NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3938 8.3044 120.3499 52.9562 34.6391 174.8540 2 L 5.2435 7.0500 130.4404 54.3647 44.8004 170.7756 3 M 4.0986 7.4429 116.3029 52.5915 35.0213 172.5696 4 P 4.8734 0.0000 0.0000 61.3490 32.8438 175.8359 5 R 4.0423 8.7067 120.7658 59.3676 30.1578 176.7700 6 R 4.7565 7.4522 112.7956 55.3927 34.2804 173.9424 7 M 4.8295 8.0075 117.3392 54.0685 35.9664 175.7362 8 K 3.8716 8.6594 122.0388 58.7717 32.5104 177.1505 9 Y 4.8360 7.4119 114.0629 56.1073 41.6050 175.2099 10 R 4.2469 8.8794 123.3180 57.9082 30.7841 176.6969 11 K 4.7354 7.8911 115.3427 54.4272 34.8352 175.2254 12 Q 4.5594 8.1691 118.7551 54.0409 31.6447 174.5903 13 Q 4.0633 8.6797 118.4161 56.5866 29.4769 177.6697 14 R 4.3031 8.7526 120.8596 59.5379 30.9682 177.7445 15 G 3.9929 9.7428 103.9536 45.1867 0.0000 170.8942 16 R 4.5964 8.0223 119.7173 55.8485 34.0239 175.0629 17 L 4.6576 7.9402 117.2451 53.3367 42.6151 174.7940 18 K 4.1867 8.3988 121.4300 54.9138 32.9698 177.4230 19 G 3.7844 8.4749 112.7307 45.9290 0.0000 170.2508 20 A 3.9608 8.5072 124.4888 52.6330 18.0934 178.5936 21 T 4.0163 8.3317 117.7068 63.7473 69.2154 175.3174 22 K 4.2530 9.0306 126.7477 56.2636 31.5566 175.5802 23 G 3.9992 7.5827 103.9606 45.1795 0.0000 172.6594 24 G 3.8027 8.5731 108.6356 44.9734 0.0000 174.9402 25 D 4.8042 7.7536 117.9799 53.9142 39.8282 175.3811 26 Y 4.5315 6.5441 116.9168 54.4555 40.1015 174.6668 27 V 3.4811 7.7197 119.3912 61.6559 31.9986 176.3775 28 A 3.7824 8.3184 123.3518 52.6278 16.3911 177.7418 29 F 4.3533 8.4066 112.7366 58.2691 43.0102 179.7085 30 G 4.3664 8.3013 120.5898 46.3758 0.0000 172.6886 31 D 4.8035 9.6400 118.3440 54.7692 44.0681 176.3132 32 Y 5.3106 7.5844 114.4599 54.9863 42.2060 175.0041 33 G 4.5886 8.9004 108.4552 44.4264 0.0000 170.9762 34 L 5.3538 8.6877 122.4296 53.2191 44.2144 175.2532 35 V 4.8956 8.5368 126.9858 59.5960 33.8046 175.2801 36 A 4.1254 8.9039 127.6456 52.2517 18.7371 177.7259 37 L 4.4281 8.7507 121.3765 54.7748 43.5809 176.6421 38 E 4.9167 8.0520 116.8546 53.5347 32.6148 174.1262 39 P 4.8070 0.0000 0.0000 62.7775 32.8959 174.8042 40 A 4.2918 8.8022 122.3783 51.8554 23.6447 174.9427 41 W 5.1622 8.8884 119.1157 55.5596 30.6359 176.2649 42 I 4.6190 8.7643 127.6882 59.6587 38.3644 176.0355 43 T 4.3334 8.7863 118.0265 60.9969 69.5780 175.5666 44 A 4.0546 8.4531 125.9308 55.3417 18.3556 180.1150 45 Q 4.0050 8.0649 115.2147 58.5816 28.7420 178.3252 46 Q 4.0491 8.2657 120.8851 58.4800 29.2130 177.5723 47 I 3.8559 7.8022 120.3477 64.9860 37.1098 177.2270 48 E 3.8411 8.5737 119.6390 59.3901 29.2946 178.3479 49 A 3.9252 8.1313 119.8302 55.3786 18.2559 179.4854 50 A 3.8183 8.1259 117.9902 55.5040 18.7110 179.2325 51 R 3.5543 7.8930 117.1435 59.6652 30.0002 178.3761 52 V 3.4448 8.0360 117.3486 66.3111 31.5143 177.8959 53 A 3.9462 8.0330 120.2089 55.4877 18.0852 179.6205 54 M 3.5359 7.9380 117.1360 58.4946 32.1352 179.1299 55 V 3.5157 7.4871 111.8600 64.6201 31.4822 178.6906 56 R 3.8564 7.9519 116.8861 59.9762 29.9912 177.9308 57 H 4.0408 7.8024 116.8089 57.9020 30.9263 175.8104 58 F 4.7076 7.4265 118.3316 54.7792 37.1836 176.3141 59 R 4.4818 7.7028 115.3308 58.0870 29.9595 176.9947 60 R 3.7628 8.6266 115.8797 56.3170 27.5094 176.5950 61 G 3.7861 7.9322 111.0935 44.7948 0.0000 169.1765 62 G 3.9915 8.0002 109.6702 45.1196 0.0000 171.4854 63 K 4.5940 8.3765 119.2894 54.5547 35.1346 176.1782 64 I 4.9025 8.0868 125.7408 59.4607 40.3772 174.8295 65 F 5.0154 9.1819 125.0864 55.7162 41.6815 174.4821 66 I 4.6796 8.5835 118.6696 59.7663 37.8162 