NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 G 3.8976 8.3544 109.7353 45.4953 0.0000 176.4351 2 S 4.3890 9.1121 115.4415 56.1010 62.0068 170.3666 3 S 4.5885 8.0201 121.9452 55.7537 62.5731 174.0228 4 G 4.2217 7.5539 109.7415 43.6130 0.0000 169.6691 5 S 4.3308 7.4436 114.7306 57.7911 65.7859 175.7266 6 S 4.4456 8.7239 115.5634 56.8667 64.3153 173.1197 7 G 4.0640 8.5729 110.5590 44.9885 0.0000 171.5883 8 P 4.6114 0.0000 0.0000 62.3045 32.4660 175.4772 9 G 4.2859 8.1914 107.8186 43.1773 0.0000 171.5789 10 P 4.3720 0.0000 0.0000 62.2219 31.5611 176.8923 11 V 3.7130 8.4270 116.7615 61.6661 32.4192 174.1874 12 E 4.6804 8.4754 119.4000 55.1339 32.5747 175.8668 13 N 4.3950 8.3184 113.7686 54.1513 36.0975 173.9388 14 L 4.7771 7.7305 120.4488 54.2577 43.6364 175.9468 15 Q 4.7681 8.7247 123.5171 54.7021 33.9113 173.2947 16 A 5.7905 8.7783 124.0791 49.0913 21.9517 175.6606 17 V 4.4923 8.1853 120.8587 60.2579 35.1698 173.6411 18 S 4.9056 8.6889 118.1922 57.6309 63.2130 173.7421 19 T 4.4711 8.5946 115.0253 61.6188 69.3979 173.3437 20 S 4.6483 7.6840 116.9718 56.6957 67.4359 171.9613 21 P 4.4140 0.0000 0.0000 65.8661 30.8020 177.3043 22 T 4.6774 7.3626 109.5713 59.8737 69.6691 172.5538 23 S 5.1493 8.2079 121.4442 59.6118 66.9443 175.4398 24 I 4.0349 7.7676 118.8606 60.7600 40.3954 174.1701 25 L 4.5546 9.1763 132.3533 54.2056 42.8009 175.3554 26 I 4.7275 8.5920 129.0601 60.1678 39.0098 175.2975 27 T 4.4864 9.3355 119.4159 59.7751 70.5399 173.1322 28 W 5.4387 7.3063 123.3449 53.8732 31.5686 174.1147 29 E 4.7213 8.7715 117.3548 53.9443 34.0721 173.2662 30 P 4.9749 0.0000 0.0000 62.1128 31.8318 174.7898 31 P 4.2202 0.0000 0.0000 62.6182 32.2425 176.0785 32 A 4.1646 7.9905 123.1599 54.7621 19.8543 178.4494 33 Y 4.5127 6.6278 113.1913 56.2364 37.3287 174.8570 34 A 4.7637 7.3001 121.7228 50.7131 22.0710 176.4747 35 N 4.4386 8.7468 120.1732 53.8473 38.2921 175.7919 36 G 3.7958 8.5704 116.6693 43.7206 0.0000 169.0570 37 P 4.3905 0.0000 0.0000 62.2550 32.3288 175.9414 38 V 3.9507 7.6174 116.7434 60.7165 32.0117 174.7760 39 Q 3.9974 8.2305 126.0432 58.1236 29.2872 178.2059 40 G 3.6446 5.9018 103.9257 45.8323 0.0000 170.8836 41 Y 4.3547 7.4990 117.2421 56.1532 42.7963 174.1555 42 R 4.6595 7.9274 122.3373 54.2890 32.9211 174.2556 43 L 4.7175 8.1443 127.3975 53.0447 45.6522 174.9925 44 F 5.2628 8.5384 122.9629 55.9790 42.2813 173.5607 45 C 4.8751 8.9514 125.6578 58.2913 33.0603 172.3975 46 T 5.1105 8.6420 122.7178 61.9624 71.6493 173.3262 47 E 4.6126 8.9120 127.4675 54.2075 29.0258 176.1414 48 V 3.4736 7.8853 122.7485 65.9341 31.9035 177.5414 49 S 4.2209 8.0574 114.3620 61.9108 62.9174 175.6451 50 T 4.1013 7.5829 107.4647 65.1327 69.1604 176.4330 51 G 4.2338 8.3896 111.1647 44.6239 0.0000 172.9388 52 K 4.5653 8.2785 119.1419 54.4668 34.2148 174.8867 53 E 5.3199 8.8505 125.8514 54.3350 31.8869 174.6143 54 Q 4.7101 9.1842 125.4828 54.3594 30.9683 174.5597 55 N 5.1627 8.9009 122.0899 53.0593 39.5975 174.6752 56 I 4.5604 8.8290 123.2215 59.4838 41.8488 174.5348 57 E 4.6770 8.7179 124.2833 54.9946 30.9854 175.7441 58 V 4.5218 7.7201 118.2086 59.4981 34.3244 175.0856 59 D 5.1278 8.7595 119.9425 52.6771 42.8989 176.5215 60 G 3.9831 9.6430 105.3635 44.7204 0.0000 173.7456 61 L 2.7908 7.4073 117.7145 53.3006 43.5761 176.4781 62 S 5.0083 6.7834 107.8791 58.3731 65.3953 174.9752 63 Y 4.6288 8.3984 125.7458 55.6819 42.1704 173.3533 64 K 4.5009 8.1082 128.5496 54.8148 33.0245 175.6318 65 L 4.4482 8.7410 130.7923 55.3399 43.3235 175.4411 66 E 4.9597 8.5197 122.3884 55.3974 34.0701 174.7836 67 G 3.7629 8.9314 107.3831 46.4324 0.0000 173.5625 68 L 4.5160 7.5466 119.9138 52.5734 44.0599 175.7048 69 K 4.4116 8.7333 118.8243 56.1871 32.1673 177.5522 70 K 4.0431 7.4993 122.4449 56.8176 33.5089 175.2023 71 F 4.8432 7.7509 131.4019 55.7789 41.6209 173.9337 72 T 4.4442 8.6374 122.8546 61.6695 72.3400 