NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 I 4.1679 8.0249 114.2656 60.6696 38.9163 174.3179 2 Q 4.8889 8.5059 120.2269 53.8772 31.7343 173.6217 3 R 4.7692 9.4136 122.5105 54.6108 34.4749 174.2925 4 T 4.9761 8.8801 118.0855 59.8746 68.5279 172.4212 5 P 4.7942 0.0000 0.0000 63.0753 32.0667 176.0737 6 K 4.5027 9.5174 122.8717 56.2087 33.8674 175.9668 7 I 5.1388 8.1820 122.3216 59.9290 41.0795 174.6895 8 Q 4.8183 9.3440 124.8995 54.1324 32.7449 174.2756 9 V 5.0523 8.4281 123.2839 61.4785 34.0230 173.8698 10 Y 5.2753 8.2230 124.3759 56.8768 41.6113 172.9595 11 S 5.0130 9.0518 114.5018 56.8388 64.9604 174.3774 12 R 4.1378 8.8789 122.2830 59.4437 30.0944 176.4160 13 H 5.1259 8.4792 113.7100 52.5989 31.6616 172.2282 14 P 4.4525 0.0000 0.0000 62.7650 31.6067 176.0157 15 A 4.2253 8.6973 124.0530 52.1607 19.1372 176.9818 16 E 4.5267 8.4204 122.0697 54.3066 30.8241 174.7749 17 N 4.2885 8.5261 120.5365 54.6367 38.8513 176.5255 18 G 3.9856 9.5740 112.3204 45.1828 0.0000 173.1503 19 K 4.4598 7.8851 119.6557 54.0335 33.8528 176.1568 20 S 4.0904 8.3569 118.1212 58.6318 63.0586 172.7097 21 N 5.0003 8.9846 123.7570 52.8356 42.8650 172.0191 22 F 5.2317 8.9446 115.9281 55.7179 42.9348 174.0010 23 L 3.9408 8.7180 125.9422 53.5160 43.4025 174.7956 24 N 5.3668 8.5919 123.8139 51.4336 42.0158 172.8738 25 C 5.2145 9.4504 122.4898 55.1262 46.8525 171.8615 26 Y 5.4483 9.4169 129.1440 56.3223 40.4200 174.4802 27 V 5.0595 8.7023 120.8974 59.7620 34.5855 175.2486 28 S 4.9188 9.1421 118.5669 57.9138 66.9928 174.6480 29 G 4.3119 8.5061 106.3300 46.8992 0.0000 173.2863 30 F 5.3408 7.2871 113.9425 55.5446 41.3357 173.8884 31 H 5.2434 9.0198 117.6884 54.9381 33.7755 172.1794 32 P 4.8141 0.0000 0.0000 62.3951 32.5941 175.8039 33 S 3.9234 8.3765 112.7102 60.1761 63.3676 174.2689 34 D 4.4754 7.8519 121.7669 54.2695 41.0439 175.1358 35 I 4.5806 7.9700 122.6075 59.8095 41.4187 173.2695 36 E 4.5438 9.1933 128.2104 54.6029 31.6387 175.0922 37 V 4.4292 8.0052 124.3770 60.9495 33.3948 174.1993 38 D 4.9693 9.1852 127.8490 52.3761 44.4955 174.9896 39 L 4.7106 8.3518 121.9269 53.8150 43.6346 175.4146 40 L 5.0400 9.3093 124.4934 52.8971 44.3613 175.6513 41 K 4.2857 8.8722 124.5596 54.4185 34.1566 175.6101 42 N 3.8413 9.3081 128.0059 54.3655 36.1544 176.2497 43 G 3.9856 8.4620 106.1590 45.2592 0.0000 173.6115 44 E 4.5813 7.3870 119.2403 53.9656 31.4355 175.4128 45 R 4.3122 8.4075 123.4606 56.3293 30.5486 176.0206 46 I 4.0646 8.3499 126.3494 60.9030 38.9240 175.2436 47 E 4.2120 8.7934 125.8851 58.4980 30.5717 177.8108 48 K 4.3202 7.6407 118.9358 55.2127 31.2962 176.1677 49 V 4.0181 7.3236 119.2129 62.3850 33.1480 176.0044 50 E 4.5684 8.2094 127.1849 55.2392 32.2141 174.1901 51 H 5.3847 7.7938 115.1430 54.0163 31.6112 173.1512 52 S 4.5205 8.7720 114.8409 58.1220 63.8692 173.7450 53 D 4.4905 8.4777 120.3425 53.5971 41.2706 176.2864 54 L 4.0155 8.4761 124.9433 56.0398 42.7383 175.8030 55 S 4.8076 8.1140 120.0019 56.8289 66.5704 171.7863 56 F 5.2736 7.6455 113.9863 55.7137 40.8548 174.3329 57 S 4.6931 9.1496 117.0529 57.0724 64.2230 175.7119 58 K 3.6325 8.3804 120.2154 59.3099 31.7024 177.8656 59 D 4.4851 7.8607 116.3316 52.7781 39.3844 177.3773 60 W 3.7399 7.9236 119.4550 56.9630 28.2820 174.7235 61 S 4.3688 8.0752 114.0162 58.1069 63.8694 173.9968 62 F 5.0377 8.4278 121.2268 57.3110 40.4108 174.1887 63 Y 5.3345 8.3146 117.7946 55.9420 41.7708 173.9251 64 L 5.0533 9.3370 120.1399 53.3957 47.0148 174.6236 65 L 5.3118 9.3782 125.5983 54.0015 44.0845 174.4624 66 Y 5.2140 9.1938 124.7779 56.7220 40.3649 174.4627 67 Y 5.8743 8.3916 120.2490 56.4753 42.0068 173.5920 68 T 4.9813 8.4140 114.4866 60.1367 71.4891 172.3153 69 E 3.7667 8.9342 128.6383 56.5432 