NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 M 4.4986 8.1633 120.6136 55.5842 34.4940 173.3543 3 I 4.7963 8.2290 121.1969 59.0213 39.5272 174.1671 4 R 4.7040 9.1864 125.9631 54.2432 34.4323 174.8467 5 G 4.3048 8.7160 109.3753 45.7509 0.0000 172.9659 6 I 4.8980 8.6809 122.0380 59.3265 41.1750 174.9081 7 R 5.1111 8.8214 124.2153 54.7902 33.8180 174.8628 8 G 4.6980 8.3377 106.1489 45.0702 0.0000 171.6304 9 A 5.2192 7.9185 120.1254 51.2735 22.8612 175.1319 10 T 5.1208 8.9164 114.6680 61.4834 71.6974 172.1113 11 T 5.6825 8.2680 112.6308 58.8781 71.8076 173.5125 12 V 4.5232 8.2755 115.0100 59.8811 34.1707 175.7968 13 E 4.2863 9.1240 121.8178 57.9872 29.9780 177.4019 14 R 4.6269 7.3239 115.3315 54.3504 34.0828 175.1944 15 D 4.6203 8.4842 121.4047 53.5186 39.9631 175.8108 16 T 4.7441 7.6594 114.3464 58.2747 73.4919 174.1771 17 E 3.8502 8.6201 122.3414 59.4547 29.7031 178.4007 18 E 3.9024 8.2279 118.8014 59.6437 29.4999 178.6805 19 E 3.9406 7.9148 118.3109 59.3422 29.4614 179.3252 20 I 3.6810 7.5169 119.3919 64.4820 37.1317 178.5819 21 L 3.9654 8.2002 120.0371 57.6592 41.3733 179.3333 22 Q 3.9080 8.2286 119.5947 59.3279 29.0649 178.5998 23 K 3.9703 8.3373 119.7718 59.6555 32.0154 179.6242 24 T 3.8632 8.2699 116.6003 66.2288 68.2702 176.7374 25 K 3.7982 8.3008 121.9158 59.6286 32.3212 178.8424 26 Q 3.9252 8.2246 118.5314 58.9163 28.5514 178.4869 27 L 3.8500 7.8819 121.2524 58.0543 42.1091 178.6430 28 L 3.8030 7.7764 118.6859 58.2140 41.6524 179.6127 29 E 3.8373 8.1909 118.1178 59.2412 29.2666 179.4661 30 K 3.9369 7.7726 119.1856 59.4362 32.2761 179.0033 31 I 3.6846 7.8449 120.2146 64.3978 36.9827 178.5389 32 I 3.7729 8.0708 121.0832 64.3076 36.7163 178.1420 33 E 3.9496 8.0613 119.1345 59.3576 29.5579 178.4359 34 E 4.0891 8.4386 118.0832 58.5334 29.6423 178.0233 35 N 4.6480 7.8548 113.0132 51.8479 40.1298 174.1748 36 H 4.1333 8.0465 116.6641 57.0894 26.8021 175.3325 37 T 4.2930 7.8018 114.2950 63.1388 69.7781 174.8750 38 K 4.6441 8.3138 124.2991 53.8295 34.5919 175.4498 39 P 2.9700 0.0000 0.0000 65.3240 31.1932 177.9334 40 E 4.0557 7.7888 113.2497 57.7908 30.1484 176.7280 41 D 4.4989 8.0755 119.5520 54.2286 41.2787 175.8010 42 V 4.4725 7.2072 120.4722 61.2926 31.5969 175.4543 43 V 3.8553 8.5818 129.1249 65.4967 32.0343 175.4671 44 Q 4.7851 7.6123 115.7811 56.4760 31.4253 171.9116 45 M 5.3135 8.4110 117.9781 54.2087 36.0990 173.3401 46 L 5.3057 9.1106 125.2916 52.9490 45.5312 175.3805 47 L 5.2437 8.8747 122.0064 53.0318 45.3635 175.8026 48 S 5.9425 9.5084 118.3457 55.9707 66.1764 172.9620 49 A 5.3040 8.2168 121.7285 50.2968 22.7479 175.7482 50 T 4.4259 8.3863 111.0709 60.4361 70.3324 173.8947 51 P 4.2908 0.0000 0.0000 64.1141 30.9399 176.2560 52 D 4.7506 7.9375 117.2363 53.1467 39.6195 175.9116 53 L 4.9025 7.5570 119.6704 53.8809 43.5654 175.6643 54 H 4.7013 9.3777 119.0894 55.0351 30.6215 174.8617 55 A 4.1336 8.4737 123.5685 54.7759 18.4266 178.2276 56 V 4.3171 6.9654 111.4365 60.3231 34.1020 173.2906 57 F 4.5096 8.4739 120.5735 56.8130 39.5197 175.1646 58 P 4.3450 0.0000 0.0000 65.2914 31.0928 178.4034 59 A 4.2239 8.2386 119.4783 55.0208 17.6481 179.0807 60 K 4.0500 8.2717 117.3758 58.8724 32.2054 178.5800 61 A 4.0788 8.4620 121.4006 54.9279 18.4264 179.5847 62 V 3.4865 7.7859 117.0530 66.0666 31.2778 178.3923 63 R 4.0547 7.5144 116.4049 58.6282 29.8895 176.9887 64 E 4.2278 7.8958 117.2617 56.1883 29.8024 175.5654 65 L 4.5993 7.6833 118.9318 52.7658 43.2378 176.0020 66 S 4.4633 