NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 M 4.4441 8.3049 120.3262 54.6158 33.4290 175.1062 1 I 3.6048 8.2171 122.8264 61.5834 37.5964 174.2321 2 Q 4.8282 9.3415 124.3611 54.5554 33.1752 174.1155 3 R 4.8313 9.2305 123.4177 54.5281 33.7341 175.2386 4 T 4.6826 8.8052 119.5925 61.8211 69.4645 172.7478 5 P 4.8943 0.0000 0.0000 62.7761 32.4171 176.2858 6 K 4.4859 9.5739 123.2920 56.2307 33.8282 175.9527 7 I 5.1761 8.1830 122.1406 59.8819 41.0709 174.7866 8 Q 4.8336 9.2600 125.0908 54.1223 32.5790 174.3620 9 V 5.1065 8.6663 123.9418 60.2107 33.5635 174.3919 10 Y 5.2656 8.5086 122.2590 56.4958 41.7187 173.2149 11 S 4.9461 8.8930 114.3027 56.8286 65.0121 174.4356 12 R 4.1154 8.9818 122.5672 59.6440 29.9084 176.4554 13 H 5.0734 8.4701 113.9726 52.7849 31.2904 172.6976 14 P 4.2464 0.0000 0.0000 62.9998 31.5590 176.2338 15 A 4.2751 8.8856 125.9431 52.0667 18.6083 176.4839 16 E 4.6834 8.5736 120.8263 54.3768 31.8461 175.3783 17 N 4.6131 8.8504 121.0050 55.2019 38.9473 175.3423 18 G 3.9588 9.2965 112.0858 44.9575 0.0000 173.2608 19 K 4.4837 7.2263 118.8945 54.0281 33.7201 176.6472 20 S 4.1540 8.2615 117.4211 58.5502 63.6946 173.2983 21 N 4.9070 8.7177 119.0355 53.4176 42.6936 172.0490 22 F 5.1187 8.8760 115.4612 55.9356 43.2661 173.6279 23 L 3.9052 8.7233 126.6920 53.7667 43.1799 174.9845 24 N 5.3598 9.0109 124.5029 51.5854 42.0888 173.2914 25 C 5.2172 9.4098 121.7106 55.4081 43.1672 171.9457 26 Y 5.5284 9.5246 129.5363 56.3625 40.2093 174.5649 27 V 5.3348 8.9116 120.6112 59.2432 34.4527 175.2277 28 S 4.9025 8.5356 117.3994 57.7728 66.6350 174.3584 29 G 4.2246 8.5444 106.6793 47.1240 0.0000 173.4926 30 F 5.2539 7.1878 114.3259 55.7114 41.1314 173.9169 31 H 5.1052 8.7121 115.6915 54.9525 33.8149 172.4950 32 P 4.7142 0.0000 0.0000 62.5848 32.2265 175.7760 33 S 4.1446 8.5234 113.2007 60.6866 63.3411 174.4660 34 D 4.4229 7.8876 121.0345 53.3479 39.5763 175.0548 35 I 4.6122 7.8437 121.8088 59.8538 41.3669 173.0506 36 E 4.6634 8.9333 125.9019 54.4353 32.7202 175.2564 37 V 4.5393 8.0139 123.1526 61.1651 34.2318 174.0470 38 D 5.0256 9.1459 127.5490 52.4122 44.8395 174.6969 39 L 5.1406 8.3866 120.8753 53.0256 44.6522 175.2623 40 L 5.1698 9.1591 123.0699 52.7400 45.4478 175.3823 41 K 4.1437 8.9818 124.7837 54.4594 34.1244 175.8837 42 N 4.2821 9.9039 128.2090 54.2720 36.6961 175.1153 43 G 4.0478 8.3529 106.0884 45.2509 0.0000 173.6759 44 E 4.2345 7.9285 120.9057 54.5790 30.4583 175.4378 45 R 4.2976 8.4613 126.4833 56.4563 30.5478 175.9532 46 I 4.0504 8.3744 127.3207 61.2643 37.7907 176.0818 47 E 4.1982 8.7585 123.9587 57.9513 30.1597 177.2215 48 K 4.3012 7.6926 120.7974 54.3872 30.7006 173.7178 49 V 4.5942 7.6291 120.0956 60.4286 34.2942 174.1878 50 E 4.6404 8.2932 125.3328 54.6998 32.8485 174.0677 51 H 5.8309 7.9465 113.7063 53.0178 31.6108 173.1269 52 S 4.5674 8.6639 114.7345 58.0784 64.2661 173.1796 53 D 4.5210 8.5044 120.2763 53.4876 41.1945 176.3641 54 L 3.9955 8.5814 125.6136 56.3076 42.5363 175.8418 55 S 4.7206 8.2063 119.4125 57.0793 66.6564 171.7399 56 F 4.9833 7.3873 114.3087 55.7397 40.8685 174.5549 57 S 4.7065 9.0455 116.7228 57.3265 64.6776 175.3537 58 K 3.6402 8.6072 119.8961 60.0928 31.5918 178.1848 59 D 4.3914 7.7843 113.9720 53.5349 39.3299 176.9101 60 W 3.7315 7.9073 119.6139 56.6535 27.8031 174.5583 61 S 4.3099 7.7722 114.1510 58.0331 64.1920 174.0469 62 F 4.9062 8.4701 121.0641 57.4609 40.0848 174.1145 63 Y 5.4345 8.0355 117.7230 56.0599 41.7089 173.8922 64 L 5.0999 9.5655 120.9026 53.5442 47.2063 174.3247 65 L 5.3223 9.3956 125.5947 53.8997 44.2257 174.4995 66 Y 5.1590 9.4337 125.0515 56.8297 40.4818 174.4513 67 Y 5.3928 8.5637 120.2578 56.7356 42.1484 173.3188 68 T 4.9599 8.6669 113.4992 60.9546 71.3803 172.4715 69 E 4.0011 