30.2523 175.7057 70 F 4.9562 9.1112 120.7191 55.8712 42.3138 173.5348 71 T 4.6037 8.0977 114.8634 60.5573 71.1551 171.9109 72 P 4.6739 0.0000 0.0000 63.2387 32.5882 175.5847 73 T 5.0495 8.3301 109.8159 59.2457 71.9907 173.4634 74 E 4.0729 8.6864 121.7508 58.6604 29.6566 177.6031 75 K 4.1121 7.8155 119.5820 59.1698 32.7681 176.3382 76 D 4.6093 8.2242 119.3885 54.4083 41.5974 175.9588 77 E 4.8128 9.2591 123.3889 55.5818 31.8908 174.8363 78 Y 5.3601 8.6913 118.5212 56.6923 42.6217 174.1116 79 A 5.0972 8.9958 122.8293 51.3118 23.9371 173.8580 80 C 5.2916 9.3433 119.2018 54.8361 44.9445 172.4870 81 R 5.1025 9.8498 126.9656 54.5296 32.1678 174.4444 82 V 4.7402 9.0143 126.4333 61.0051 34.6563 173.6015 83 N 5.3052 9.2814 125.9474 52.2429 42.3084 172.3664 84 H 5.1588 8.4440 123.1983 54.5029 33.4258 174.3931 85 V 3.5892 8.0313 121.5520 64.6170 31.3592 177.4098 86 T 4.1036 7.9485 109.3618 62.5680 69.2021 173.4753 87 L 4.7739 7.6269 123.3729 52.8977 43.1816 176.2104 88 S 4.3100 9.0357 120.8905 61.0468 62.9624 174.6734 89 Q 4.6348 7.5393 114.3712 53.1287 31.5359 172.7766 90 P 4.5104 0.0000 0.0000 63.0257 32.4244 175.4555 91 K 4.5078 9.3368 124.8243 55.0597 34.0932 174.9944 92 I 4.9596 8.3637 127.6577 59.4889 39.6307 174.9052 93 V 4.4215 8.5945 126.9907 60.8518 33.8753 174.8667 94 K 4.6860 8.7634 127.5973 55.7395 33.1424 176.7178 95 W 4.4764 9.3879 135.0000 57.7183 31.2729 175.0828 96 D 4.4261 8.5450 128.0068 52.1531 41.5832 176.3351 97 R 3.4260 7.5609 127.8858 59.5017 30.0148 176.3809 98 D 4.7753 8.7311 115.1434 54.3755 40.9745 176.3257 99 M 4.3967 8.1660 125.4099 55.5935 32.9396 175.0581 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 I 8.02 4.17 1.87 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.03 0.89 0.00 0.00 2 Q 8.51 4.89 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.80 6.68 0.00 0.00 0.00 0.00 0.00 2.31 2.50 0.00 3 R 9.41 4.77 0.00 1.88 1.96 0.00 3.14 0.00 0.00 3.15 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 4 T 8.88 4.98 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 1.25 0.00 0.00 5 P 0.00 4.79 0.00 1.99 1.71 0.00 3.79 0.00 0.00 3.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.79 0.00 6 K 9.52 4.50 0.00 1.75 1.82 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.87 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.49 1.48 7.81 7 I 8.18 5.14 1.91 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 1.31 0.60 0.95 0.00 0.00 8 Q 9.34 4.82 0.00 2.40 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.26 6.75 0.00 0.00 0.00 0.00 0.00 2.39 2.47 0.00 9 V 8.43 5.05 2.32 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 0.93 0.00 0.00 1.06 0.00 0.00 10 Y 8.22 5.28 0.00 3.19 3.14 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 0.00 0.00 0.00 0.00 11 S 9.05 5.01 0.00 4.32 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 12 R 8.88 4.14 0.00 1.90 2.12 0.00 3.22 0.00 0.00 3.04 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.49 0.00 13 H 8.48 5.13 0.00 3.22 3.23 0.00 5.91 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 P 0.00 4.45 0.00 2.25 2.14 0.00 3.88 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.03 0.00 15 A 8.70 4.23 1.68 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 16 E 8.42 4.53 0.00 1.96 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 2.30 2.24 0.00 17 N 8.53 4.29 0.00 2.77 2.80 0.00 0.00 7.06 7.93 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 18 G 9.57 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 19 K 7.89 4.46 0.00 1.80 1.68 0.00 1.71 0.00 0.00 1.59 0.00 0.00 2.74 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.36 1.47 7.81 20 S 8.36 4.09 0.00 3.78 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 