175.6595 67 R 4.2443 9.3371 128.6591 56.9845 30.3255 175.8660 68 I 4.6787 7.6338 110.2375 59.6408 40.6000 174.5595 69 F 4.6860 8.3259 122.5924 56.0776 41.8597 172.7969 70 P 4.4383 0.0000 0.0000 62.5542 29.5544 175.2883 71 D 4.7138 8.2184 123.1392 53.0672 40.9786 176.3064 72 K 4.3734 7.6504 123.3709 54.9303 33.3968 174.0489 73 P 4.3177 0.0000 0.0000 62.2720 32.3489 174.7801 74 Y 4.6771 8.4836 124.6599 56.2906 40.7568 174.7561 75 T 4.5727 7.8330 122.7876 62.3190 71.1830 174.3717 76 K 4.1917 8.3326 123.7357 55.5377 35.8474 175.7208 77 K 4.1741 8.6509 127.1685 55.4501 32.7415 174.6677 78 P 4.5524 0.0000 0.0000 62.1266 32.0993 176.0863 79 L 4.3263 8.1699 118.3367 55.2200 42.5016 176.9993 80 E 4.1688 8.6794 117.9283 57.3580 27.1467 174.7586 81 V 4.3460 6.9938 110.7072 59.6501 33.5364 176.4799 82 R 4.3150 8.1112 121.9539 55.3663 31.4982 176.0164 83 M 4.1700 8.2327 118.3494 56.3556 32.5992 177.7255 84 G 3.7589 8.5733 109.3632 45.6274 0.0000 173.7021 85 K 3.7825 8.7674 116.8045 57.2705 28.7158 177.3293 86 G 3.9871 8.1786 103.1697 44.7561 0.0000 173.9647 87 K 4.0454 8.1327 120.1697 55.6424 32.8496 177.5743 88 G 3.9598 8.3563 111.6360 46.8114 0.0000 171.7043 89 N 5.1187 8.0068 114.6777 51.1563 41.4668 175.0926 90 V 4.1580 8.2474 121.9260 63.5343 31.6208 175.5385 91 E 4.4084 10.0337 127.8588 56.0552 30.8580 176.4097 92 G 3.9374 6.6362 105.2212 46.0671 0.0000 170.6166 93 Y 5.0690 7.6899 115.0385 56.4167 42.5000 175.0719 94 V 4.8316 9.0946 113.3971 59.7814 36.8182 174.0069 95 A 4.6999 8.7706 125.1726 50.2191 21.2364 176.2547 96 V 4.3725 8.2768 122.7677 62.4483 32.7573 175.3098 97 V 4.4912 9.4063 127.7731 61.0697 34.3673 174.4962 98 K 4.9340 8.3647 125.3459 53.4612 36.2281 173.6251 99 P 4.4192 0.0000 0.0000 63.9451 31.6637 176.9095 100 G 4.0113 9.0918 111.8462 45.2094 0.0000 173.4879 101 R 4.0452 7.6782 121.6205 56.3548 31.2205 175.7264 102 V 4.2131 8.2391 127.2688 62.3926 31.3522 175.4203 103 M 3.9960 9.0728 129.9500 57.5140 33.1747 176.5266 104 F 5.8512 7.6958 114.8072 56.1404 44.1437 173.6732 105 E 5.4925 9.1601 117.4815 55.6304 34.3207 175.0430 106 V 5.2404 9.0498 114.5101 60.1283 36.4472 174.4053 107 A 5.0890 8.2196 123.1080 50.9595 23.2541 176.1035 108 G 4.0136 9.0330 105.0586 46.3975 0.0000 174.1059 109 V 4.3238 7.5664 116.8582 59.4719 35.0366 175.2415 110 T 4.0563 8.3915 116.6299 61.8792 70.3743 175.1989 111 E 3.8208 8.7708 122.5125 59.0733 29.7242 178.8738 112 E 3.8499 8.0300 119.2290 59.3344 29.8562 178.1948 113 Q 4.1689 8.3646 117.9925 59.1274 28.8534 179.0858 114 A 4.0760 8.4659 121.6798 56.2902 18.3312 178.8441 115 M 3.8400 7.7448 116.5960 57.9676 31.6653 178.4308 116 E 3.7853 8.1415 120.8737 60.1555 30.4447 178.9596 117 A 3.6939 8.3018 120.3535 55.7494 18.3173 179.3755 118 L 3.9941 8.4772 115.8862 57.7000 41.6792 180.0354 119 R 3.9151 8.1067 118.3346 59.3863 30.3641 178.3499 120 I 3.9492 7.8125 119.6051 64.1211 37.0513 178.2026 121 A 4.1272 7.9047 121.3417 54.8547 18.1347 179.4781 122 G 3.6789 8.2394 106.0800 48.2144 0.0000 174.7350 123 H 4.6676 7.8380 115.0196 56.4927 28.7732 175.7965 124 K 4.5031 7.6964 117.6597 55.8917 33.5757 175.8777 125 L 4.6562 7.4117 120.6472 52.2568 42.9148 175.6488 126 P 4.4538 0.0000 0.0000 64.1554 31.2976 175.3282 127 I 4.9071 7.3588 112.3822 59.8164 40.7075 174.3316 128 K 4.7420 8.6421 120.4081 55.6719 34.4659 176.0221 129 T 5.3053 8.1094 112.2106 59.1470 72.4409 172.3605 130 K 4.6695 8.3356 120.0363 55.4203 35.6888 174.5430 131 I 5.0310 8.4111 126.5864 59.9628 39.4627 174.9591 132 V 4.5084 8.8181 117.8769 61.5752 