8.6678 119.5290 59.7032 63.2094 174.3581 67 G 4.0951 8.4602 113.2491 45.1952 0.0000 173.8932 68 W 4.4029 8.5785 119.1568 56.3275 29.4990 177.9476 69 Q 3.9695 8.0412 117.1150 58.4973 27.8918 176.6759 70 Y 4.6740 7.6088 114.0716 57.5379 38.6853 175.5492 71 V 3.7641 7.8804 121.8512 61.7217 32.2863 173.5558 72 P 4.6024 0.0000 0.0000 62.8175 32.3737 175.5712 73 V 5.5356 8.2420 116.5048 58.9147 35.6327 174.6860 74 T 4.5763 8.2155 116.3059 61.1759 70.9249 172.4396 75 C 5.7705 8.5565 124.0615 58.5503 30.6295 172.2641 76 M 4.7640 8.1848 115.7031 54.6297 34.2086 172.9400 77 Q 4.9503 8.4621 121.1679 54.6459 30.3627 174.8905 78 E 4.3441 8.9718 128.4489 55.9430 30.5141 176.3994 79 M 4.1492 8.5105 122.8507 55.0703 32.0925 175.4506 80 D 4.5239 8.5538 121.4369 53.5663 41.6312 175.4334 81 V 4.3406 8.0329 126.4146 60.8406 33.6675 174.6543 82 T 4.0674 8.3908 123.9186 65.6723 68.2970 174.5596 83 G 3.9906 9.0778 116.3613 44.9279 0.0000 173.6187 84 G 3.7758 7.5870 108.4950 45.2247 0.0000 173.2538 85 L 4.0032 8.3618 123.6442 54.9579 42.6635 176.8437 86 K 4.3867 8.4345 124.5638 55.8467 34.3111 176.0083 87 K 3.8952 8.6629 117.5937 58.3117 30.0586 174.8812 88 C 5.2770 8.1694 118.3842 57.6305 34.8420 173.0138 89 I 4.8832 8.6880 126.9887 59.8116 39.0755 174.8251 90 R 5.1802 8.7175 126.4712 54.2959 33.3435 175.6165 91 V 4.8894 8.4879 120.6236 60.1551 35.3030 174.3803 92 M 4.7654 9.0219 122.2850 54.2375 34.8987 173.7548 93 M 4.8203 9.0357 128.2406 54.3985 34.0194 174.8145 94 T 4.8020 8.5955 124.4043 62.9750 70.0809 174.7280 95 V 4.9705 8.6759 118.8313 59.4216 36.4514 174.2698 96 Q 4.6605 8.8471 124.3935 55.9722 29.6226 174.7512 97 T 4.3640 8.7294 119.4266 62.0471 70.5006 172.1211 98 D 4.7004 8.7225 123.3050 54.6271 42.8066 177.0828 99 V 3.6847 7.4260 118.8510 61.9806 32.0825 173.8924 100 P 4.3997 0.0000 0.0000 62.5954 31.7782 177.0028 101 Q 3.7935 8.7444 121.8866 59.3860 29.0702 178.3271 102 D 4.5719 8.0152 113.9995 53.8790 40.0076 176.4129 103 Q 4.4977 8.3711 118.2384 55.6369 30.0108 175.9069 104 I 3.6145 7.1530 119.8933 61.5632 37.3470 175.6221 105 R 4.3157 8.3798 124.9724 55.5710 30.4786 175.6756 106 H 5.0027 8.6218 120.1803 54.3167 31.0607 174.6494 107 V 4.4934 8.1697 120.7102 61.3474 34.4832 173.9752 108 Y 5.0260 8.7035 124.1269 56.4866 41.1331 174.5382 109 L 4.7583 9.2521 124.0432 52.2323 45.6454 178.2362 110 E 3.4763 8.7550 119.2828 58.2103 27.8947 177.9661 111 K 4.2613 8.9735 125.7267 58.7221 32.0523 177.6395 112 A 4.2982 8.1599 121.2507 53.3120 18.2253 179.3309 113 V 3.6871 7.4585 111.2693 64.2174 31.6832 177.9961 114 V 3.8685 7.3421 116.1507 62.4716 31.4017 176.1792 115 L 4.1862 7.6813 125.2075 55.0510 41.7291 176.0854 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 2 M 8.16 4.50 0.00 2.26 2.03 0.00 0.00 0.00 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.65 0.00 3 I 8.23 4.80 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 1.34 0.41 0.98 0.00 0.00 4 R 9.19 4.70 0.00 1.68 1.78 0.00 3.29 0.00 0.00 3.19 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.70 0.00 5 G 8.72 4.30 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 0.00 6 I 8.68 4.90 1.88 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 1.22 0.86 0.88 0.00 0.00 7 R 8.82 5.11 0.00 1.64 1.62 0.00 3.38 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 8 G 8.34 4.70 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 0.00 0.00 0.00 9 A 7.92 5.22 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 10 T 