175.3833 51 L 4.0427 7.9515 119.2411 53.9752 41.8212 177.2847 52 A 4.1744 8.1629 126.8163 51.2072 19.7043 177.2561 53 D 4.3238 8.8317 119.4214 57.8171 41.0303 178.5938 54 H 4.3700 8.0134 111.2269 57.3379 28.7545 175.5640 55 L 4.1515 8.1151 120.1933 54.9727 42.3560 176.0837 56 N 4.1205 7.8876 116.3296 54.2648 36.4570 174.3293 57 S 4.8437 7.7685 113.0201 57.6471 64.6305 175.4665 58 T 4.3711 8.0781 113.0672 60.8641 71.2062 175.3456 59 N 4.2570 8.7352 119.2077 57.1505 38.5404 176.9704 60 H 4.0797 8.2675 118.4575 59.2479 29.9257 176.9973 61 A 4.0883 8.1141 122.6040 55.0625 18.1852 179.6756 62 I 3.6678 7.8399 118.3556 64.5458 37.1621 178.8053 63 V 3.5633 8.1086 119.3970 66.0748 31.2873 177.7295 64 Q 3.9152 8.5425 119.5646 59.5075 28.7531 178.3602 65 T 3.8953 8.2340 116.9764 66.7880 68.3438 176.5899 66 L 3.8905 8.0384 120.8381 57.6246 41.5792 179.7252 67 V 3.5544 8.1589 118.7362 65.9611 31.2439 177.5649 68 N 4.6285 8.2674 116.4122 56.7195 38.8238 176.6980 69 S 4.2189 7.6098 114.4468 60.7434 63.1892 176.2506 70 V 3.9623 7.1252 121.5034 63.9615 31.7720 175.7148 71 N 4.7621 8.3405 118.9260 52.1239 41.0233 174.6077 72 S 4.5103 8.6957 120.0553 59.4493 63.4125 175.3859 73 K 4.0504 8.4072 121.2946 59.0013 31.9806 177.1649 74 I 4.1478 7.4484 120.5945 59.2742 37.6340 174.1834 75 P 4.4959 0.0000 0.0000 62.0946 31.9828 176.1622 76 K 4.1643 8.2537 118.2785 55.8945 32.6167 176.6969 77 A 4.3540 8.2965 122.5175 52.3869 19.4615 176.1919 78 C 4.8401 8.8021 118.8518 57.6164 34.9967 172.1958 79 C 5.0318 8.7748 125.4696 56.3423 43.0657 172.7275 80 V 4.7517 8.8703 119.0092 58.7755 36.5059 173.0624 81 P 4.9404 0.0000 0.0000 63.2825 31.2970 176.7470 82 T 4.6031 8.9431 113.1607 61.5006 70.4470 173.8145 83 E 4.7612 7.9424 123.4263 54.8786 33.1404 173.6218 84 L 5.5657 8.6596 125.3646 53.0410 46.0079 175.3408 85 S 4.9354 9.0773 114.6017 56.6172 66.8123 172.7795 86 A 5.1996 8.5583 121.8726 50.8994 20.6413 176.4814 87 I 4.7181 8.4108 112.1212 59.2972 41.2931 174.6214 88 S 5.3110 8.6414 119.0242 57.9394 64.7519 173.4712 89 M 5.0747 9.2231 121.3694 53.8380 36.9206 173.5404 90 L 5.2379 9.2560 124.3254 53.6739 44.7657 174.8589 91 Y 5.4573 8.4708 122.9111 55.7778 42.4272 173.2513 92 L 5.3320 9.2807 120.2953 53.4214 43.4894 176.9833 93 D 4.9909 8.4126 123.6161 51.6662 42.1042 175.9482 94 E 3.8150 8.9386 119.0476 59.5933 29.2739 177.9877 95 N 4.7092 8.2401 111.9705 52.2781 37.6691 173.9673 96 E 3.7774 8.3717 118.1669 57.4759 28.6262 173.6226 97 K 4.6267 7.9851 116.5766 54.2881 35.2728 175.1872 98 V 4.4713 8.2084 118.7158 60.4575 32.4855 175.4865 99 V 4.1998 7.9777 126.1062 60.7415 34.0251 174.0043 100 L 4.8859 8.2527 129.2186 53.8739 43.3124 175.4199 101 K 4.5337 9.1737 127.2077 54.5627 35.7152 174.2427 102 N 4.9527 8.7692 126.2864 53.3460 40.0541 173.4022 103 Y 4.5924 9.1976 124.8412 56.3071 39.7120 175.7104 104 Q 4.3824 8.8157 123.4848 55.7127 30.0636 175.3526 105 D 4.4689 8.4648 117.3891 56.2394 38.2245 174.5752 106 M 4.5924 8.4360 118.4204 55.6824 34.0694 177.6797 107 V 4.8162 7.6961 118.5701 60.7965 34.9248 174.6248 108 V 4.0976 9.0399 128.9127 63.1993 31.2381 175.3698 109 E 4.3627 9.2236 127.8904 57.4302 30.9764 176.5107 110 G 4.2315 7.7249 104.4432 45.2358 0.0000 172.8796 111 C 5.6105 8.6264 118.8857 55.2990 43.6501 173.1244 112 G 4.1211 8.9700 107.7766 45.9183 0.0000 170.8864 113 C 5.3034 8.6987 117.4778 55.7277 43.2961 174.8869 114 R 4.3069 8.8852 122.1177 56.3980 30.9261 175.1606 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 12 S 8.19 4.49 0.00 3.95 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 13 S 8.74 4.80 0.00 3.89 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 14 C 8.48 4.19 0.00 3.02 3.05 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 15 K 8.69 4.45 0.00 1.75 1.82 0.00 1.21 0.00 0.00 1.46 0.00 0.00 2.79 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.22 1.03 7.81 16 R 8.33 4.63 0.00 1.72 1.69 0.00 2.72 0.00 0.00 2.91 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.60 0.00 17 H 9.09 5.05 0.00 1.58 2.73 0.00 5.67 0.00 0.00 0.00 0.00 6.54 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 4.79 0.00 2.11 2.12 0.00 3.84 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 19 L 7.96 4.20 0.00 2.04 1.61 0.83 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 20 Y 8.48 4.42 0.00 2.68 2.63 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.33 