36.3129 176.3938 133 R 4.1357 9.2754 122.6287 55.6901 29.5288 177.5572 134 R 4.5508 5.8400 112.7564 55.9439 35.3004 172.5734 135 D 4.2826 7.4401 130.5440 53.9184 40.7023 177.2568 136 A 4.5648 7.3127 119.9660 51.6439 20.3877 176.9076 137 Y 4.7416 7.3961 114.1320 58.5815 37.6380 176.3965 138 D 4.6955 7.6060 117.8545 52.7903 41.2377 175.2188 139 E 4.3145 7.6067 117.9970 56.1396 30.0467 177.6295 140 A 3.9658 7.9315 124.7367 53.8931 18.4344 178.3426 141 Q 4.3433 8.0252 119.4536 56.2717 29.6495 172.6989 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 M 8.30 4.39 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 -0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 2.62 0.00 2 L 7.05 5.24 0.00 1.73 1.55 1.17 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 3 M 7.44 4.10 0.00 1.67 1.07 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 4 P 0.00 4.87 0.00 2.23 2.30 0.00 2.88 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.92 0.00 5 R 8.71 4.04 0.00 1.81 2.05 0.00 3.17 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.68 0.00 6 R 7.45 4.76 0.00 1.72 1.75 0.00 3.20 0.00 0.00 3.21 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.63 0.00 7 M 8.01 4.83 0.00 2.06 2.04 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 2.52 2.59 0.00 8 K 8.66 3.87 0.00 1.33 1.05 0.00 1.69 0.00 0.00 1.77 0.00 0.00 2.68 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.30 1.39 7.81 9 Y 7.41 4.84 0.00 2.94 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 10 R 8.88 4.25 0.00 1.82 1.99 0.00 3.23 0.00 0.00 3.26 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.73 0.00 11 K 7.89 4.74 0.00 1.75 1.64 0.00 1.76 0.00 0.00 1.73 0.00 0.00 3.06 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.39 7.81 12 Q 8.17 4.56 0.00 2.07 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.85 0.00 0.00 0.00 0.00 0.00 2.19 2.34 0.00 13 Q 8.68 4.06 0.00 2.07 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 7.08 0.00 0.00 0.00 0.00 0.00 2.36 2.38 0.00 14 R 8.75 4.30 0.00 1.92 2.18 0.00 3.28 0.00 0.00 3.34 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 1.94 0.00 15 G 9.74 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 16 R 8.02 4.60 0.00 1.79 1.85 0.00 3.31 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.60 0.00 17 L 7.94 4.66 0.00 1.56 1.57 0.92 1.07 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 18 K 8.40 4.19 0.00 1.73 1.75 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.43 1.49 7.81 19 G 8.47 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 0.00 0.00 0.00 20 A 8.51 3.96 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 21 T 8.33 4.02 4.17 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 1.27 0.00 0.00 22 K 9.03 4.25 0.00 1.88 1.93 0.00 1.78 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.28 1.41 7.81 23 G 7.58 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 24 G 8.57 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 0.00 0.00 0.00 25 D 7.75 4.80 0.00 2.69 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 26 Y 6.54 4.53 0.00 2.95 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 27 V 7.72 3.48 2.31 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 1.04 0.00 0.00 1.16 0.00 0.00 28 A 8.32 3.78 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 0.00 0.00 0.00 0.00 0.00 29 F 8.41 4.35 0.00 2.89 1.75 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 30 G 8.30 4.37 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 0.00 31 D 9.64 4.80 0.00 2.50 2.29 