173.0670 73 E 3.7995 8.9218 127.6438 57.2663 30.4893 174.7820 74 Y 4.8642 8.2147 123.9397 56.4024 41.0535 175.1634 75 S 5.1145 8.9091 117.1102 56.8938 65.1802 173.1857 76 L 5.8066 8.9778 127.6244 52.7923 45.0959 175.9201 77 R 4.9070 8.3915 119.6746 55.3227 33.2914 173.1446 78 F 5.2582 8.7131 128.7580 56.7016 42.2190 174.1059 79 L 4.7952 7.1864 122.2009 54.9521 44.3474 173.3266 80 A 4.7578 8.4863 121.4016 50.3606 21.9347 175.3906 81 Y 5.6042 7.6425 119.3479 54.3857 41.7983 174.3659 82 N 4.9934 8.3406 119.2500 50.6293 40.7483 174.7599 83 R 3.7789 8.3140 117.1771 60.1531 30.4072 177.2022 84 Y 4.4049 8.3142 115.1932 60.2743 38.3475 176.6997 85 G 4.0467 7.2784 105.7300 43.9042 0.0000 169.1144 86 P 4.9902 0.0000 0.0000 62.8171 32.4642 176.0052 87 G 4.7675 8.6669 118.0223 45.5235 0.0000 174.2319 88 V 3.9574 8.5185 125.7549 63.0902 32.0256 176.2685 89 S 4.8604 8.6532 124.0194 57.7629 64.3495 174.0613 90 T 4.4048 8.3727 113.5256 60.9720 70.0736 174.0128 91 D 4.4315 8.6646 122.2708 53.6238 41.3581 175.6356 92 D 4.4189 8.7620 122.8507 53.3545 38.9829 176.9431 93 I 4.0281 9.0835 126.9850 61.1359 37.8221 175.5916 94 T 4.9082 8.4258 125.1506 62.3005 69.7077 175.1703 95 V 4.2196 8.7129 127.1541 60.7830 34.5421 174.7937 96 V 3.6717 8.3683 129.4757 62.2923 31.4785 175.7226 97 T 3.9457 8.5344 118.6918 61.9952 69.6850 174.4976 98 L 4.2684 8.3402 122.6485 55.0293 42.1307 176.1227 99 S 4.5751 8.3448 113.0526 57.1437 64.0904 174.0561 100 D 4.6367 8.6540 128.7365 52.7697 39.3178 173.9904 101 S 4.4935 7.7172 113.5686 57.0928 65.2117 172.7070 102 G 3.9197 7.9246 122.2904 45.9700 0.0000 172.8771 103 P 4.4068 0.0000 0.0000 61.7051 29.6716 174.6949 104 S 4.4416 8.0326 118.7037 57.3039 62.4491 173.4651 105 S 4.5395 8.4883 123.6471 56.6774 64.2761 174.8678 106 G 3.7409 8.5728 113.3862 45.4562 0.0000 171.9579 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 G 8.35 3.90 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 0.00 0.00 0.00 2 S 9.11 4.39 0.00 3.89 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 S 8.02 4.59 0.00 3.87 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 4 G 7.55 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 5 S 7.44 4.33 0.00 4.03 3.83 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 6 S 8.72 4.45 0.00 3.75 3.90 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 7 G 8.57 4.06 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 0.00 0.00 0.00 8 P 0.00 4.61 0.00 2.22 2.20 0.00 3.90 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 2.20 1.89 0.00 9 G 8.19 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 0.00 0.00 0.00 0.00 10 P 0.00 4.37 0.00 2.31 2.19 0.00 4.14 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 2.14 0.00 11 V 8.43 3.71 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 1.16 0.00 0.00 1.21 0.00 0.00 12 E 8.48 4.68 0.00 2.00 1.87 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 2.14 2.30 0.00 13 N 8.32 4.40 0.00 2.80 2.88 0.00 0.00 6.71 6.72 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 14 L 7.73 4.78 0.00 1.72 1.63 0.72 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 15 Q 8.72 4.77 0.00 2.03 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.54 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 16 A 8.78 5.79 1.17 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 0.00 0.00 17 V 8.19 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 0.69 0.00 0.00 0.93 0.00 0.00 18 S 8.69 4.91 0.00 3.99 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 19 T 8.59 4.47 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 20 S 7.68 4.65 0.00 3.80 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 21 P 0.00 4.41 0.00 2.06 2.18 0.00 3.63 0.00 0.00 3.