8.92 5.12 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 1.19 0.00 0.00 11 T 8.27 5.68 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 1.28 0.00 0.00 12 V 8.28 4.52 2.28 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 0.75 0.00 0.00 0.96 0.00 0.00 13 E 9.12 4.29 0.00 1.96 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 2.31 2.41 0.00 14 R 7.32 4.63 0.00 1.90 1.75 0.00 3.15 0.00 0.00 3.14 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.54 0.00 15 D 8.48 4.62 0.00 2.61 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 16 T 7.66 4.74 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 17 E 8.62 3.85 0.00 2.04 1.97 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 2.37 2.36 0.00 18 E 8.23 3.90 0.00 2.06 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 2.37 2.41 0.00 19 E 7.91 3.94 0.00 1.99 1.97 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 2.32 2.34 0.00 20 I 7.52 3.68 1.98 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 1.51 0.84 0.91 0.00 0.00 21 L 8.20 3.97 0.00 1.66 1.70 0.92 1.05 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 22 Q 8.23 3.91 0.00 2.18 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.80 0.00 0.00 0.00 0.00 0.00 2.34 2.39 0.00 23 K 8.34 3.97 0.00 1.85 1.82 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.57 1.61 7.81 24 T 8.27 3.86 4.39 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 1.20 0.00 0.00 25 K 8.30 3.80 0.00 1.80 1.92 0.00 1.58 0.00 0.00 1.60 0.00 0.00 3.01 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.36 1.37 7.81 26 Q 8.22 3.93 0.00 2.22 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.56 0.00 0.00 0.00 0.00 0.00 2.35 2.54 0.00 27 L 7.88 3.85 0.00 1.80 1.78 0.90 0.67 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 28 L 7.78 3.80 0.00 1.69 1.37 0.73 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.19 3.84 0.00 2.09 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 2.20 2.40 0.00 30 K 7.77 3.94 0.00 1.96 1.81 0.00 1.50 0.00 0.00 1.62 0.00 0.00 3.03 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.42 1.50 7.81 31 I 7.84 3.68 1.96 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.42 0.90 0.00 0.00 32 I 8.07 3.77 1.99 0.00 0.00 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.73 1.10 0.00 0.00 33 E 8.06 3.95 0.00 2.09 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 2.32 2.35 0.00 34 E 8.44 4.09 0.00 1.91 1.95 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 2.45 2.48 0.00 35 N 7.85 4.65 0.00 2.80 2.81 0.00 0.00 7.37 8.56 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 36 H 8.05 4.13 0.00 3.30 3.36 0.00 5.84 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 37 T 7.80 4.29 4.46 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 1.36 0.00 0.00 38 K 8.31 4.64 0.00 1.94 1.87 0.00 1.72 0.00 0.00 1.86 0.00 0.00 2.91 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.46 1.37 7.81 39 P 0.00 2.97 0.00 1.72 0.95 0.00 3.45 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 1.84 1.25 0.00 40 E 7.79 4.06 0.00 1.98 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 2.20 2.21 0.00 41 D 8.08 4.50 0.00 2.80 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 42 V 7.21 4.47 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 0.87 0.00 0.00 0.85 0.00 0.00 43 V 8.58 3.86 2.18 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 0.81 0.00 0.00 0.92 0.00 0.00 44 Q 7.61 4.79 0.00 2.22 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.61 