3.74 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 0.00 0.00 0.61 0.00 0.00 0.47 0.00 0.00 22 D 7.98 4.70 0.00 2.96 2.47 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.61 4.55 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 24 S 8.55 4.23 0.00 4.10 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 25 D 7.91 4.44 0.00 2.66 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 26 V 7.67 4.02 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 0.47 0.00 0.00 0.29 0.00 0.00 27 G 7.80 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 28 W 8.77 5.21 0.00 3.25 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 29 N 8.43 4.52 0.00 2.80 2.96 0.00 0.00 7.07 8.06 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 30 D 8.26 4.68 0.00 2.89 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 31 W 8.16 4.64 0.00 3.52 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 32 I 6.74 4.29 1.05 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 0.01 -0.36 0.46 0.00 0.00 33 V 8.43 4.09 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 0.68 0.00 0.00 0.94 0.00 0.00 34 A 7.58 4.73 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 35 P 0.00 4.87 0.00 2.32 2.18 0.00 3.93 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 2.23 2.09 0.00 36 P 0.00 4.46 0.00 2.28 2.21 0.00 3.77 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 2.17 2.15 0.00 37 G 7.45 3.31 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 0.00 38 Y 6.08 4.68 0.00 2.98 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 39 H 8.86 4.50 0.00 3.00 2.55 0.00 5.88 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 A 8.46 4.40 1.01 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 41 F 8.03 4.44 0.00 3.26 3.19 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 42 Y 8.37 5.05 0.00 3.11 3.02 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 43 C 8.74 5.42 0.00 2.96 3.08 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 0.00 44 H 8.82 4.78 0.00 3.50 3.09 0.00 5.77 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 45 G 8.56 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 46 E 8.68 4.08 0.00 2.03 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 2.32 2.29 0.00 47 C 8.37 5.03 0.00 3.11 3.02 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 48 P 0.00 4.65 0.00 2.19 2.08 0.00 3.74 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 1.94 1.94 0.00 49 F 8.49 4.46 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 50 P 0.00 3.52 0.00 1.74 0.83 0.00 3.58 0.00 0.00 3.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.61 0.00 51 L 7.95 4.04 0.00 1.61 1.62 0.98 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.16 4.17 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 53 D 8.83 4.32 0.00 2.65 2.68 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 54 H 8.01 4.37 0.00 3.23 3.40 0.00 5.77 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 55 L 8.12 4.15 0.00 1.78 1.69 0.86 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 56 N 7.89 4.12 0.00 2.79 2.85 0.00 0.00 6.97 7.05 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 57 S 7.77 4.84 0.00 3.85 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 58 T 8.08 4.37 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 1.23 0.00 0.00 59 N 8.74 4.26 0.00 2.77 2.96 0.00 0.00 6.45 8.16 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 60 H 8.27 4.08 0.00 3.21 3.31 0.00 5.67 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 A 8.11 4.09 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 62 I 7.84 3.67 2.06 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 1.42 0.75 0.97 0.00 0.00 63 V 8.11 3.56 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 1.04 0.00 0.00 0.99 0.00 0.00 64 Q 8.54 3.92 0.00 2.08 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.56 0.00 0.00 0.00 0.00 0.00 2.49 2.40 0.00 65 T 8.23 3.90 4.53 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 0.00 0.00 0.00 1.38 0.00 0.00 66 L 8.04 3.89 0.00 1.82 1.63 1.04 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 67 V 8.16 3.55 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 1.00 0.00 0.00 0.92 0.00 0.00 68 N 8.27 4.63 0.00 2.84 3.01 0.00 0.00 7.29 8.33 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 69 S 7.61 4.22 0.00 3.91 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 