NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.2518 8.2493 123.5806 51.8072 20.4759 176.5261 2 Q 4.4509 7.5605 110.9940 51.8544 31.1600 173.1747 3 S 4.1557 9.1775 113.4451 59.0880 63.9663 175.9928 4 V 4.2104 7.9093 114.8074 59.0707 33.8042 173.5295 5 P 4.3651 0.0000 0.0000 61.3659 31.8078 174.9917 6 P 4.4045 0.0000 0.0000 62.0704 29.9240 175.9268 7 G 3.7572 8.6701 113.0890 46.2579 0.0000 170.5281 8 D 4.9271 8.8992 123.9053 54.6032 41.4132 176.3703 9 I 4.1967 7.6321 118.3098 59.9828 38.2613 175.9275 10 N 4.5721 8.6381 124.7318 53.5798 39.5024 174.0260 11 T 4.9424 8.1622 111.0693 60.2731 72.9503 172.8716 12 Q 4.5591 8.8530 123.5133 53.4177 32.2896 173.1200 13 P 4.6148 0.0000 0.0000 62.8522 31.9347 176.3005 14 S 4.3780 8.1586 112.2686 59.4587 63.2096 173.5508 15 Q 4.7132 7.0274 117.1562 54.3713 29.3371 175.1389 16 K 4.3058 7.4285 114.2471 55.9753 36.2336 175.5767 17 I 4.1842 7.7087 126.0283 59.0784 40.9174 174.3246 18 V 4.1319 8.1190 130.1316 60.5388 31.9109 173.1900 19 F 3.6013 7.4792 125.6894 56.4780 39.3030 174.1823 20 N 4.8774 9.0083 120.6944 52.7160 39.2272 174.9290 21 A 3.6888 8.2604 125.2567 51.7811 19.2734 175.0355 22 P 4.3494 0.0000 0.0000 61.7407 33.5331 175.2478 23 Y 5.0846 7.9580 115.0212 58.2734 38.3104 176.6710 24 D 4.8228 8.0365 117.3068 54.1235 41.7249 174.8449 25 D 4.6066 7.6011 114.5873 53.4226 44.2270 174.6252 26 K 4.0904 8.8483 123.0814 56.9237 32.9515 175.8781 27 H 4.6094 8.8720 126.3550 54.8264 31.4193 173.7670 28 T 4.5813 8.2725 123.8693 62.5918 69.4798 174.1652 29 Y 4.3192 8.3374 125.4092 57.1702 39.3462 174.9786 30 H 5.4012 8.7475 122.1227 55.2582 29.8557 174.8978 31 I 4.6477 8.5265 122.8980 59.4360 40.9843 174.3727 32 K 4.8012 8.4462 123.5793 54.8218 34.4406 175.4748 33 I 5.1588 8.0764 124.5854 58.9162 41.3770 174.7581 34 T 4.9005 7.7529 119.4252 62.1783 73.5229 172.6569 35 N 4.3803 8.6622 123.8336 52.3030 39.5867 174.4763 36 A 4.2510 8.4516 129.3414 52.0402 19.1184 176.7176 37 G 4.2299 7.7051 109.4891 45.4113 0.0000 173.7867 38 G 3.8056 8.5515 106.1924 46.3283 0.0000 173.2672 39 R 4.8615 7.4770 116.7325 53.5105 33.7870 175.1637 40 R 4.9884 8.5665 116.5076 56.5803 31.2252 175.4631 41 I 4.7369 8.1709 111.3620 59.6903 41.3199 173.9397 42 G 4.7476 9.0495 113.9056 45.2668 0.0000 172.5832 43 W 6.3000 9.4890 123.1827 54.1492 31.7513 174.5365 44 A 4.8368 8.8942 120.7833 50.6680 22.3236 174.9805 45 I 5.6069 7.9993 119.7920 59.0240 40.5420 175.7176 46 K 4.7770 8.4760 123.0557 55.3138 36.2568 175.2560 47 T 5.1747 8.4974 114.2908 59.6577 72.0003 174.7386 48 T 3.7686 8.1378 112.8845 64.6074 69.6239 173.7006 49 N 4.7712 7.9733 118.9402 52.0389 41.6848 174.1300 50 M 4.8106 8.7690 122.4843 55.4499 32.3626 176.7094 51 R 4.4305 7.8736 118.0440 58.1760 31.7503 177.8627 52 R 4.1078 7.9569 116.1083 59.1712 30.9081 176.8109 53 L 4.7219 7.2932 117.3236 53.9672 43.4637 177.0147 54 S 4.4846 8.6894 115.7128 57.0235 65.7902 173.0865 55 V 5.2494 8.3459 118.5875 59.0475 33.2700 175.4459 56 D 5.0405 8.4742 124.7559 51.7829 45.4186 173.2114 57 P 4.6459 0.0000 0.0000 