0.00 0.00 0.00 0.00 0.00 2.18 2.21 0.00 45 M 8.41 5.31 0.00 2.17 2.00 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 46 L 9.11 5.31 0.00 1.59 1.51 0.93 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 47 L 8.87 5.24 0.00 1.55 1.53 0.92 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 48 S 9.51 5.94 0.00 3.85 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 49 A 8.22 5.30 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 50 T 8.39 4.43 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 1.22 0.00 0.00 51 P 0.00 4.29 0.00 2.22 2.21 0.00 3.75 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 1.99 1.96 0.00 52 D 7.94 4.75 0.00 2.83 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 53 L 7.56 4.90 0.00 1.54 1.55 0.90 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 54 H 9.38 4.70 0.00 3.04 3.22 0.00 5.65 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 55 A 8.47 4.13 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 56 V 6.97 4.32 2.05 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 0.67 0.00 0.00 0.95 0.00 0.00 57 F 8.47 4.51 0.00 3.12 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 58 P 0.00 4.35 0.00 2.18 2.12 0.00 3.75 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 2.16 2.19 0.00 59 A 8.24 4.22 1.29 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 0.00 0.00 60 K 8.27 4.05 0.00 1.93 2.02 0.00 1.68 0.00 0.00 1.69 0.00 0.00 2.98 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.45 1.48 7.81 61 A 8.46 4.08 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 62 V 7.79 3.49 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 1.20 0.00 0.00 0.95 0.00 0.00 63 R 7.51 4.05 0.00 2.07 1.98 0.00 3.22 0.00 0.00 3.28 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.64 0.00 64 E 7.90 4.23 0.00 1.91 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 0.00 2.30 2.26 0.00 65 L 7.68 4.60 0.00 1.58 1.21 0.10 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 66 S 8.67 4.46 0.00 4.03 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 67 G 8.46 4.10 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 0.00 0.00 0.00 68 W 8.58 4.40 0.00 3.69 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 69 Q 8.04 3.97 0.00 1.90 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.89 6.71 0.00 0.00 0.00 0.00 0.00 1.16 1.80 0.00 70 Y 7.61 4.67 0.00 2.95 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 71 V 7.88 3.76 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 0.84 0.00 0.00 0.56 0.00 0.00 72 P 0.00 4.60 0.00 2.16 2.19 0.00 3.69 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 1.99 0.00 73 V 8.24 5.54 2.11 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 0.98 0.00 0.00 0.93 0.00 0.00 74 T 8.22 4.58 4.20 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 0.00 0.00 1.19 0.00 0.00 75 C 8.56 5.77 0.00 2.82 2.93 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 76 M 8.18 4.76 0.00 2.06 2.13 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 2.57 2.68 0.00 77 Q 8.46 4.95 0.00 2.12 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 7.04 0.00 0.00 0.00 0.00 0.00 2.29 2.48 0.00 78 E 8.97 4.34 0.00 2.00 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 2.33 2.31 0.00 79 M 8.51 4.15 0.00 2.17 2.06 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.53 0.00 80 D 8.55 4.52 0.00 2.67 2.64 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 81 V 8.03 4.34 