21 N 8.98 5.00 0.00 2.48 2.33 0.00 0.00 6.75 7.59 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 22 F 8.94 5.23 0.00 3.05 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 23 L 8.72 3.94 0.00 0.27 0.61 -0.16 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 24 N 8.59 5.37 0.00 1.44 1.99 0.00 0.00 5.98 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 25 C 9.45 5.21 0.00 2.87 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 Y 9.42 5.45 0.00 3.36 3.23 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 27 V 8.70 5.06 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 0.66 0.00 0.00 1.10 0.00 0.00 28 S 9.14 4.92 0.00 3.83 3.21 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 29 G 8.51 4.31 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 30 F 7.29 5.34 0.00 3.02 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 31 H 9.02 5.24 0.00 3.30 3.22 0.00 5.58 0.00 0.00 0.00 0.00 6.67 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 4.81 0.00 2.14 2.18 0.00 3.93 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.00 0.00 33 S 8.38 3.92 0.00 3.09 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 34 D 7.85 4.48 0.00 2.66 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 35 I 7.97 4.58 1.47 0.00 0.00 -0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.50 0.83 0.00 0.00 36 E 9.19 4.54 0.00 1.79 1.74 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 2.17 2.15 0.00 37 V 8.01 4.43 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 0.00 0.00 0.24 0.00 0.00 0.44 0.00 0.00 38 D 9.19 4.97 0.00 2.48 2.45 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 0.00 0.00 0.00 0.00 39 L 8.35 4.71 0.00 1.58 1.56 0.87 0.53 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 40 L 9.31 5.04 0.00 1.55 1.53 0.91 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.87 4.29 0.00 1.73 1.59 0.00 1.90 0.00 0.00 1.65 0.00 0.00 2.79 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.05 0.59 7.81 42 N 9.31 3.84 0.00 2.84 2.85 0.00 0.00 7.11 7.20 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 43 G 8.46 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 44 E 7.39 4.58 0.00 2.00 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 2.22 2.19 0.00 45 R 8.41 4.31 0.00 1.75 1.84 0.00 3.21 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 46 I 8.35 4.06 1.92 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 1.32 0.81 1.01 0.00 0.00 47 E 8.79 4.21 0.00 2.00 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 2.26 2.28 0.00 48 K 7.64 4.32 0.00 1.71 1.74 0.00 1.77 0.00 0.00 1.63 0.00 0.00 2.97 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.35 1.40 7.81 49 V 7.32 4.02 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 0.99 0.00 0.00 0.97 0.00 0.00 50 E 8.21 4.57 0.00 1.16 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 2.13 2.12 0.00 51 H 7.79 5.38 0.00 2.34 1.92 0.00 5.72 0.00 0.00 0.00 0.00 6.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.77 4.52 0.00 3.97 4.03 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 53 D 8.48 4.49 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 54 L 8.48 4.02 0.00 1.65 1.63 0.87 0.61 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 55 S 8.11 4.81 0.00 3.72 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 56 F 7.65 5.27 0.00 2.90 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 57 S 9.15 4.69 0.00 4.08 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 58 K 8.38 3.63 0.00 1.62 1.69 0.00 1.64 0.00 0.00 1.67 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.29 1.33 7.81 59 D 7.86 4.49 0.00 2.79 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 60 W 7.92 3.74 0.00 