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 2.13 0.00 22 T 7.36 4.68 4.34 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 1.29 0.00 0.00 23 S 8.21 5.15 0.00 3.93 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.77 4.03 1.87 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 1.22 0.23 0.92 0.00 0.00 25 L 9.18 4.55 0.00 1.70 1.68 0.88 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 26 I 8.59 4.73 2.01 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 1.25 1.25 0.60 0.00 0.00 27 T 9.34 4.49 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 1.14 0.00 0.00 28 W 7.31 5.44 0.00 3.23 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 29 E 8.77 4.72 0.00 2.06 1.79 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 2.06 2.13 0.00 30 P 0.00 4.97 0.00 2.11 2.18 0.00 3.73 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 1.99 1.98 0.00 31 P 0.00 4.22 0.00 1.96 2.13 0.00 3.85 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 2.10 0.00 32 A 7.99 4.16 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 33 Y 6.63 4.51 0.00 3.09 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 34 A 7.30 4.76 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 35 N 8.75 4.44 0.00 2.83 3.02 0.00 0.00 7.16 8.01 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 36 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 37 P 0.00 4.39 0.00 2.08 2.05 0.00 3.53 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 1.87 0.00 38 V 7.62 3.95 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 -0.01 0.00 0.00 0.81 0.00 0.00 39 Q 8.23 4.00 0.00 2.23 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.61 6.71 0.00 0.00 0.00 0.00 0.00 2.33 2.40 0.00 40 G 5.90 3.64 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 0.00 0.00 0.00 41 Y 7.50 4.35 0.00 2.72 1.82 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.93 4.66 0.00 2.00 1.43 0.00 3.11 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.87 1.29 0.00 43 L 8.14 4.72 0.00 1.70 1.19 0.95 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 44 F 8.54 5.26 0.00 3.01 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 45 C 8.95 4.88 0.00 2.99 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 46 T 8.64 5.11 4.44 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 1.27 0.00 0.00 47 E 8.91 4.61 0.00 2.33 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 2.27 2.35 0.00 48 V 7.89 3.47 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 0.88 0.00 0.00 0.94 0.00 0.00 49 S 8.06 4.22 0.00 4.04 3.90 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 50 T 7.58 4.10 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 1.33 0.00 0.00 51 G 8.39 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 0.00 0.00 0.00 0.00 52 K 8.28 4.57 0.00 1.77 1.76 0.00 1.66 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.47 1.44 7.81 53 E 8.85 5.32 0.00 1.98 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 2.30 2.37 0.00 54 Q 9.18 4.71 0.00 2.09 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.75 0.00 0.00 0.00 0.00 0.00 2.47 2.30 0.00 55 N 8.90 5.16 0.00 2.64 2.87 0.00 0.00 7.31 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 56 I 8.83 4.56 1.65 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.16 0.66 0.65 0.00 0.00 57 E 8.72 4.68 0.00 1.76 1.87 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 2.14 2.20 0.00 58 V 7.72 4.52 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 -0.36 0.00 0.00 0.93 0.00 0.00 59 D 8.76 5.13 0.00 2.83 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 60 G 9.64 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 0.00 0.00 0.00 61 L 7.41 2.79 0.00 1.05 1.02 0.72 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 62 S 6.78 5.01 0.00 3.66 3.52 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 0.00 0.00 0.00 63 Y 8.40 4.63 0.00 3.31 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 64 K 8.11 4.50 0.00 1.66 1.52 0.00 1.75 0.00 0.00 1.56 0.00 0.00 2.65 