NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 Q 4.2406 8.3293 121.7023 55.7441 30.4490 175.3911 4 S 4.2883 8.2364 120.0144 57.8781 65.4271 174.7288 5 F 4.1661 10.0049 123.2166 60.6019 39.3165 179.3999 6 T 3.9461 8.6711 116.3234 66.7886 68.2674 176.4502 7 S 4.1340 7.8752 114.7694 61.1567 62.3994 176.1795 8 I 3.6371 7.7181 122.3509 64.4974 36.8357 178.3675 9 A 4.0989 8.5709 121.8878 54.9015 17.9687 179.6252 10 R 3.8419 7.8621 117.2465 59.8406 30.0424 178.9005 11 I 4.1035 7.9996 119.6805 63.9731 37.0499 178.7436 12 G 3.5974 8.7726 106.9827 47.9952 0.0000 175.4187 13 D 4.3871 8.3978 122.4708 57.2235 41.0042 178.3623 14 Y 4.0928 7.7500 118.4502 60.8681 38.5081 178.4102 15 I 3.5206 7.1941 119.9064 63.9955 37.2786 178.0960 16 L 4.0919 7.7766 119.0550 57.8673 41.6245 179.6448 17 K 4.1517 8.6441 117.3200 57.4617 32.1889 177.0340 18 S 4.5156 7.0665 114.2369 56.0012 62.8310 172.9239 19 P 4.1935 0.0000 0.0000 65.9163 30.6511 178.7493 20 V 3.5547 7.5849 117.4468 65.9635 31.7276 177.9104 21 L 3.8275 7.6913 118.2078 57.5529 41.6140 179.0589 22 S 4.0100 8.1871 113.3584 61.6869 62.1162 176.6342 23 K 3.9836 7.5396 118.9158 58.8284 31.8426 178.2810 24 L 4.3166 7.2179 118.2510 55.8403 42.4240 176.7699 25 C 4.5566 7.6975 114.2668 61.7827 29.7927 175.7485 26 V 3.5519 7.4388 119.2704 65.9269 30.9507 176.2355 27 P 4.3864 0.0000 0.0000 65.6741 31.1941 178.7309 28 V 3.6160 7.8054 116.3296 65.7162 31.4645 177.7292 29 A 4.0070 8.2084 120.8284 55.4819 18.3989 179.4284 30 N 4.3495 8.6069 115.3072 56.2792 38.5102 177.6265 31 Q 3.8952 8.1250 121.0825 59.2682 29.2135 177.7987 32 F 4.1423 8.6473 122.1022 61.5315 38.8688 177.2025 33 I 3.6266 8.0349 119.3551 64.3957 36.6993 178.2022 34 N 4.2841 7.8226 116.1955 56.0609 38.3898 177.2238 35 L 4.0301 7.6415 119.4974 57.0147 41.7074 179.0152 36 A 3.9349 6.9681 120.2389 54.7062 18.7118 178.9695 37 G 3.6650 7.4989 103.5502 45.4096 0.0000 174.7025 38 Y 4.1090 7.6612 118.6907 60.0653 37.6275 178.6164 39 K 3.9372 7.0608 119.8718 59.1617 32.3232 178.7308 40 K 2.4800 7.5474 117.4371 57.0374 31.4539 177.8159 41 L 4.4516 7.2385 119.8251 53.5686 42.8542 175.6668 42 G 3.9647 8.0531 103.9530 46.8322 0.0000 174.2949 43 L 4.9638 7.6846 116.1969 52.5452 45.9597 176.9578 44 K 4.6413 9.1085 122.1646 55.2102 33.5138 177.6967 45 F 3.2666 9.1396 125.0603 61.3759 39.5838 177.2715 46 D 4.2194 8.3425 119.5824 57.3004 40.7951 178.3724 47 D 4.4060 8.1389 118.7249 57.2323 40.8606 177.9285 48 L 3.8931 7.2551 117.9806 56.7610 41.7309 177.8161 49 I 3.5764 6.7989 119.8283 60.9540 37.4182 175.6828 50 A 4.0776 8.5559 128.6100 52.3106 18.5999 176.9280 51 E 4.4536 8.6311 119.9126 56.2740 30.8694 176.8070 52 E 4.3632 7.8467 121.2941 54.1203 28.4876 175.8479 53 N 4.6893 7.4180 116.4376 49.9640 41.5253 173.4833 54 P 4.2249 0.0000 0.0000 66.4699 31.1600 178.4937 55 I 3.6672 7.8142 119.2279 64.4906 36.9861 178.2229 56 M 4.1089 7.9897 118.6599 58.2680 31.8400 178.7702 57 Q 3.9582 7.9136 118.0612 59.1593 29.0090 178.7139 58 T 3.8453 8.4880 116.9151 66.5112 68.5861 176.6033 59 A 3.9645 8.0056 122.5597 55.2778 18.2724 179.7887 60 L 3.8877 7.8987 116.4057 57.7154 41.6531 179.4842 61 R 3.9647 7.7812 118.2424 59.2042 30.1583 178.1829 62 R 4.2112 7.4186 115.1863 56.1265 30.3349 176.3364 63 L 3.3536 6.8083 121.7860 53.2036 42.4534 175.1287 64 P 4.2090 0.0000 0.0000 63.9201 32.5315 176.5629 65 E 3.4841 8.5355 120.4274 59.5571 29.7230 179.2325 66 D 4.5810 8.3156 118.2102 58.0568 40.9622 179.2477 67 E 3.8757 8.1160 118.0151 59.1850 29.4028 179.3540 68 S 3.9355 7.7573 112.9022 61.6767 62.5605 175.6941 69 Y 4.2406 8.0053 119.5980 61.0124 37.5705 178.7647 70 A 4.0506 8.0176 121.1889 55.2509 18.5267 179.3774 71 R 3.7890 8.1023 117.1505 59.6824 30.0614 178.2782 72 A 4.0016 8.4113 120.7055 55.3901 18.3913 178.9984 73 Y 4.0835 