3.32 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 61 S 8.08 4.37 0.00 3.86 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 62 F 8.43 5.04 0.00 1.65 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 63 Y 8.31 5.33 0.00 3.08 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 64 L 9.34 5.05 0.00 1.96 1.72 1.16 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.38 5.31 0.00 2.05 1.73 1.09 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.19 5.21 0.00 3.13 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 67 Y 8.39 5.87 0.00 3.04 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 68 T 8.41 4.98 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 1.13 0.00 0.00 69 E 8.93 3.77 0.00 1.81 1.71 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 2.05 1.80 0.00 70 F 9.11 4.96 0.00 2.88 2.70 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 71 T 8.10 4.60 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 1.12 0.00 0.00 72 P 0.00 4.67 0.00 2.22 2.37 0.00 3.34 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.69 0.00 73 T 8.33 5.05 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 1.25 0.00 0.00 74 E 8.69 4.07 0.00 1.98 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 0.00 2.31 2.31 0.00 75 K 7.82 4.11 0.00 1.79 1.81 0.00 1.85 0.00 0.00 1.72 0.00 0.00 2.97 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 8.22 4.61 0.00 2.92 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 0.00 0.00 0.00 0.00 77 E 9.26 4.81 0.00 1.97 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 2.32 2.29 0.00 78 Y 8.69 5.36 0.00 3.20 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 79 A 9.00 5.10 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 80 C 9.34 5.29 0.00 2.95 2.92 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 81 R 9.85 5.10 0.00 1.88 1.69 0.00 3.05 0.00 0.00 3.07 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.50 0.00 82 V 9.01 4.74 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 0.72 0.00 0.00 0.80 0.00 0.00 83 N 9.28 5.31 0.00 2.73 2.66 0.00 0.00 6.26 8.22 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 84 H 8.44 5.16 0.00 3.04 3.02 0.00 5.73 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.03 3.59 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 0.67 0.00 0.00 0.90 0.00 0.00 86 T 7.95 4.10 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 1.37 0.00 0.00 87 L 7.63 4.77 0.00 1.90 1.81 0.92 0.73 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 88 S 9.04 4.31 0.00 3.85 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 89 Q 7.54 4.63 0.00 2.08 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.56 6.96 0.00 0.00 0.00 0.00 0.00 2.21 2.34 0.00 90 P 0.00 4.51 0.00 1.93 1.99 0.00 3.64 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.06 0.00 91 K 9.34 4.51 0.00 1.77 1.64 0.00 1.58 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.40 7.81 92 I 8.36 4.96 1.88 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 1.22 0.77 0.92 0.00 0.00 93 V 8.59 4.42 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 1.16 0.00 0.00 0.96 0.00 0.00 94 K 8.76 4.69 0.00 1.74 1.80 0.00 1.83 0.00 0.00 1.67 0.00 0.00 2.85 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.50 1.48 7.81 95 W 9.39 4.48 0.00 3.26 3.48 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 0.00 0.00 0.00 96 D 8.54 4.43 0.00 2.63 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 97 R 7.56 3.43 0.00 1.31 1.77 0.00 3.14 0.00 0.00 3.18 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.41 0.00 98 D 8.73 4.78 0.00 2.73 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 M 8.17 4.40 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 2.46 0.00