8.5781 127.0400 56.2242 30.3377 175.9871 70 F 4.7750 8.8027 117.1910 56.2331 41.5426 173.3505 71 T 4.4924 8.0740 116.7265 60.7212 70.8887 171.7813 72 P 4.5767 0.0000 0.0000 63.0351 32.6012 175.4138 73 T 4.9365 8.4488 110.6460 59.7843 71.7487 173.4261 74 E 4.0919 9.0161 123.0051 59.3022 30.0179 178.2052 75 K 4.1251 8.1212 118.5998 59.2578 32.5506 177.0573 76 D 4.6255 8.2211 118.4431 54.4476 41.4181 175.2774 77 E 4.9565 9.1898 123.4222 55.0144 32.0791 174.7266 78 Y 5.3456 8.7971 119.5684 56.7076 42.7119 173.9637 79 A 5.1232 8.7536 121.7197 51.5241 23.8333 174.2235 80 C 5.2984 9.4222 119.3572 54.8998 44.7341 172.4932 81 R 5.0602 9.1345 127.2512 54.6160 32.0461 174.7618 82 V 4.8590 8.9554 126.1011 61.0477 34.9119 173.6031 83 N 5.2973 8.9540 125.5480 52.4212 42.5815 172.2740 84 H 4.8847 8.4000 122.1777 55.3327 33.0219 174.5987 85 V 3.5926 8.2187 115.3767 64.6905 31.3724 177.8140 86 T 4.1640 7.9282 107.6341 62.4295 69.1088 173.4327 87 L 4.7986 7.5444 123.1496 53.0151 43.8311 176.6284 88 S 4.2443 8.9300 120.1335 61.1836 63.0002 174.1320 89 Q 4.7044 7.5192 115.2953 52.7503 32.3846 173.0715 90 P 4.5407 0.0000 0.0000 62.8877 32.3150 176.1002 91 K 4.3710 9.1556 125.7543 55.3832 33.5468 175.0706 92 I 4.9581 8.3784 128.5019 59.5601 39.3176 175.0910 93 V 4.4533 8.7219 127.4225 60.9740 33.8862 174.7751 94 K 4.8694 8.7129 127.0709 55.4528 33.4849 176.1347 95 W 4.6429 9.0098 134.4419 57.0592 31.6239 174.9443 96 D 4.5647 8.4293 126.2796 51.9715 42.5402 176.5987 97 R 3.4951 7.9018 125.8866 58.9180 30.1430 176.8307 98 D 4.8816 7.9619 116.3769 54.1128 41.0010 176.4136 99 M 4.3861 8.0034 125.3175 55.7971 33.1898 174.9097 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 0 M 8.30 4.44 0.00 2.03 2.07 0.00 0.00 0.00 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.56 0.00 1 I 8.22 3.60 1.80 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 1.40 0.55 0.87 0.00 0.00 2 Q 9.34 4.83 0.00 1.91 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.73 6.70 0.00 0.00 0.00 0.00 0.00 2.30 2.60 0.00 3 R 9.23 4.83 0.00 1.94 2.03 0.00 3.15 0.00 0.00 3.27 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 4 T 8.81 4.68 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 4.89 0.00 1.92 1.73 0.00 3.76 0.00 0.00 3.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.74 0.00 6 K 9.57 4.49 0.00 1.75 1.81 0.00 1.66 0.00 0.00 1.69 0.00 0.00 2.85 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.50 1.63 7.81 7 I 8.18 5.18 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 1.32 0.60 0.96 0.00 0.00 8 Q 9.26 4.83 0.00 2.34 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.43 0.00 9 V 8.67 5.11 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 0.96 0.00 0.00 1.05 0.00 0.00 10 Y 8.51 5.27 0.00 3.20 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 11 S 8.89 4.95 0.00 4.09 3.92 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 12 R 8.98 4.12 0.00 1.86 2.26 0.00 3.18 0.00 0.00 3.04 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 1.48 0.00 13 H 8.47 5.07 0.00 3.25 3.22 0.00 5.73 0.00 0.00 0.00 0.00 6.94 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 4.25 0.00 2.11 2.09 0.00 3.78 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.18 0.00 15 A 8.89 4.28 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 0.00 0.00 0.00 0.00 0.00 16 E 8.57 4.68 0.00 2.12 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 0.00 2.25 2.28 0.00 17 N 8.85 4.61 0.00 2.75 2.85 0.00 0.00 7.30 7.65 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 18 G 9.30 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 19 K 7.23 4.48 0.00 1.81 1.69 0.00 1.84 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.36 1.32 7.81 20 S 8.26 4.15 0.00 3.86 