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 32 Y 7.58 5.31 0.00 3.06 2.90 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 33 G 8.90 4.59 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 0.00 0.00 0.00 34 L 8.69 5.35 0.00 1.98 1.67 1.05 1.25 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 35 V 8.54 4.90 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 0.88 0.00 0.00 0.95 0.00 0.00 36 A 8.90 4.13 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 37 L 8.75 4.43 0.00 1.63 1.70 0.99 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 38 E 8.05 4.92 0.00 1.79 1.80 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 2.18 2.25 0.00 39 P 0.00 4.81 0.00 2.07 2.04 0.00 3.80 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.95 0.00 40 A 8.80 4.29 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 41 W 8.89 5.16 0.00 3.12 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 42 I 8.76 4.62 1.87 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 1.27 0.60 1.00 0.00 0.00 43 T 8.79 4.33 4.17 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 1.07 0.00 0.00 44 A 8.45 4.05 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 45 Q 8.06 4.00 0.00 2.25 2.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.78 0.00 0.00 0.00 0.00 0.00 2.39 2.38 0.00 46 Q 8.27 4.05 0.00 2.21 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.20 6.75 0.00 0.00 0.00 0.00 0.00 2.34 2.46 0.00 47 I 7.80 3.86 2.06 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 1.64 0.62 1.05 0.00 0.00 48 E 8.57 3.84 0.00 2.14 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 0.00 2.31 2.37 0.00 49 A 8.13 3.93 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.13 3.82 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 51 R 7.89 3.55 0.00 1.85 1.97 0.00 3.10 0.00 0.00 3.07 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.51 0.00 52 V 8.04 3.44 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 0.95 0.00 0.00 0.93 0.00 0.00 53 A 8.03 3.95 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 7.94 3.54 0.00 1.58 1.95 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.50 2.34 0.00 55 V 7.49 3.52 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 0.92 0.00 0.00 56 R 7.95 3.86 0.00 1.86 1.94 0.00 3.30 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.73 0.00 57 H 7.80 4.04 0.00 3.08 3.07 0.00 5.74 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 58 F 7.43 4.71 0.00 2.99 3.09 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 0.00 0.00 0.00 0.00 59 R 7.70 4.48 0.00 1.93 2.03 0.00 2.84 0.00 0.00 3.91 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.88 0.00 60 R 8.63 3.76 0.00 1.94 1.97 0.00 3.25 0.00 0.00 3.24 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 61 G 7.93 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 62 G 8.00 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 63 K 8.38 4.59 0.00 1.69 1.41 0.00 1.51 0.00 0.00 1.24 0.00 0.00 3.07 0.00 0.00 2.64 0.00 0.00 0.00 0.00 0.75 1.17 7.81 64 I 8.09 4.90 1.82 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.91 0.85 0.00 0.00 65 F 9.18 5.02 0.00 3.10 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 66 I 8.58 4.68 2.09 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.70 1.01 0.00 0.00 67 R 9.34 4.24 0.00 1.79 1.99 0.00 2.83 0.00 0.00 3.22 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.49 0.00 68 I 7.63 4.68 1.85 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.88 0.80 0.00 0.00 69 F 8.33 4.69 0.00 2.90 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 70 P 0.00 4.44 0.00 2.03 1.91 0.00 2.98 0.00 0.00 3.