61.7097 32.5733 174.5946 58 P 4.3179 0.0000 0.0000 65.1943 31.5259 175.7109 59 C 4.5740 6.3183 111.2060 54.6170 32.8203 173.0943 60 G 3.8108 6.6948 105.8900 46.1387 0.0000 171.8944 61 V 4.8941 8.5655 119.7108 61.0991 33.0226 175.2410 62 L 4.5725 9.0545 128.5955 54.7924 43.4468 176.0906 63 D 5.1533 8.3857 120.0755 51.6645 44.5125 173.6112 64 P 4.0983 0.0000 0.0000 63.0915 31.7104 176.5080 65 K 3.8863 8.3929 127.5380 57.3546 31.3380 174.5589 66 E 4.6497 7.9349 117.3533 54.3508 31.7236 174.4889 67 K 5.0984 8.5273 125.0903 54.9573 34.4185 176.0702 68 V 4.6044 8.3782 122.0757 60.1875 35.1780 173.8864 69 L 5.0982 8.5589 121.8369 53.5165 43.8330 175.3607 70 M 5.0100 8.7199 121.1301 53.7086 36.3729 174.2525 71 A 4.8849 8.7507 123.8879 50.3864 22.3731 175.4778 72 V 4.5458 8.4282 123.2765 60.3228 32.1571 174.8275 73 S 4.9713 8.9872 123.6719 58.0064 64.3146 172.3998 74 C 4.8080 8.3702 119.6779 56.1565 31.8521 172.8237 75 D 4.7790 8.3411 123.6423 54.6899 41.1316 177.1726 76 T 4.4812 8.7300 112.0480 62.5614 69.6876 172.6920 77 F 4.6210 7.4746 115.4976 57.3543 41.9430 172.4152 78 N 4.6022 8.5377 117.2148 52.0950 39.2915 174.0599 79 A 4.6191 8.2208 125.4854 52.0152 19.0809 177.5485 80 A 4.3450 7.8903 123.1206 55.4738 19.2385 179.0863 81 T 4.7824 7.4855 106.2273 60.3666 68.7011 173.9188 82 E 4.6600 8.0336 119.9551 55.3196 33.6082 175.5606 83 D 4.4807 8.7595 123.6157 53.6661 40.3403 176.7210 84 L 4.6915 8.0666 121.4131 52.3974 41.7822 176.6445 85 N 4.9293 7.6993 114.4950 53.5324 39.7556 174.0452 86 N 4.9623 8.2935 110.1398 52.1122 40.8057 173.5335 87 D 4.9960 8.2842 119.9818 52.1975 42.6705 175.6449 88 R 4.9859 8.3907 119.4669 54.8052 33.2108 174.6092 89 I 4.8176 8.4253 122.9528 60.4854 40.3691 174.7169 90 T 4.9860 8.7023 119.2690 62.1572 72.7631 173.2816 91 I 5.1783 8.8780 127.5332 59.6493 40.0813 174.4772 92 E 5.7863 9.1867 125.1558 54.6767 33.2852 174.9471 93 W 6.3000 8.4369 116.0973 56.7437 32.2522 173.2348 94 T 4.6781 8.5047 115.8770 59.8376 70.5206 172.3873 95 N 4.7634 8.8956 126.0943 53.6787 37.3753 174.8786 96 T 3.1525 7.6900 113.2202 60.2295 69.7406 172.5917 97 P 4.2977 0.0000 0.0000 61.9956 32.1937 175.0665 98 D 4.3620 8.7332 118.4128 55.9479 40.9792 177.6036 99 G 3.9091 8.8407 114.5482 45.8266 0.0000 172.3487 100 A 4.1659 7.6826 119.8764 51.8029 19.2311 177.8122 101 A 4.4190 8.5539 122.2056 52.0067 19.6274 178.8215 102 K 4.4433 8.2000 120.4455 53.1060 30.6397 176.5145 103 Q 4.7883 7.7775 116.9190 55.0415 32.5480 173.8631 104 F 3.7203 9.1590 125.4037 58.7325 39.7191 174.1209 105 R 4.0723 5.8400 126.7106 53.8949 32.5913 176.1075 106 R 3.6479 7.8496 121.8086 58.3986 30.3204 178.2068 107 E 4.0394 7.7653 118.5931 58.7372 29.4499 178.0953 108 W 4.6140 7.4163 117.5239 58.8042 29.0979 177.1192 109 F 4.6184 8.4256 116.4002 57.4772 39.5218 176.1449 110 Q 4.8442 7.9710 116.9169 55.7353 30.0215 176.2837 111 G 4.2045 7.8763 108.4918 45.7464 0.0000 173.2482 112 D 4.5990 8.5879 123.8996 54.0119 42.6919 176.4135 113 G 3.8093 8.9139 109.7015 44.1924 0.0000 172.2802 114 M 4.7388 8.0179 114.3418 