8.1238 117.7298 61.0207 38.9673 178.0081 74 R 3.7272 8.5945 119.3255 59.5544 30.2425 179.0957 75 I 3.6427 7.9045 119.1172 64.4265 37.1830 178.4561 76 I 3.7107 7.7369 120.6156 64.3952 36.9032 178.3265 77 R 3.6730 8.1667 119.4496 59.2731 29.7912 178.2883 78 A 3.8981 7.8992 120.3410 55.5115 18.4102 179.2278 79 H 4.0175 8.0698 114.5667 59.1405 28.5944 177.6830 80 Q 3.9948 7.8519 119.8053 59.5595 29.0937 178.4874 81 T 4.0032 8.0491 116.6273 66.5947 68.6994 176.2714 82 E 3.9044 8.6960 121.8111 59.2890 29.4310 178.7822 83 L 4.0439 8.3069 118.5591 58.0004 40.6682 178.2963 84 T 4.1752 7.5966 109.1592 61.2989 69.7428 173.8960 85 H 4.0706 7.8458 117.3915 57.5543 26.3413 173.2930 86 H 4.9979 8.0885 113.7962 54.2770 32.9669 172.1690 87 L 4.9330 8.1908 119.2501 52.8116 44.9258 176.5221 88 L 4.5489 8.3716 120.2200 53.7152 42.9752 175.5863 89 P 4.3476 0.0000 0.0000 62.6057 31.7357 178.1280 90 R 2.0000 8.3641 123.2166 58.6531 29.9719 177.5675 91 N 4.5739 7.7318 111.8201 53.5086 37.6045 175.0102 92 E 4.5973 8.2912 118.0135 56.2608 31.1339 176.5523 93 W 4.5803 7.7423 119.2664 56.6647 29.5950 176.0305 94 I 4.0189 8.3733 123.6099 61.4391 37.1368 176.4032 95 K 4.3414 9.4850 125.3537 55.5158 33.3399 177.7868 96 A 4.0156 8.8872 124.1708 55.9713 18.1096 179.5573 97 Q 4.5007 8.1031 110.3913 56.4851 28.8350 176.3237 98 E 4.4426 8.2627 119.4077 57.7696 31.3932 176.9595 99 D 4.8317 7.5546 117.5300 53.9829 39.2114 175.8713 100 V 4.2462 7.4013 119.9083 61.2717 33.1407 174.8214 101 P 4.7744 0.0000 0.0000 62.1322 29.6080 176.1812 102 Y 4.0224 7.9731 123.4760 60.6311 38.8297 178.7866 103 L 4.1744 6.9498 121.9310 56.8527 41.9454 178.2002 104 L 3.6351 7.2908 120.8456 57.7930 41.7973 177.3482 105 P 4.1099 0.0000 0.0000 66.0995 31.2428 177.9429 106 Y 4.0434 7.5631 116.0354 60.7202 37.7740 178.4570 107 I 3.6328 7.5528 120.5349 64.4109 37.2810 178.1870 108 L 4.0577 7.9666 119.7616 58.1151 41.4315 179.5376 109 E 3.9314 8.4547 118.9352 59.1235 29.6325 178.6750 110 A 4.0186 8.1324 120.9760 55.1239 18.4224 179.5442 111 E 3.9239 8.8737 117.3111 59.3072 29.5621 179.1871 112 A 3.9491 8.0661 120.6155 55.2672 18.4782 179.4781 113 A 3.9283 8.1624 118.8945 55.2027 18.4464 179.7070 114 A 3.8755 8.0295 119.1543 55.1831 18.5148 179.4961 115 K 3.7720 8.4481 118.5703 59.7394 32.2114 178.3399 116 E 3.8641 8.1666 119.2243 59.2545 29.6926 178.4712 117 K 3.8523 7.9394 119.5725 59.7308 31.9548 178.0253 118 D 4.3349 7.8991 116.9421 57.3262 41.4340 177.8819 119 E 4.1117 8.0917 118.9904 59.5209 29.3914 179.3097 120 L 4.1604 8.2628 117.0318 56.8797 41.7330 178.2750 121 D 4.7357 7.6922 117.1874 54.9398 41.1457 176.4392 122 N 4.9826 7.8184 114.9366 52.2140 40.6000 174.2243 123 I 3.7155 7.8250 112.8483 61.1315 37.7044 175.6912 124 E 4.2745 8.6220 125.0673 55.8228 30.3110 176.3241 125 V 4.3822 8.0688 114.6297 59.5999 33.8676 175.5158 126 S 4.5374 8.3862 117.1222 56.4939 64.5640 173.8835 127 K 4.1854 8.7069 126.0692 56.6425 31.9875 176.5703 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 3 Q 8.33 4.24 0.00 1.97 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.97 0.00 0.00 0.00 0.00 0.00 2.12 2.30 0.00 4 S 8.24 4.29 0.00 4.49 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 5 F 10.00 4.17 0.00 3.28 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 6 T 8.67 3.95 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 1.23 0.00 0.00 7 S 7.88 4.13 0.00 3.84 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 8 I 7.72 3.64 1.95 0.00 0.00 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.60 0.88 0.00 0.00 9 A 8.57 4.10 1.35 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 0.00 0.00 10 R 7.86 3.84 0.00 2.12 2.12 0.00 3.08 0.00 0.00 3.14 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 11 I 8.00 4.10 1.99 