NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.4023 8.1076 122.4565 52.1303 20.4895 175.6249 2 T 4.6078 8.2245 110.1268 60.6433 70.7370 172.0862 3 H 4.9594 8.9368 119.0289 54.1405 34.1426 173.1084 4 E 4.9480 8.6138 120.2962 54.4267 32.5685 174.8657 5 V 4.5316 8.7073 126.2922 61.4439 34.7546 173.7890 6 H 5.2105 9.4999 125.4868 55.2275 30.9388 174.1043 7 M 4.6469 9.0400 122.9245 53.9731 33.6322 175.1286 8 L 5.1033 8.2613 123.6286 52.8085 45.4204 177.7363 9 N 4.4661 9.8233 120.9473 56.0543 39.5626 175.3500 10 K 4.9517 7.8491 116.7598 55.2169 35.5274 174.7476 11 G 4.1795 8.7984 112.4662 44.5371 0.0000 172.9629 12 E 3.9959 8.8528 117.9600 59.3186 29.3716 178.4863 13 S 4.3442 8.1632 111.1595 58.1372 63.9841 172.7787 14 G 3.6924 7.3003 107.1554 44.3698 0.0000 172.3714 15 A 4.7011 8.4295 122.5908 52.3625 20.0820 177.0494 16 M 3.1771 8.7829 122.0382 55.9752 29.4718 176.0010 17 V 4.5622 8.0746 113.2028 59.2553 36.7942 174.9412 18 F 5.2567 8.7897 122.1395 56.9223 40.3496 175.1215 19 E 4.8593 9.3184 122.7961 53.7014 32.9284 173.8013 20 P 4.7711 0.0000 0.0000 63.0351 32.1063 176.2746 21 A 4.5951 8.8403 121.4459 52.9237 20.1703 176.5671 22 F 5.3030 8.1660 117.0883 56.2072 42.5406 174.0891 23 V 4.1782 7.8579 125.0694 60.8372 34.6338 173.8342 24 R 4.7415 8.4012 127.5117 54.6812 31.5140 174.4970 25 A 4.9025 9.0519 127.5247 50.2597 22.9973 173.7940 26 E 4.9836 9.1846 116.9396 53.6166 33.9028 174.5757 27 P 4.4156 0.0000 0.0000 64.7795 31.7336 176.9899 28 G 3.9886 9.3527 111.9776 45.1381 0.0000 173.5799 29 D 4.7423 7.9789 119.4993 54.4562 42.3632 175.6777 30 V 4.8596 8.3552 113.3608 59.6686 35.2117 174.9490 31 I 4.6492 8.7220 124.6954 59.6075 40.0638 174.2366 32 N 5.1078 8.8940 125.7938 52.1338 40.3673 174.1632 33 F 5.1372 9.4712 123.7466 56.0513 41.0985 174.9230 34 V 4.7053 8.8311 124.7639 60.0618 33.6628 174.0023 35 P 4.8191 0.0000 0.0000 62.4746 28.2904 175.8615 36 T 4.0621 8.0695 121.7200 66.6557 69.3899 175.0542 37 D 5.0542 7.8957 118.7119 51.9304 43.8727 176.0507 38 K 4.2973 8.2197 120.8072 56.9066 32.7075 177.5556 39 S 4.5115 10.1026 115.4607 58.0500 62.2621 168.7131 40 H 5.1919 7.9106 117.6671 54.5131 32.2528 172.5934 41 N 5.5175 8.3160 116.1389 51.9215 41.1835 172.7587 42 V 4.7724 8.6526 117.3082 60.1700 34.6315 174.4207 43 E 4.7904 9.1405 124.2220 53.8675 33.3486 174.2502 44 A 3.8696 7.2585 128.2781 51.9578 19.2657 177.4428 45 I 3.7908 8.4435 123.6949 60.1173 37.2438 177.0422 46 K 3.7346 8.6828 128.0337 59.4617 32.0172 178.3350 47 E 4.2305 8.0271 115.3489 57.4607 30.0888 177.0291 48 I 4.4552 7.5970 120.9406 58.1312 37.1981 173.0023 49 L 4.4659 7.4238 121.7659 52.8062 45.0155 173.2463 50 P 4.3551 0.0000 0.0000 61.9444 32.0326 175.5645 51 E 3.8914 8.3676 119.7352 58.0367 29.7317 177.9339 52 G 3.8511 8.8057 110.1057 45.6523 0.0000 172.9937 53 V 4.2126 7.1216 119.2842 60.8226 32.3488 175.6654 54 E 4.1538 8.6905 127.2108 56.0838 30.0314 176.8710 55 S 4.2724 8.3949 117.2821 58.4679 63.4346 172.8053 56 F 5.0227 7.3504 117.2821 55.6848 41.4249 173.6759 57 K 4.6529 8.2976 121.7889 55.7499 33.8588 175.4443 58 S 4.5501 8.5679 123.5452 57.5260 64.6324 173.8480 59 K 4.3916 8.4277 119.3153 55.3345 33.4638 177.0089 60 I 3.8811 8.2706 124.2329 63.4740 37.4121 176.2279 61 N 4.5373 8.9822 120.7592 53.3862 36.8814 173.9224 62 E 4.8073 7.5324 117.3078 54.5526 31.8555 176.1983 63 S 4.7497 8.5803 117.4339 58.9999 64.1461 173.1952 64 Y 4.7583 9.0194 122.9809 56.2764 42.3029 173.9417 65 T 4.7697 7.6903 122.7529 61.7552 70.5836 173.4337 66 L 4.1808 8.7790 130.4211 53.9288 43.6115 175.2807 67 T 4.6739 8.2729 123.6711 62.5883 69.7997 174.8245 68 V 3.9766 8.4404 121.1756 60.6827 32.1746 176.8011 69 T 4.1035 8.6761 122.5471 65.0918 