NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.2148 8.3144 121.7901 55.9219 32.5735 174.8608 2 E 3.9477 8.6377 128.4188 54.2055 30.2592 175.5758 3 T 4.4069 8.6509 118.6996 60.5169 72.7905 175.1014 4 A 4.0013 8.4531 122.3355 55.2936 18.4348 179.7248 5 A 3.9563 8.0090 118.5525 55.2343 18.4684 179.5885 6 A 4.0036 7.9838 119.0101 55.0962 18.4200 179.7355 7 K 3.9910 8.4468 118.5585 59.6047 32.3102 178.6164 8 F 4.0795 8.3195 120.9020 61.4139 39.2768 176.9481 9 E 4.0730 8.3180 117.5301 59.5082 29.1226 179.1919 10 R 3.8932 7.9561 117.4025 59.8075 30.2058 178.2768 11 Q 3.9526 7.9980 116.4338 58.0465 28.9621 176.5869 12 H 4.6496 7.8736 113.8951 54.2316 30.9878 173.1231 13 M 4.7294 7.8247 119.5800 54.3015 33.5943 176.5857 14 D 4.7960 8.7820 122.0366 53.2761 41.7883 175.8864 15 S 4.3589 7.9749 116.6849 60.7632 63.6494 176.1344 16 S 4.3779 7.7041 115.0657 60.0288 62.8374 174.2587 17 T 4.7281 7.5971 109.8079 59.6154 71.1983 174.1403 18 S 4.2647 8.6137 117.5439 60.1711 63.8168 173.4042 19 A 3.8058 7.1419 120.8668 51.3871 21.4032 174.6556 20 A 4.2325 8.3264 123.0410 50.8350 20.0310 177.6190 21 S 4.5322 8.5410 118.0729 58.6980 65.2366 174.4896 22 S 4.7321 7.7030 114.6734 56.3710 63.4440 174.8826 23 S 4.3081 8.6114 120.9028 60.7837 63.2738 174.6458 24 N 4.6451 8.2395 117.9138 53.8932 39.0666 176.0317 25 Y 4.0052 7.9542 120.4172 61.2385 38.6426 177.4440 26 C 4.1770 8.3478 116.6672 60.2801 38.6486 175.8860 27 N 4.3789 8.2680 117.3123 56.5268 38.0765 177.3899 28 Q 3.9144 7.8458 118.8809 59.3182 28.9117 178.5878 29 M 3.6898 7.7968 120.0093 58.3413 31.7354 178.7779 30 M 4.0280 8.2012 119.6450 58.0057 32.1180 178.9853 31 K 3.9614 7.5639 118.2242 60.2151 32.7379 179.3854 32 S 4.1212 7.8478 115.5372 61.0577 62.7973 176.1015 33 R 4.2353 7.8131 117.5610 55.3505 30.2985 175.6914 34 N 4.1699 7.9895 115.7108 55.2524 37.4849 174.4132 35 L 4.6920 8.0053 114.7587 54.6164 42.4183 177.6983 36 T 5.1723 7.5323 107.6828 60.1392 69.2896 173.6776 37 K 4.3226 8.2638 121.4371 57.9183 33.1443 176.2559 38 D 4.7679 9.5967 128.2708 54.6392 39.4440 174.2967 39 R 4.2964 6.9121 114.5966 54.4809 34.2947 174.5212 40 C 4.7446 8.6404 117.4695 55.8427 40.8541 173.8753 41 K 4.1523 8.4227 127.0746 56.0423 32.2672 174.7587 42 P 4.5830 0.0000 0.0000 65.2815 32.3987 176.5852 43 V 5.0640 7.5383 116.5925 61.5970 34.8180 173.8765 44 N 4.6939 8.8925 123.1070 52.8854 42.8518 173.0083 45 T 4.8185 7.7633 120.1105 61.5865 72.1975 172.6284 46 F 4.8988 9.0605 124.6301 55.6469 42.0090 174.5763 47 V 4.5385 9.1068 123.5949 61.0497 33.2505 175.8932 48 H 5.5371 8.6757 129.4221 53.8563 26.1545 173.5825 49 E 4.8035 7.6550 117.4200 53.4070 34.5675 176.5332 50 S 4.3627 8.3854 115.0742 58.0771 65.0195 174.7885 51 L 3.9683 8.6135 125.1465 58.6716 41.9750 179.3389 52 A 3.9936 8.0301 119.9303 55.3398 18.0890 179.2034 53 D 4.3655 7.8213 116.6150 57.3229 41.1783 178.8323 54 V 3.8057 7.9587 118.9826 66.0352 31.7170 178.1565 55 Q 3.9145 8.4247 117.8308 58.7974 28.5750 178.5756 56 A 4.0614 7.9806 121.2229 54.6416 18.2467 179.6615 57 V 3.5363 7.6110 117.0925 66.0808 31.3006 177.0405 58 C 3.8936 7.7908 114.7686 58.1522 39.8850 174.2266 59 S 4.6300 7.4079 113.8209 57.9095 63.8818 174.7856 60 Q 4.2501 7.5640 125.6816 56.1880 27.2622 177.3975 61 K 4.1484 7.9050 129.7708 56.8683 32.9085 175.7981 62 N 4.4337 8.7673 127.5639 53.6806 39.3896 174.3042 63 V 4.5841 8.4012 118.3332 59.1984 36.7704 174.7714 64 A 4.3015 8.3596 124.7439 52.1938 19.1277 178.5205 65 C 4.7013 9.0259 119.7940 55.8403 41.1579 175.3519 66 K 3.7417 9.2389 121.3338 59.5080 32.1414 177.6229 67 N 4.6004 8.1305 115.4709 52.6309 37.4509 175.8170 68 G 3.9582 8.1319 108.7130 45.6571 0.0000 174.4592 69 Q 4.1638 8.4147 119.2138 56.4183 29.1589 