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.28 1.36 7.81 65 L 8.74 4.45 0.00 2.03 1.51 1.07 0.54 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 66 E 8.52 4.96 0.00 1.81 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 2.15 2.37 0.00 67 G 8.93 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 68 L 7.55 4.52 0.00 1.61 1.51 0.80 0.14 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 69 K 8.73 4.41 0.00 1.99 1.84 0.00 1.80 0.00 0.00 1.67 0.00 0.00 3.18 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.55 1.59 7.81 70 K 7.50 4.04 0.00 1.78 1.81 0.00 1.73 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.50 1.66 7.81 71 F 7.75 4.84 0.00 3.19 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 72 T 8.64 4.44 3.73 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 0.66 0.00 0.00 73 E 8.92 3.80 0.00 1.99 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 2.34 2.32 0.00 74 Y 8.21 4.86 0.00 3.17 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 75 S 8.91 5.11 0.00 3.93 3.75 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 76 L 8.98 5.81 0.00 1.65 1.61 0.92 0.53 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 77 R 8.39 4.91 0.00 1.94 2.01 0.00 3.00 0.00 0.00 3.24 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 1.72 0.00 78 F 8.71 5.26 0.00 3.03 2.82 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.19 4.80 0.00 1.93 1.77 1.01 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 80 A 8.49 4.76 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 81 Y 7.64 5.60 0.00 3.07 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 82 N 8.34 4.99 0.00 2.68 2.78 0.00 0.00 5.73 7.33 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 83 R 8.31 3.78 0.00 1.73 1.75 0.00 3.28 0.00 0.00 3.30 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.80 0.00 84 Y 8.31 4.40 0.00 2.98 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 85 G 7.28 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 86 P 0.00 4.99 0.00 2.25 2.17 0.00 3.79 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.97 0.00 87 G 8.67 4.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 88 V 8.52 3.96 2.16 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 0.86 0.00 0.00 0.99 0.00 0.00 89 S 8.65 4.86 0.00 3.82 3.83 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 90 T 8.37 4.40 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 1.38 0.00 0.00 91 D 8.66 4.43 0.00 2.73 2.67 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 92 D 8.76 4.42 0.00 2.79 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 93 I 9.08 4.03 1.91 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 1.26 0.83 0.93 0.00 0.00 94 T 8.43 4.91 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 1.25 0.00 0.00 95 V 8.71 4.22 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 0.89 0.00 0.00 1.02 0.00 0.00 96 V 8.37 3.67 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 -0.56 0.00 0.00 0.84 0.00 0.00 97 T 8.53 3.95 4.66 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 1.34 0.00 0.00 98 L 8.34 4.27 0.00 1.70 1.76 0.97 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.00 0.00 0.00 0.00 0.00 0.00 99 S 8.34 4.58 0.00 4.03 3.86 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 D 8.65 4.64 0.00 2.71 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.72 4.49 0.00 3.81 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 0.00 102 G 7.92 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 0.00 0.00 0.00 103 P 0.00 4.41 0.00 2.19 2.11 0.00 3.74 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.95 0.00 104 S 8.03 4.44 0.00 3.82 3.82 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.49 4.54 0.00 3.85 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 0.00 106 G 8.57 3.74 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 0.00 0.00 0.00 0.00 0.00 0.00