69.5673 175.7330 70 E 4.4396 7.6481 118.9057 54.6187 30.4503 174.8394 71 P 4.5853 0.0000 0.0000 62.9791 32.4927 175.7610 72 G 3.8414 8.0231 105.7518 44.0030 0.0000 171.9080 73 L 5.0789 8.5721 120.6892 53.8524 43.1078 176.3252 74 Y 4.7426 9.4930 121.8581 56.2965 40.3701 175.0340 75 G 4.3796 9.2476 113.0226 45.2811 0.0000 172.6697 76 V 5.0754 8.7949 116.4252 59.0843 35.9922 174.7814 77 K 5.2608 8.9050 121.7198 55.3529 36.4748 174.4201 78 C 5.0423 8.9576 122.2347 58.0985 32.7783 174.1089 79 T 3.8092 9.5817 124.7896 66.3491 68.2396 174.9130 80 P 4.3906 0.0000 0.0000 65.0785 31.7738 176.5665 81 H 4.9811 7.8706 115.3345 55.4489 29.4945 175.5537 82 F 4.5347 8.2759 123.5928 61.5438 39.1882 177.9124 83 G 3.4854 8.1246 107.3418 48.5948 0.0000 173.9754 84 M 4.1845 7.9395 116.9518 55.8188 32.1562 176.8443 85 G 3.8940 8.3257 107.5062 45.7702 0.0000 174.5150 86 M 4.6051 8.0297 121.5710 54.0530 31.0365 175.2698 87 V 5.3477 8.3088 115.6206 59.3662 36.4361 174.2146 88 G 4.3619 9.2146 109.1610 44.4978 0.0000 171.1119 89 L 5.2583 8.9975 121.1172 53.2587 45.9387 174.8757 90 V 4.4203 9.0251 126.4316 61.0670 34.2044 173.7220 91 Q 4.7631 8.5125 130.2236 54.7547 30.7551 174.1736 92 V 4.5806 8.9906 127.7221 62.4096 33.3270 176.4670 93 G 4.2684 9.0147 114.6349 44.5156 0.0000 171.7018 94 D 4.4002 8.3398 117.7088 54.1569 42.3833 175.1647 95 A 3.7791 8.5402 123.4752 52.5164 15.7263 176.1659 96 P 4.4352 0.0000 0.0000 62.3638 32.4187 177.3926 97 E 4.1710 8.8336 120.0876 58.0841 30.2815 177.3787 98 N 4.9486 7.8367 117.7521 52.5686 38.6211 176.5106 99 L 3.9521 7.9615 124.5964 59.3819 42.1051 177.8842 100 D 4.3438 8.1155 117.9743 57.3896 40.8560 178.4160 101 A 3.9935 8.0461 120.4869 55.2375 18.1742 179.4067 102 A 4.0187 7.8729 118.2766 55.1998 18.4955 179.7676 103 K 4.1296 8.0476 116.6828 58.7732 32.2132 178.6005 104 T 4.4166 7.4870 107.0455 60.4711 70.1767 174.7933 105 A 4.0322 7.3799 125.1960 52.4939 18.8930 177.3965 106 K 4.2245 8.5456 122.3225 56.5100 32.8892 176.2360 107 M 4.3426 7.9784 118.0380 52.5374 33.4461 173.1521 108 P 4.1949 0.0000 0.0000 62.1834 33.3262 177.2085 109 K 3.7408 8.5711 121.3455 60.0612 32.0177 179.0499 110 K 4.2299 8.2122 120.0297 58.6734 32.1273 178.4496 111 A 4.0347 7.8200 120.8208 55.1904 18.2996 179.3959 112 R 3.9025 8.2180 117.4540 59.4603 29.7135 178.5311 113 E 3.9642 8.3012 118.4148 59.6903 29.5487 179.6846 114 R 4.0796 8.1604 117.9871 59.2904 30.0134 178.8147 115 M 4.1492 8.6230 118.6730 58.7031 32.0187 177.9634 116 D 4.3478 8.3337 118.3876 57.2686 40.8492 178.3407 117 A 4.1418 7.9692 120.9042 55.2702 18.0116 179.5926 118 E 4.0259 8.3444 117.1060 59.5626 29.5546 179.6074 119 L 4.1293 8.3828 118.9570 57.4541 41.4067 179.1893 120 A 4.0645 7.4295 118.5680 54.4322 18.3229 178.7428 121 Q 3.8425 7.4788 115.0181 55.6293 29.2182 176.5876 122 V 3.9722 6.8239 120.9850 63.0747 32.1126 175.4219 123 N 4.6130 9.2367 123.5502 53.0915 37.2717 173.9905 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 A 8.11 4.40 1.18 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 0.00 0.00 0.00 0.00 0.00 0.00 2 T 8.22 4.61 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 1.14 0.00 0.00 3 H 8.94 4.96 0.00 2.96 3.04 0.00 5.75 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 E 8.61 4.95 0.00 1.88 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 2.24 2.27 0.00 5 V 8.71 4.53 1.47 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 1.29 0.00 0.00 0.58 0.00 0.00 6 H 9.50 5.21 0.00 3.23 3.21 0.00 5.67 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7 M 9.04 4.65 0.00 1.86 2.15 0.00 0.00 0.00 0.00 0.00 2.