176.7670 70 T 4.4486 8.2908 108.6650 61.7075 69.4995 174.0962 71 N 4.9936 7.7664 119.6958 53.7686 38.5761 174.9266 72 C 5.3019 7.3983 115.9643 56.7025 43.8204 172.8721 73 Y 5.0427 8.6898 118.7950 56.2128 42.0086 173.9674 74 Q 5.1939 9.0129 124.7131 53.8675 31.7481 174.8631 75 S 4.4288 8.6815 121.7547 58.6270 63.0648 174.1205 76 Y 4.3985 8.8219 122.1183 60.5544 37.8887 176.6640 77 S 5.0449 7.8357 112.3603 56.4474 65.7012 174.2805 78 T 4.2231 8.2183 110.6025 61.9949 69.7912 173.4120 79 M 5.0001 9.2466 121.9313 53.3024 37.1480 174.7036 80 S 4.5805 9.7668 116.6005 58.3459 63.4434 173.0517 81 I 5.2361 9.0265 120.7635 59.4949 41.6134 174.5402 82 T 5.0524 8.8353 119.2261 62.0432 72.2529 172.4453 83 D 5.0776 9.1958 127.3842 53.3715 43.1872 174.2678 84 C 5.5848 9.2854 123.4441 55.2265 40.5479 172.9556 85 R 5.2603 8.8822 123.5396 54.0976 33.1585 173.9402 86 E 4.1092 9.2351 128.4249 56.6982 30.2318 176.7352 87 T 4.2884 8.5430 117.1910 60.8883 70.4625 175.7093 88 G 3.7676 8.7926 110.1837 47.1144 0.0000 174.2649 89 S 4.5817 7.4883 112.7291 57.6053 64.1668 174.5699 90 S 3.9533 7.4806 117.0126 58.6034 62.5188 173.6437 91 K 4.2935 8.7462 128.7694 55.0177 33.7243 174.3381 92 Y 4.1470 8.7506 127.5323 57.9028 38.8586 174.3882 93 P 2.9700 0.0000 0.0000 62.7549 32.3832 176.7403 94 N 4.5776 7.9152 120.1232 52.1265 36.9350 173.1896 95 C 4.5560 7.8795 116.5964 56.7245 42.8297 173.3428 96 A 5.0576 8.5389 125.6197 50.3342 21.8650 174.4360 97 Y 5.1061 9.1330 118.7270 56.0150 42.3135 174.8700 98 K 4.4827 9.3114 124.6676 55.7537 34.0527 175.2415 99 T 5.0487 8.5764 124.1046 62.6423 70.0414 174.1642 100 T 4.5831 9.0092 123.3127 61.7983 71.7728 172.7689 101 Q 4.9391 8.5996 127.6484 55.0147 30.7750 174.0825 102 A 4.4269 8.4648 125.4610 51.7085 23.7426 174.7613 103 N 5.3258 8.8151 116.5715 51.8638 39.9769 174.7119 104 K 4.7962 8.7019 122.6665 54.5121 37.2241 175.7109 105 H 5.0000 8.8036 118.8426 55.8500 30.1198 174.7627 106 I 4.8111 8.6175 115.6031 59.5234 40.6770 174.5375 107 I 4.8414 8.0812 123.7145 59.7515 40.1557 175.0504 108 V 4.7286 8.5296 119.7551 59.2957 35.7438 174.4717 109 A 4.9836 8.6779 125.0469 50.9295 20.7181 175.5676 110 C 5.0721 8.7129 119.6865 55.3780 43.6440 173.0914 111 E 4.6408 8.6214 120.3035 56.5527 34.4393 176.1812 112 G 4.0028 9.3905 109.0683 45.0212 0.0000 171.7374 113 N 5.0576 8.3877 118.0001 51.1995 40.8208 173.2267 114 P 4.3293 0.0000 0.0000 62.7589 31.9875 175.8120 115 Y 4.8287 8.2905 121.4091 57.0476 38.6291 174.5786 116 V 4.4453 8.3588 119.4473 58.3111 36.6912 173.4674 117 P 4.4276 0.0000 0.0000 62.9286 31.0019 176.9264 118 V 4.4247 8.6101 116.5127 61.4057 33.8784 175.2801 119 H 5.0627 7.8624 119.5735 54.8361 33.5125 171.9762 120 F 4.4729 8.7879 127.8525 57.5181 39.1085 174.6515 121 D 4.4892 8.3833 127.0003 56.1699 41.6517 175.7135 122 A 4.6554 6.6191 117.2450 51.4709 22.6582 174.3716 123 S 5.1216 8.7436 112.7563 56.9005 66.0811 174.7784 124 V 4.1555 8.6320 114.9348 61.7516 32.1522 175.2024 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 K 8.31 4.21 0.00 1.74 1.83 0.00 1.75 0.00 0.00 1.71 0.00 0.00 2.91 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.33 1.44 7.81 2 E 8.64 3.95 0.00 2.06 1.85 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 2.31 2.38 0.00 3 T 8.65 4.41 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 1.23 0.00 0.00 4 A 8.45 4.00 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 5 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 6 A 7.98 4.00 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 7 K 8.45 3.99 0.00 2.00 2.04 0.00 1.67 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.46 7.81 8 F 8.32 4.08 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 9 E 8.32 4.07 0.00 2.33 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 2.54 2.71 0.00 10 R 7.96 3.89 0.00 1.80 1.96 0.00 3.38 0.00 0.00 3.22 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.68 0.00 11 Q 8.00 3.95 0.00 1.53 1.