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.63 0.00 71 D 8.22 4.71 0.00 2.89 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 72 K 7.65 4.37 0.00 1.64 1.60 0.00 1.31 0.00 0.00 0.64 0.00 0.00 2.89 0.00 0.00 2.52 0.00 0.00 0.00 0.00 0.99 1.22 7.81 73 P 0.00 4.32 0.00 1.85 1.63 0.00 3.63 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.29 0.00 74 Y 8.48 4.68 0.00 2.83 2.72 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 75 T 7.83 4.57 4.09 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 0.00 0.00 0.00 1.10 0.00 0.00 76 K 8.33 4.19 0.00 1.69 1.54 0.00 1.48 0.00 0.00 1.68 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.35 1.42 7.81 77 K 8.65 4.17 0.00 1.75 1.72 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.41 1.42 7.81 78 P 0.00 4.55 0.00 2.03 2.01 0.00 3.65 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 2.01 2.09 0.00 79 L 8.17 4.33 0.00 1.70 1.57 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 80 E 8.68 4.17 0.00 2.10 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 2.21 2.31 0.00 81 V 6.99 4.35 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 0.77 0.00 0.00 0.95 0.00 0.00 82 R 8.11 4.31 0.00 1.79 1.89 0.00 3.20 0.00 0.00 3.22 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 83 M 8.23 4.17 0.00 1.99 1.99 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.47 0.00 84 G 8.57 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 0.00 0.00 0.00 85 K 8.77 3.78 0.00 1.92 1.99 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.31 1.48 7.81 86 G 8.18 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 87 K 8.13 4.05 0.00 1.71 1.70 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.82 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.40 7.81 88 G 8.36 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 0.00 0.00 0.00 89 N 8.01 5.12 0.00 2.70 2.69 0.00 0.00 7.10 7.56 0.00 0.00 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 V 8.25 4.16 2.00 0.00 0.00 0.00 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 0.91 0.00 0.00 91 E 10.03 4.41 0.00 1.87 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 2.39 2.42 0.00 92 G 6.64 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 93 Y 7.69 5.07 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 94 V 9.09 4.83 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 0.71 0.00 0.00 0.27 0.00 0.00 95 A 8.77 4.70 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 0.00 0.00 0.00 0.00 0.00 0.00 96 V 8.28 4.37 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 0.95 0.00 0.00 0.83 0.00 0.00 97 V 9.41 4.49 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 0.70 0.00 0.00 0.95 0.00 0.00 98 K 8.36 4.93 0.00 1.70 1.72 0.00 1.75 0.00 0.00 2.12 0.00 0.00 2.89 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.43 1.44 7.81 99 P 0.00 4.42 0.00 2.02 2.10 0.00 3.71 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 2.01 2.07 0.00 100 G 9.09 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 0.00 101 R 7.68 4.05 0.00 1.87 1.80 0.00 3.12 0.00 0.00 3.02 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.50 0.00 102 V 8.24 4.21 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 0.83 0.00 0.00 0.86 0.00 0.00 103 M 9.07 4.00 0.00 1.05 1.30 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.27 0.00 104 F 7.70 5.85 0.00 3.06 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 0.00 105 E 9.16 5.49 0.00 2.21 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 