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.89 2.90 0.00 8 L 8.26 5.10 0.00 1.63 1.63 0.96 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 9 N 9.82 4.47 0.00 2.68 2.87 0.00 0.00 6.30 7.72 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 10 K 7.85 4.95 0.00 1.65 1.61 0.00 1.78 0.00 0.00 1.71 0.00 0.00 2.98 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.32 1.38 7.81 11 G 8.80 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 12 E 8.85 4.00 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 2.33 2.26 0.00 13 S 8.16 4.34 0.00 4.03 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 14 G 7.30 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 0.00 0.00 0.00 15 A 8.43 4.70 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 16 M 8.78 3.18 0.00 2.08 2.05 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 2.36 2.55 0.00 17 V 8.07 4.56 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 0.94 0.00 0.00 1.02 0.00 0.00 18 F 8.79 5.26 0.00 3.06 3.04 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 0.00 0.00 0.00 19 E 9.32 4.86 0.00 1.91 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 2.27 2.27 0.00 20 P 0.00 4.77 0.00 2.31 2.09 0.00 3.85 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.96 0.00 21 A 8.84 4.60 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 0.00 0.00 0.00 0.00 0.00 22 F 8.17 5.30 0.00 3.01 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 23 V 7.86 4.18 1.77 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 0.61 0.00 0.00 0.75 0.00 0.00 24 R 8.40 4.74 0.00 1.91 1.81 0.00 3.46 0.00 0.00 3.36 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 25 A 9.05 4.90 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 26 E 9.18 4.98 0.00 1.84 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 2.21 2.40 0.00 27 P 0.00 4.42 0.00 2.04 2.25 0.00 3.65 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 2.05 2.14 0.00 28 G 9.35 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 29 D 7.98 4.74 0.00 2.75 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 30 V 8.36 4.86 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 0.63 0.00 0.00 0.85 0.00 0.00 31 I 8.72 4.65 1.73 0.00 0.00 0.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.53 0.24 0.00 0.00 32 N 8.89 5.11 0.00 2.67 2.69 0.00 0.00 6.49 8.26 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 33 F 9.47 5.14 0.00 3.11 3.18 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 0.00 0.00 0.00 0.00 34 V 8.83 4.71 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 1.04 0.00 0.00 1.04 0.00 0.00 35 P 0.00 4.82 0.00 2.16 2.15 0.00 3.87 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 2.02 2.14 0.00 36 T 8.07 4.06 4.40 0.00 0.00 0.00 0.00 0.00 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 37 D 7.90 5.05 0.00 2.75 2.59 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 0.00 0.00 0.00 0.00 38 K 8.22 4.30 0.00 1.75 1.83 0.00 1.71 0.00 0.00 1.76 0.00 0.00 3.03 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.44 7.81 39 S 10.10 4.51 0.00 3.87 4.36 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 40 H 7.91 5.19 0.00 3.10 3.17 0.00 5.59 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 41 N 8.32 5.52 0.00 2.80 2.90 0.00 0.00 5.45 7.68 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 42 V 8.65 4.77 1.78 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 0.40 0.00 0.00 0.05 0.00 0.00 43 E 9.14 4.79 0.00 1.79 1.62 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 1.86 2.16 0.00 44 A 7.26 3.87 0.36 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 45 I 8.44 3.79 1.81 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 0.99 0.50 0.92 0.00 0.00 46 K 8.68 3.73 0.00 1.67 1.82 0.00 1.68 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.33 1.35 7.81 47 E 8.03 4.23 0.00 1.96 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 0.00 2.30 2.27 0.00 48 I 7.60 4.46 1.88 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.72 1.00 0.00 0.00 49 L 7.42 4.47 0.00 1.43 1.37 0.89 1.03 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 50 P 0.00 4.36 0.00 2.01 2.00 0.00 2.72 0.00 0.00 3.