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.50 0.00 0.00 0.00 0.00 0.00 2.25 2.47 0.00 12 H 7.87 4.65 0.00 2.24 2.75 0.00 5.61 0.00 0.00 0.00 0.00 6.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 M 7.82 4.73 0.00 2.09 2.18 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.74 0.00 14 D 8.78 4.80 0.00 2.65 2.46 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 15 S 7.97 4.36 0.00 3.93 3.95 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 16 S 7.70 4.38 0.00 4.01 3.93 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 17 T 7.60 4.73 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 1.28 0.00 0.00 18 S 8.61 4.26 0.00 3.97 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 A 7.14 3.81 1.07 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 0.00 0.00 20 A 8.33 4.23 0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.54 4.53 0.00 3.83 3.88 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 22 S 7.70 4.73 0.00 3.87 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 23 S 8.61 4.31 0.00 4.05 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 24 N 8.24 4.65 0.00 2.82 2.89 0.00 0.00 6.42 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 25 Y 7.95 4.01 0.00 3.07 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 C 8.35 4.18 0.00 3.19 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 27 N 8.27 4.38 0.00 3.04 2.92 0.00 0.00 7.11 7.74 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 28 Q 7.85 3.91 0.00 2.06 1.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.80 0.00 0.00 0.00 0.00 0.00 2.30 2.33 0.00 29 M 7.80 3.69 0.00 0.78 1.17 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.57 0.00 30 M 8.20 4.03 0.00 1.65 1.84 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 2.48 0.00 31 K 7.56 3.96 0.00 2.12 2.19 0.00 1.30 0.00 0.00 1.63 0.00 0.00 2.91 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.52 1.44 7.81 32 S 7.85 4.12 0.00 3.74 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 33 R 7.81 4.24 0.00 1.94 2.10 0.00 3.63 0.00 0.00 3.13 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.92 0.00 34 N 7.99 4.17 0.00 2.87 2.89 0.00 0.00 6.97 7.58 0.00 0.00 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 8.01 4.69 0.00 1.83 1.59 0.78 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 36 T 7.53 5.17 4.41 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 1.43 0.00 0.00 37 K 8.26 4.32 0.00 1.80 1.81 0.00 1.85 0.00 0.00 1.73 0.00 0.00 2.98 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.47 1.66 7.81 38 D 9.60 4.77 0.00 2.74 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 39 R 6.91 4.30 0.00 1.72 1.69 0.00 3.04 0.00 0.00 3.28 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.42 0.00 40 C 8.64 4.74 0.00 3.09 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 41 K 8.42 4.15 0.00 1.79 1.77 0.00 1.76 0.00 0.00 1.60 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.60 1.43 7.81 42 P 0.00 4.58 0.00 2.15 2.11 0.00 3.64 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.11 0.00 43 V 7.54 5.06 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 0.80 0.00 0.00 0.97 0.00 0.00 44 N 8.89 4.69 0.00 2.63 2.23 0.00 0.00 6.92 6.79 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 45 T 7.76 4.82 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 0.87 0.00 0.00 46 F 9.06 4.90 0.00 2.97 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 47 V 9.11 4.54 2.17 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 1.14 0.00 0.00 1.05 0.00 0.00 48 H 8.68 5.54 0.00 3.08 3.43 0.00 5.63 0.00 0.00 0.00 0.00 6.