2.41 2.43 0.00 106 V 9.05 5.24 2.27 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 1.06 0.00 0.00 1.24 0.00 0.00 107 A 8.22 5.09 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 0.00 108 G 9.03 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 0.00 109 V 7.57 4.32 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 0.70 0.00 0.00 0.24 0.00 0.00 110 T 8.39 4.06 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 1.26 0.00 0.00 111 E 8.77 3.82 0.00 2.16 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.12 0.00 112 E 8.03 3.85 0.00 2.07 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 2.40 2.40 0.00 113 Q 8.36 4.17 0.00 2.31 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.56 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 114 A 8.47 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 115 M 7.74 3.84 0.00 1.94 2.08 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.53 2.76 0.00 116 E 8.14 3.79 0.00 1.96 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 2.40 2.13 0.00 117 A 8.30 3.69 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 0.00 118 L 8.48 3.99 0.00 1.76 1.83 1.11 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 0.00 0.00 0.00 0.00 0.00 0.00 119 R 8.11 3.92 0.00 1.77 2.10 0.00 3.28 0.00 0.00 3.23 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.66 0.00 120 I 7.81 3.95 1.89 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 1.65 0.98 0.88 0.00 0.00 121 A 7.90 4.13 1.26 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 0.00 0.00 122 G 8.24 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 0.00 0.00 0.00 123 H 7.84 4.67 0.00 3.42 3.32 0.00 5.61 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 0.00 124 K 7.70 4.50 0.00 1.83 1.82 0.00 1.70 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.59 1.50 7.81 125 L 7.41 4.66 0.00 1.69 1.60 1.04 1.40 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 0.00 126 P 0.00 4.45 0.00 2.17 2.17 0.00 3.72 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.10 0.00 127 I 7.36 4.91 1.94 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.72 0.96 0.00 0.00 128 K 8.64 4.74 0.00 1.73 1.73 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.37 1.58 7.81 129 T 8.11 5.31 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 1.22 0.00 0.00 130 K 8.34 4.67 0.00 1.82 1.63 0.00 1.72 0.00 0.00 1.84 0.00 0.00 2.86 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.50 7.81 131 I 8.41 5.03 1.94 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 1.39 0.78 1.05 0.00 0.00 132 V 8.82 4.51 2.34 0.00 0.00 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 1.12 0.00 0.00 133 R 9.28 4.14 0.00 1.84 1.60 0.00 3.39 0.00 0.00 3.19 7.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.58 0.00 134 R 5.84 4.55 0.00 1.76 1.71 0.00 3.48 0.00 0.00 3.31 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.46 0.00 135 D 7.44 4.28 0.00 2.54 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 0.00 136 A 7.31 4.56 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 0.00 137 Y 7.40 4.74 0.00 2.92 3.03 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 0.00 138 D 7.61 4.70 0.00 2.53 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 0.00 139 E 7.61 4.31 0.00 1.29 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 2.46 2.38 0.00 140 A 7.93 3.97 1.22 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 0.00 0.00 141 Q 8.03 4.34 0.00 2.10 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.99 6.60 0.00 0.00 0.00 0.00 0.00 2.11 2.01 0.00