70 V 7.13 3.96 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 0.79 0.00 0.00 0.93 0.00 0.00 71 N 8.34 4.76 0.00 2.65 2.59 0.00 0.00 7.00 7.13 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 72 S 8.70 4.51 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 73 K 8.41 4.05 0.00 1.91 1.92 0.00 1.80 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.48 1.41 7.81 74 I 7.45 4.15 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 1.35 0.76 0.91 0.00 0.00 75 P 0.00 4.50 0.00 2.19 2.07 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.00 0.00 76 K 8.25 4.16 0.00 1.79 1.81 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.13 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.54 1.45 7.81 77 A 8.30 4.35 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 78 C 8.80 4.84 0.00 3.00 2.76 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 79 C 8.77 5.03 0.00 3.18 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 80 V 8.87 4.75 2.12 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 0.75 0.00 0.00 1.02 0.00 0.00 81 P 0.00 4.94 0.00 1.99 2.05 0.00 3.68 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 2.11 2.17 0.00 82 T 8.94 4.60 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 1.24 0.00 0.00 83 E 7.94 4.76 0.00 2.02 1.76 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 2.28 2.35 0.00 84 L 8.66 5.57 0.00 1.71 1.57 0.98 0.93 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 85 S 9.08 4.94 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 86 A 8.56 5.20 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 87 I 8.41 4.72 1.79 0.00 0.00 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.94 0.82 0.89 0.00 0.00 88 S 8.64 5.31 0.00 3.81 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 89 M 9.22 5.07 0.00 1.86 2.12 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 90 L 9.26 5.24 0.00 1.71 1.49 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 91 Y 8.47 5.46 0.00 3.23 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 92 L 9.28 5.33 0.00 1.69 1.74 1.03 0.98 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 93 D 8.41 4.99 0.00 3.03 3.05 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 94 E 8.94 3.82 0.00 1.94 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 0.00 2.28 2.31 0.00 95 N 8.24 4.71 0.00 2.86 2.89 0.00 0.00 6.05 7.66 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 96 E 8.37 3.78 0.00 2.15 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 0.00 2.22 2.26 0.00 97 K 7.99 4.63 0.00 1.93 1.58 0.00 1.55 0.00 0.00 1.64 0.00 0.00 2.95 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.32 1.41 7.81 98 V 8.21 4.47 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 0.70 0.00 0.00 0.89 0.00 0.00 99 V 7.98 4.20 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.76 0.00 0.00 100 L 8.25 4.89 0.00 1.63 1.49 0.93 0.50 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 0.00 101 K 9.17 4.53 0.00 1.89 1.74 0.00 1.73 0.00 0.00 0.86 0.00 0.00 2.45 0.00 0.00 2.73 0.00 0.00 0.00 0.00 0.30 1.04 7.81 102 N 8.77 4.95 0.00 2.74 2.66 0.00 0.00 7.04 7.54 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 0.00 103 Y 9.20 4.59 0.00 2.92 2.84 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 0.00 104 Q 8.82 4.38 0.00 1.98 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.95 6.91 0.00 0.00 0.00 0.00 0.00 2.37 2.35 0.00 105 D 8.46 4.47 0.00 2.89 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 0.00 106 M 8.44 4.59 0.00 1.80 2.11 0.00 0.00 0.00 0.00 0.00 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.94 0.00 107 V 7.70 4.82 2.25 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 1.46 0.00 0.00 1.27 0.00 0.00 108 V 9.04 4.10 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 0.85 0.00 0.00 1.12 0.00 0.00 109 E 9.22 4.36 0.00 1.85 1.94 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 2.45 2.41 0.00 110 G 7.72 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 0.00 0.00 0.00 0.00 111 C 8.63 5.61 0.00 2.81 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 0.00 112 G 8.97 4.12 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 0.00 0.00 0.00 113 C 8.70 5.30 0.00 2.92 3.02 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 0.00 114 R 8.89 4.31 0.00 1.69 1.76 0.00 3.33 0.00 0.00 3.22 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.72 0.00