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 0.67 0.95 0.00 0.00 12 G 8.77 3.60 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 0.00 0.00 0.00 13 D 8.40 4.39 0.00 2.83 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 14 Y 7.75 4.09 0.00 3.14 3.17 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 0.00 15 I 7.19 3.52 1.95 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 1.41 0.84 0.82 0.00 0.00 16 L 7.78 4.09 0.00 1.86 1.71 0.90 1.17 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 17 K 8.64 4.15 0.00 1.70 1.89 0.00 1.75 0.00 0.00 1.67 0.00 0.00 2.99 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.61 7.81 18 S 7.07 4.52 0.00 3.69 3.44 0.00 0.00 0.00 0.00 0.00 0.00 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 P 0.00 4.19 0.00 2.28 2.28 0.00 3.71 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 2.04 2.01 0.00 20 V 7.58 3.55 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 1.03 0.00 0.00 0.91 0.00 0.00 21 L 7.69 3.83 0.00 1.51 1.56 0.86 0.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 22 S 8.19 4.01 0.00 4.08 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 23 K 7.54 3.98 0.00 1.76 1.85 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.98 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.46 1.66 7.81 24 L 7.22 4.32 0.00 1.68 1.79 0.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 25 C 7.70 4.56 0.00 3.01 2.86 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 26 V 7.44 3.55 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 1.06 0.00 0.00 0.97 0.00 0.00 27 P 0.00 4.39 0.00 2.20 2.09 0.00 3.58 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.26 2.14 0.00 28 V 7.81 3.62 2.23 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 1.10 0.00 0.00 0.98 0.00 0.00 29 A 8.21 4.01 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 30 N 8.61 4.35 0.00 2.76 2.90 0.00 0.00 6.76 7.00 0.00 0.00 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 Q 8.13 3.90 0.00 2.34 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.12 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.44 0.00 32 F 8.65 4.14 0.00 3.06 3.29 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 33 I 8.03 3.63 2.04 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 1.72 1.48 0.89 0.00 0.00 34 N 7.82 4.28 0.00 2.80 2.81 0.00 0.00 7.11 7.80 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 35 L 7.64 4.03 0.00 1.62 1.61 0.93 0.83 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 36 A 6.97 3.93 1.20 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 0.00 0.00 37 G 7.50 3.66 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 0.00 0.00 0.00 38 Y 7.66 4.11 0.00 3.18 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 39 K 7.06 3.94 0.00 1.43 1.87 0.00 1.91 0.00 0.00 1.83 0.00 0.00 2.80 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.27 0.85 7.81 40 K 7.55 2.48 0.00 1.25 0.74 0.00 1.14 0.00 0.00 0.61 0.00 0.00 2.85 0.00 0.00 2.72 0.00 0.00 0.00 0.00 0.30 0.71 7.81 41 L 7.24 4.45 0.00 1.62 1.58 0.86 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 42 G 8.05 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 43 L 7.68 4.96 0.00 1.71 1.54 0.88 0.97 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 44 K 9.11 4.64 0.00 2.06 1.95 0.00 1.78 0.00 0.00 1.86 0.00 0.00 2.99 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.57 1.48 7.81 45 F 9.14 3.27 0.00 2.83 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 46 D 8.34 4.22 0.00 2.52 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 0.00 0.00 0.00 0.00 47 D 8.14 4.41 0.00 2.65 2.71 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 48 L 7.26 3.89 0.00 1.00 1.24 0.70 0.