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 21 N 8.72 4.91 0.00 2.51 2.62 0.00 0.00 7.10 8.27 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 22 F 8.88 5.12 0.00 2.98 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 23 L 8.72 3.91 0.00 0.27 0.72 -0.36 -0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 24 N 9.01 5.36 0.00 1.44 2.14 0.00 0.00 5.96 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 9.41 5.22 0.00 2.89 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 26 Y 9.52 5.53 0.00 3.37 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 27 V 8.91 5.33 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 0.73 0.00 0.00 1.10 0.00 0.00 28 S 8.54 4.90 0.00 3.84 3.47 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 29 G 8.54 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 0.00 0.00 0.00 0.00 30 F 7.19 5.25 0.00 3.03 3.20 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 0.00 31 H 8.71 5.11 0.00 3.32 3.24 0.00 5.78 0.00 0.00 0.00 0.00 6.65 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 4.71 0.00 2.15 2.19 0.00 3.88 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 2.09 1.99 0.00 33 S 8.52 4.14 0.00 3.34 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 7.89 4.42 0.00 2.76 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 35 I 7.84 4.61 1.42 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.54 0.75 0.00 0.00 36 E 8.93 4.66 0.00 1.82 1.70 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 2.15 2.15 0.00 37 V 8.01 4.54 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 0.30 0.00 0.00 0.35 0.00 0.00 38 D 9.15 5.03 0.00 2.49 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 8.39 5.14 0.00 1.55 1.51 0.85 0.53 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 40 L 9.16 5.17 0.00 1.51 1.50 0.92 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 41 K 8.98 4.14 0.00 1.80 1.60 0.00 1.93 0.00 0.00 1.65 0.00 0.00 2.83 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.07 0.60 7.81 42 N 9.90 4.28 0.00 2.72 2.78 0.00 0.00 7.23 7.53 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 43 G 8.35 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 44 E 7.93 4.23 0.00 2.01 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 2.26 2.23 0.00 45 R 8.46 4.30 0.00 1.80 1.83 0.00 3.54 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 46 I 8.37 4.05 1.88 0.00 0.00 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 1.36 0.77 0.92 0.00 0.00 47 E 8.76 4.20 0.00 1.95 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 2.28 2.23 0.00 48 K 7.69 4.30 0.00 1.67 1.72 0.00 1.56 0.00 0.00 1.61 0.00 0.00 3.13 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.34 1.45 7.81 49 V 7.63 4.59 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 1.01 0.00 0.00 0.98 0.00 0.00 50 E 8.29 4.64 0.00 1.44 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 1.80 1.61 0.00 51 H 7.95 5.83 0.00 2.20 1.43 0.00 5.33 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 52 S 8.66 4.57 0.00 4.01 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 53 D 8.50 4.52 0.00 2.71 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 54 L 8.58 4.00 0.00 1.64 1.63 0.84 0.60 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 55 S 8.21 4.72 0.00 3.54 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 56 F 7.39 4.98 0.00 2.91 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 57 S 9.05 4.71 0.00 4.15 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 58 K 8.61 3.64 0.00 1.62 1.71 0.00 1.58 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.36 1.38 7.81 59 D 7.78 4.39 0.00 2.80 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 60 W 7.91 3.73 0.00 3.28 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 61 S 7.77 4.31 0.00 3.78 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 8.47 4.91 0.00 1.58 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 8.04 5.43 0.00 2.97 2.98 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 64 L 9.57 5.10 0.00 1.97 1.83 1.20 0.