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 49 E 7.66 4.80 0.00 1.95 1.85 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 2.27 2.29 0.00 50 S 8.39 4.36 0.00 4.07 4.02 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.61 3.97 0.00 1.77 1.75 1.02 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.03 3.99 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 53 D 7.82 4.37 0.00 2.87 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 54 V 7.96 3.81 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 1.20 0.00 0.00 1.10 0.00 0.00 55 Q 8.42 3.91 0.00 2.25 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.57 0.00 0.00 0.00 0.00 0.00 2.31 2.58 0.00 56 A 7.98 4.06 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 57 V 7.61 3.54 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 1.09 0.00 0.00 0.97 0.00 0.00 58 C 7.79 3.89 0.00 2.94 2.77 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 59 S 7.41 4.63 0.00 3.94 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 60 Q 7.56 4.25 0.00 1.91 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.98 0.00 0.00 0.00 0.00 0.00 2.35 2.39 0.00 61 K 7.90 4.15 0.00 1.51 1.66 0.00 1.69 0.00 0.00 1.55 0.00 0.00 2.78 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.40 1.44 7.81 62 N 8.77 4.43 0.00 2.81 2.67 0.00 0.00 7.00 7.71 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 63 V 8.40 4.58 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 0.69 0.00 0.00 0.79 0.00 0.00 64 A 8.36 4.30 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 65 C 9.03 4.70 0.00 3.08 2.99 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 66 K 9.24 3.74 0.00 1.82 1.94 0.00 1.62 0.00 0.00 1.77 0.00 0.00 3.04 0.00 0.00 3.26 0.00 0.00 0.00 0.00 1.64 1.40 7.81 67 N 8.13 4.60 0.00 2.83 2.93 0.00 0.00 6.25 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 68 G 8.13 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 69 Q 8.41 4.16 0.00 2.21 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.07 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 70 T 8.29 4.45 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 1.18 0.00 0.00 71 N 7.77 4.99 0.00 3.09 3.18 0.00 0.00 6.09 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 72 C 7.40 5.30 0.00 2.96 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 73 Y 8.69 5.04 0.00 2.87 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 74 Q 9.01 5.19 0.00 1.97 1.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.99 0.00 0.00 0.00 0.00 0.00 2.20 2.21 0.00 75 S 8.68 4.43 0.00 3.94 3.87 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 76 Y 8.82 4.40 0.00 3.10 3.02 0.00 0.00 0.00 0.00 0.00 0.00 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 S 7.84 5.04 0.00 3.89 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 78 T 8.22 4.22 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 1.02 0.00 0.00 79 M 9.25 5.00 0.00 1.96 2.00 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.49 0.00 80 S 9.77 4.58 0.00 3.87 4.04 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 81 I 9.03 5.24 1.89 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 1.35 0.79 1.05 0.00 0.00 82 T 8.84 5.05 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 1.21 0.00 0.00 83 D 9.20 5.08 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 84 C 9.29 5.58 0.00 2.87 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 85 R 8.88 5.26 0.00 1.95 1.78 0.00 3.31 0.00 0.00 3.13 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.60 0.00 86 E 9.24 4.11 0.00 2.02 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 2.04 1.70 0.00 87 