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.76 0.00 51 E 8.37 3.89 0.00 1.93 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 2.29 2.24 0.00 52 G 8.81 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 0.00 0.00 0.00 53 V 7.12 4.21 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 1.03 0.00 0.00 0.94 0.00 0.00 54 E 8.69 4.15 0.00 2.10 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 2.36 2.29 0.00 55 S 8.39 4.27 0.00 3.74 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 56 F 7.35 5.02 0.00 2.96 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 57 K 8.30 4.65 0.00 1.60 1.63 0.00 1.82 0.00 0.00 1.70 0.00 0.00 2.71 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.25 1.32 7.81 58 S 8.57 4.55 0.00 3.96 3.46 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 0.00 59 K 8.43 4.39 0.00 1.74 1.77 0.00 1.71 0.00 0.00 1.82 0.00 0.00 2.81 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.54 1.44 7.81 60 I 8.27 3.88 1.87 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 1.40 0.71 0.87 0.00 0.00 61 N 8.98 4.54 0.00 2.93 3.04 0.00 0.00 6.93 7.27 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 62 E 7.53 4.81 0.00 1.98 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 2.47 2.46 0.00 63 S 8.58 4.75 0.00 3.80 3.84 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 64 Y 9.02 4.76 0.00 3.11 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 T 7.69 4.77 3.97 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 1.06 0.00 0.00 66 L 8.78 4.18 0.00 1.78 1.73 0.44 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 0.00 0.00 0.00 0.00 0.00 0.00 67 T 8.27 4.67 4.17 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 1.17 0.00 0.00 68 V 8.44 3.98 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 -0.10 0.00 0.00 0.80 0.00 0.00 69 T 8.68 4.10 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 70 E 7.65 4.44 0.00 2.13 1.90 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 2.38 2.57 0.00 71 P 0.00 4.59 0.00 2.22 2.09 0.00 3.79 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 2.01 1.99 0.00 72 G 8.02 3.84 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 0.00 0.00 0.00 73 L 8.57 5.08 0.00 1.64 1.69 0.99 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 74 Y 9.49 4.74 0.00 2.79 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 75 G 9.25 4.38 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 0.00 76 V 8.79 5.08 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 0.86 0.00 0.00 0.48 0.00 0.00 77 K 8.90 5.26 0.00 1.42 1.49 0.00 0.61 0.00 0.00 0.61 0.00 0.00 2.53 0.00 0.00 2.70 0.00 0.00 0.00 0.00 1.07 0.98 7.81 78 C 8.96 5.04 0.00 2.93 2.85 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 79 T 9.58 3.81 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 1.16 0.00 0.00 80 P 0.00 4.39 0.00 1.90 2.08 0.00 3.78 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 1.67 1.84 0.00 81 H 7.87 4.98 0.00 3.18 3.31 0.00 5.65 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 F 8.28 4.53 0.00 3.17 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 83 G 8.12 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 0.00 0.00 0.00 84 M 7.94 4.18 0.00 2.03 2.28 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 2.63 2.54 0.00 85 G 8.33 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 