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 1.09 0.00 0.00 0.94 0.00 0.00 82 T 8.39 4.07 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 83 G 9.08 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 84 G 7.59 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 85 L 8.36 4.00 0.00 1.61 1.61 0.93 0.63 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 86 K 8.43 4.39 0.00 1.78 1.92 0.00 1.97 0.00 0.00 1.71 0.00 0.00 3.10 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.39 1.39 7.81 87 K 8.66 3.90 0.00 1.98 1.91 0.00 1.60 0.00 0.00 1.70 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.56 7.81 88 C 8.17 5.28 0.00 3.00 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 89 I 8.69 4.88 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 1.23 0.62 0.90 0.00 0.00 90 R 8.72 5.18 0.00 1.76 1.79 0.00 3.27 0.00 0.00 3.25 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.56 0.00 91 V 8.49 4.89 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 0.67 0.00 0.00 0.96 0.00 0.00 92 M 9.02 4.77 0.00 2.12 1.95 0.00 0.00 0.00 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.50 0.00 93 M 9.04 4.82 0.00 2.16 1.97 0.00 0.00 0.00 0.00 0.00 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.61 0.00 94 T 8.60 4.80 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 1.22 0.00 0.00 95 V 8.68 4.97 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 0.74 0.00 0.00 1.00 0.00 0.00 96 Q 8.85 4.66 0.00 2.01 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.71 6.69 0.00 0.00 0.00 0.00 0.00 2.33 2.42 0.00 97 T 8.73 4.36 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 98 D 8.72 4.70 0.00 2.64 2.65 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 0.00 0.00 0.00 0.00 99 V 7.43 3.68 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 0.84 0.00 0.00 0.95 0.00 0.00 100 P 0.00 4.40 0.00 2.49 2.17 0.00 3.80 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 1.96 0.00 101 Q 8.74 3.79 0.00 2.12 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.98 0.00 0.00 0.00 0.00 0.00 2.48 2.43 0.00 102 D 8.02 4.57 0.00 2.82 2.78 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 0.00 103 Q 8.37 4.50 0.00 2.01 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.86 0.00 0.00 0.00 0.00 0.00 2.30 2.30 0.00 104 I 7.15 3.61 1.79 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 1.47 0.74 0.81 0.00 0.00 105 R 8.38 4.32 0.00 1.77 1.87 0.00 3.32 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 1.60 1.72 0.00 106 H 8.62 5.00 0.00 3.17 3.21 0.00 5.83 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 V 8.17 4.49 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 1.03 0.00 0.00 0.90 0.00 0.00 108 Y 8.70 5.03 0.00 2.80 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 0.00 109 L 9.25 4.76 0.00 1.52 1.55 0.89 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 110 E 8.75 3.48 0.00 2.16 1.48 0.00 0.00 0.00 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 2.25 0.00 111 K 8.97 4.26 0.00 1.84 1.85 0.00 1.66 0.00 0.00 1.65 0.00 0.00 3.02 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.46 1.46 7.81 112 A 8.16 4.30 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 V 7.46 3.69 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 0.98 0.00 0.00 1.00 0.00 0.00 114 V 7.34 3.87 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 0.77 0.00 0.00 0.91 0.00 0.00 115 L 7.68 4.19 0.00 1.41 1.49 1.05 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00