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 49 I 6.80 3.58 1.79 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.31 1.13 0.00 0.00 50 A 8.56 4.08 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 51 E 8.63 4.45 0.00 2.06 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 0.00 2.18 2.29 0.00 52 E 7.85 4.36 0.00 1.96 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 2.30 2.35 0.00 53 N 7.42 4.69 0.00 2.87 2.87 0.00 0.00 5.83 7.76 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 54 P 0.00 4.22 0.00 2.28 2.37 0.00 3.72 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 55 I 7.81 3.67 1.90 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 1.66 0.97 0.93 0.00 0.00 56 M 7.99 4.11 0.00 2.01 2.34 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.93 2.59 0.00 57 Q 7.91 3.96 0.00 2.27 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.80 0.00 0.00 0.00 0.00 0.00 2.68 2.53 0.00 58 T 8.49 3.85 4.45 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 1.22 0.00 0.00 59 A 8.01 3.96 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 60 L 7.90 3.89 0.00 1.61 1.69 0.92 1.10 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 61 R 7.78 3.96 0.00 1.84 2.14 0.00 3.23 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.62 0.00 62 R 7.42 4.21 0.00 2.00 1.82 0.00 3.27 0.00 0.00 3.28 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.67 0.00 63 L 6.81 3.35 0.00 1.40 1.57 1.00 0.93 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 64 P 0.00 4.21 0.00 2.31 2.22 0.00 3.48 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.21 0.00 65 E 8.54 3.48 0.00 2.12 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 0.00 2.35 2.44 0.00 66 D 8.32 4.58 0.00 2.70 2.79 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 67 E 8.12 3.88 0.00 2.07 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 2.38 2.35 0.00 68 S 7.76 3.94 0.00 3.71 3.49 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 69 Y 8.01 4.24 0.00 3.08 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 70 A 8.02 4.05 1.39 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 0.00 0.00 0.00 71 R 8.10 3.79 0.00 1.94 2.11 0.00 3.25 0.00 0.00 3.28 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.96 0.00 72 A 8.41 4.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 Y 8.12 4.08 0.00 3.09 3.22 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 74 R 8.59 3.73 0.00 2.01 1.98 0.00 3.37 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.78 0.00 75 I 7.90 3.64 2.00 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 1.49 0.96 0.94 0.00 0.00 76 I 7.74 3.71 2.04 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.91 0.92 0.00 0.00 77 R 8.17 3.67 0.00 1.15 1.75 0.00 2.93 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 1.47 1.27 0.00 78 A 7.90 3.90 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 79 H 8.07 4.02 0.00 3.39 3.34 0.00 5.83 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 80 Q 7.85 3.99 0.00 2.02 2.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.96 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 81 T 8.05 4.00 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 1.28 0.00 0.00 82 E 8.70 3.90 0.00 2.05 2.15 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 2.29 2.35 0.00 83 L 8.31 4.04 0.00 1.73 1.76 0.90 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 84 T 7.60 4.18 4.16 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 1.22 0.00 0.00 85 H 7.85 4.07 0.00 3.45 3.47 0.00 5.60 0.00 0.00 0.00 0.00 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 86 H 8.09 5.00 0.00 3.04 3.24 0.00 5.84 0.00 0.00 0.00 0.00 6.