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 65 L 9.40 5.32 0.00 2.04 1.74 1.13 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 66 Y 9.43 5.16 0.00 3.15 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 8.56 5.39 0.00 3.06 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 68 T 8.67 4.96 4.19 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 1.03 0.00 0.00 69 E 8.58 4.00 0.00 1.67 1.52 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 1.47 1.47 0.00 70 F 8.80 4.77 0.00 2.82 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 71 T 8.07 4.49 4.14 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 1.13 0.00 0.00 72 P 0.00 4.58 0.00 2.27 2.08 0.00 3.29 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.71 0.00 73 T 8.45 4.94 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 1.27 0.00 0.00 74 E 9.02 4.09 0.00 1.98 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 0.00 2.31 2.32 0.00 75 K 8.12 4.13 0.00 1.78 1.85 0.00 1.85 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.43 1.47 7.81 76 D 8.22 4.63 0.00 2.94 2.42 0.00 0.00 0.00 0.00 0.00 0.00 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 9.19 4.96 0.00 1.88 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 2.27 2.28 0.00 78 Y 8.80 5.35 0.00 3.17 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 79 A 8.75 5.12 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 80 C 9.42 5.30 0.00 2.95 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 81 R 9.13 5.06 0.00 1.83 1.70 0.00 3.05 0.00 0.00 3.07 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.51 0.00 82 V 8.96 4.86 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 0.66 0.00 0.00 0.80 0.00 0.00 83 N 8.95 5.30 0.00 2.70 2.53 0.00 0.00 6.40 7.46 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 84 H 8.40 4.88 0.00 3.04 3.03 0.00 5.74 0.00 0.00 0.00 0.00 6.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 V 8.22 3.59 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 0.73 0.00 0.00 0.74 0.00 0.00 86 T 7.93 4.16 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 1.36 0.00 0.00 87 L 7.54 4.80 0.00 1.63 1.77 0.92 0.76 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 88 S 8.93 4.24 0.00 3.86 3.92 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 89 Q 7.52 4.70 0.00 1.96 1.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.93 0.00 0.00 0.00 0.00 0.00 2.24 2.39 0.00 90 P 0.00 4.54 0.00 1.91 1.95 0.00 3.65 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 2.44 0.00 91 K 9.16 4.37 0.00 1.82 1.65 0.00 1.48 0.00 0.00 1.65 0.00 0.00 2.93 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.45 7.81 92 I 8.38 4.96 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 1.22 0.75 0.93 0.00 0.00 93 V 8.72 4.45 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 1.09 0.00 0.00 0.97 0.00 0.00 94 K 8.71 4.87 0.00 1.74 1.80 0.00 1.82 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.47 1.48 7.81 95 W 9.01 4.64 0.00 3.30 3.45 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 96 D 8.43 4.56 0.00 2.61 2.41 0.00 0.00 0.00 0.00 0.00 0.00 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 7.90 3.50 0.00 1.59 1.86 0.00 3.08 0.00 0.00 3.16 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.69 0.00 98 D 7.96 4.88 0.00 2.61 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 99 M 8.00 4.39 0.00 2.01 1.92 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.48 0.00