0.00 0.00 0.00 86 M 8.03 4.61 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.20 1.64 0.00 87 V 8.31 5.35 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 1.11 0.00 0.00 1.13 0.00 0.00 88 G 9.21 4.36 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 0.00 89 L 9.00 5.26 0.00 2.00 1.71 1.08 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 90 V 9.03 4.42 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 0.59 0.00 0.00 0.88 0.00 0.00 91 Q 8.51 4.76 0.00 2.32 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.53 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 92 V 8.99 4.58 2.37 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 0.98 0.00 0.00 0.78 0.00 0.00 93 G 9.01 4.27 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 94 D 8.34 4.40 0.00 2.65 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 95 A 8.54 3.78 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 96 P 0.00 4.44 0.00 2.24 2.14 0.00 3.81 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 2.04 2.03 0.00 97 E 8.83 4.17 0.00 2.10 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 0.00 2.27 2.29 0.00 98 N 7.84 4.95 0.00 2.90 3.02 0.00 0.00 5.91 6.67 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 99 L 7.96 3.95 0.00 1.80 1.73 0.95 1.24 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 0.00 100 D 8.12 4.34 0.00 2.73 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 0.00 101 A 8.05 3.99 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 0.00 102 A 7.87 4.02 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 0.00 103 K 8.05 4.13 0.00 1.94 1.90 0.00 1.68 0.00 0.00 1.76 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.63 7.81 104 T 7.49 4.42 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 0.00 105 A 7.38 4.03 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 0.00 106 K 8.55 4.22 0.00 1.78 1.76 0.00 1.79 0.00 0.00 1.76 0.00 0.00 3.04 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.43 7.81 107 M 7.98 4.34 0.00 2.22 1.77 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.65 0.00 108 P 0.00 4.19 0.00 1.84 1.81 0.00 2.21 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.76 0.00 109 K 8.57 3.74 0.00 1.81 1.79 0.00 1.58 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.49 1.57 7.81 110 K 8.21 4.23 0.00 1.84 1.76 0.00 1.81 0.00 0.00 1.99 0.00 0.00 2.98 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.51 1.49 7.81 111 A 7.82 4.03 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 0.00 112 R 8.22 3.90 0.00 1.91 2.08 0.00 3.31 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.72 0.00 113 E 8.30 3.96 0.00 2.24 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 0.00 2.33 2.47 0.00 114 R 8.16 4.08 0.00 2.03 2.06 0.00 3.31 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.67 0.00 115 M 8.62 4.15 0.00 2.15 2.18 0.00 0.00 0.00 0.00 0.00 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.69 0.00 116 D 8.33 4.35 0.00 2.90 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 0.00 117 A 7.97 4.14 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 E 8.34 4.03 0.00 2.29 2.21 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 2.56 2.54 0.00 119 L 8.38 4.13 0.00 1.84 1.73 1.00 1.25 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 0.00 120 A 7.43 4.06 1.30 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 0.00 121 Q 7.48 3.84 0.00 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.02 6.73 0.00 0.00 0.00 0.00 0.00 2.03 2.11 0.00 122 V 6.82 3.97 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 0.84 0.00 0.00 1.09 0.00 0.00 123 N 9.24 4.61 0.00 2.82 2.72 0.00 0.00 6.85 7.14 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