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 87 L 8.19 4.93 0.00 1.66 1.79 0.90 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 88 L 8.37 4.55 0.00 1.91 1.81 1.02 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 89 P 0.00 4.35 0.00 2.05 1.94 0.00 3.72 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 2.14 2.16 0.00 90 R 8.36 2.00 0.00 1.26 1.03 0.00 2.58 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.00 0.00 91 N 7.73 4.57 0.00 2.75 2.82 0.00 0.00 5.90 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 92 E 8.29 4.60 0.00 2.18 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 0.00 2.30 2.28 0.00 93 W 7.74 4.58 0.00 3.40 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 94 I 8.37 4.02 1.97 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 1.51 0.85 1.04 0.00 0.00 95 K 9.49 4.34 0.00 1.94 1.78 0.00 1.73 0.00 0.00 1.68 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.55 7.81 96 A 8.89 4.02 1.35 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 0.00 0.00 97 Q 8.10 4.50 0.00 2.08 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.58 6.83 0.00 0.00 0.00 0.00 0.00 2.38 2.47 0.00 98 E 8.26 4.44 0.00 2.15 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 2.31 2.28 0.00 99 D 7.55 4.83 0.00 2.84 2.86 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 0.00 100 V 7.40 4.25 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 0.99 0.00 0.00 1.06 0.00 0.00 101 P 0.00 4.77 0.00 2.27 2.26 0.00 3.82 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 2.10 1.99 0.00 102 Y 7.97 4.02 0.00 3.22 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 0.00 103 L 6.95 4.17 0.00 0.85 1.36 0.90 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 104 L 7.29 3.64 0.00 1.57 1.76 0.87 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 105 P 0.00 4.11 0.00 1.92 2.11 0.00 3.69 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.84 0.00 106 Y 7.56 4.04 0.00 3.18 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 107 I 7.55 3.63 1.71 0.00 0.00 0.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.60 0.64 0.00 0.00 108 L 7.97 4.06 0.00 1.84 1.73 0.92 0.75 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 0.00 109 E 8.45 3.93 0.00 2.04 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 0.00 2.31 2.31 0.00 110 A 8.13 4.02 1.42 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 0.00 0.00 111 E 8.87 3.92 0.00 2.13 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 2.38 2.58 0.00 112 A 8.07 3.95 1.41 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 0.00 0.00 113 A 8.16 3.93 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 0.00 114 A 8.03 3.88 1.39 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 0.00 0.00 0.00 115 K 8.45 3.77 0.00 1.84 2.11 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.45 1.61 7.81 116 E 8.17 3.86 0.00 2.09 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 2.32 0.00 117 K 7.94 3.85 0.00 1.89 1.95 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.58 1.46 7.81 118 D 7.90 4.33 0.00 2.82 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 0.00 119 E 8.09 4.11 0.00 2.27 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 2.33 2.53 0.00 120 L 8.26 4.16 0.00 1.56 1.73 0.92 1.09 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 0.00 121 D 7.69 4.74 0.00 2.92 2.71 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 0.00 122 N 7.82 4.98 0.00 2.66 2.75 0.00 0.00 6.96 6.76 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 0.00 123 I 7.82 3.72 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 1.58 0.52 1.01 0.00 0.00 124 E 8.62 4.27 0.00 1.98 1.91 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 2.31 2.32 0.00 125 V 8.07 4.38 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 0.93 0.00 0.00 126 S 8.39 4.54 0.00 3.76 3.70 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 0.00 127 K 8.71 4.19 0.00 1.78 1.69 0.00 1.83 0.00 0.00 1.74 0.00 0.00 2.90 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.39 1.42 7.81