T 8.54 4.29 4.21 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 1.23 0.00 0.00 88 G 8.79 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 0.00 0.00 0.00 89 S 7.49 4.58 0.00 3.91 3.93 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 90 S 7.48 3.95 0.00 3.76 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 91 K 8.75 4.29 0.00 1.78 1.60 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.87 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.35 1.40 7.81 92 Y 8.75 4.15 0.00 3.02 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 93 P 0.00 2.97 0.00 1.79 1.21 0.00 3.64 0.00 0.00 3.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.73 0.00 94 N 7.92 4.58 0.00 2.80 2.75 0.00 0.00 6.98 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 95 C 7.88 4.56 0.00 3.11 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 96 A 8.54 5.06 1.12 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 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 9.13 5.11 0.00 2.97 2.89 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 98 K 9.31 4.48 0.00 1.83 1.73 0.00 1.64 0.00 0.00 1.68 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.43 1.45 7.81 99 T 8.58 5.05 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 1.33 0.00 0.00 100 T 9.01 4.58 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 1.23 0.00 0.00 101 Q 8.60 4.94 0.00 1.94 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.82 0.00 0.00 0.00 0.00 0.00 2.19 2.36 0.00 102 A 8.46 4.43 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 0.00 103 N 8.82 5.33 0.00 2.59 2.76 0.00 0.00 6.67 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 K 8.70 4.80 0.00 1.74 1.70 0.00 1.72 0.00 0.00 1.83 0.00 0.00 2.88 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.43 7.81 105 H 8.80 5.00 0.00 3.09 3.22 0.00 5.59 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.62 4.81 1.81 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 1.27 0.63 1.15 0.00 0.00 107 I 8.08 4.84 1.75 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 1.13 0.67 0.82 0.00 0.00 108 V 8.53 4.73 1.88 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 0.68 0.00 0.00 0.82 0.00 0.00 109 A 8.68 4.98 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 0.00 110 C 8.71 5.07 0.00 2.01 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 0.00 0.00 0.00 111 E 8.62 4.64 0.00 1.83 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 2.23 0.00 112 G 9.39 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 0.00 0.00 0.00 113 N 8.39 5.06 0.00 2.64 2.69 0.00 0.00 6.86 7.69 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 0.00 114 P 0.00 4.33 0.00 2.23 2.05 0.00 3.82 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 1.96 0.00 115 Y 8.29 4.83 0.00 2.79 2.89 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 0.00 116 V 8.36 4.45 1.94 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 0.65 0.00 0.00 0.84 0.00 0.00 117 P 0.00 4.43 0.00 0.49 1.35 0.00 3.32 0.00 0.00 3.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.79 0.00 118 V 8.61 4.42 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 0.58 0.00 0.00 0.95 0.00 0.00 119 H 7.86 5.06 0.00 3.30 3.12 0.00 5.85 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 F 8.79 4.47 0.00 2.60 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 0.00 121 D 8.38 4.49 0.00 2.59 2.55 0.00 0.00 0.00 0.00 0.00 0.00 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 A 6.62 4.66 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 0.00 123 S 8.74 5.12 0.00 3.96 4.09 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 0.00 124 V 8.63 4.16 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 0.66 0.00 0.00 0.92 0.00 0.00