53.1664 34.1625 174.4339 115 V 4.0290 7.9784 119.5021 61.0764 34.0440 174.7059 116 R 4.2482 7.2962 126.9610 55.1339 32.1752 174.8033 117 R 5.2455 7.8817 121.7834 55.5196 33.3963 174.1697 118 K 4.7689 9.0610 124.2680 55.1099 36.8751 174.8414 119 N 5.7632 8.8200 121.9967 51.7207 40.2929 174.3899 120 L 4.6727 8.3615 123.5025 52.2545 43.8707 174.0694 121 P 4.5788 0.0000 0.0000 62.9923 32.2812 175.6308 122 I 4.2130 7.9444 124.6317 60.3460 38.6893 174.8957 123 E 4.7483 7.8670 123.0875 55.0025 34.5941 174.2562 124 Y 5.5192 8.5322 117.6768 55.5616 41.1990 174.3044 125 N 4.9355 9.1576 124.0351 51.9487 41.1228 175.1430 126 L 4.1661 8.4928 124.5558 54.8919 42.0439 176.2577 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 8.25 4.25 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 2 Q 7.56 4.45 0.00 2.22 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.87 0.00 0.00 0.00 0.00 0.00 2.22 2.40 0.00 3 S 9.18 4.16 0.00 3.97 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 4 V 7.91 4.21 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 0.71 0.00 0.00 0.90 0.00 0.00 5 P 0.00 4.37 0.00 2.16 2.04 0.00 3.76 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 1.94 0.00 6 P 0.00 4.40 0.00 2.03 2.03 0.00 3.73 0.00 0.00 3.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.95 0.00 7 G 8.67 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 8 D 8.90 4.93 0.00 2.62 2.80 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 9 I 7.63 4.20 1.29 0.00 0.00 0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.12 0.27 0.00 0.00 10 N 8.64 4.57 0.00 2.55 2.67 0.00 0.00 6.55 7.01 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 11 T 8.16 4.94 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 0.99 0.00 0.00 12 Q 8.85 4.56 0.00 1.95 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.89 0.00 0.00 0.00 0.00 0.00 2.22 2.23 0.00 13 P 0.00 4.61 0.00 2.13 2.08 0.00 3.75 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.94 1.94 0.00 14 S 8.16 4.38 0.00 3.94 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 15 Q 7.03 4.71 0.00 2.03 1.95 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 2.15 2.25 0.00 16 K 7.43 4.31 0.00 1.59 1.64 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.69 0.00 0.00 2.65 0.00 0.00 0.00 0.00 1.12 1.20 7.81 17 I 7.71 4.18 1.70 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 0.50 1.31 0.42 0.00 0.00 18 V 8.12 4.13 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 0.95 0.00 0.00 0.83 0.00 0.00 19 F 7.48 3.60 0.00 2.89 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 20 N 9.01 4.88 0.00 2.83 2.86 0.00 0.00 7.23 7.40 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 21 A 8.26 3.69 1.05 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 22 P 0.00 4.35 0.00 2.02 1.98 0.00 3.68 0.00 0.00 3.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.90 1.93 0.00 23 Y 7.96 5.08 0.00 2.75 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 24 D 8.04 4.82 0.00 2.62 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 25 D 7.60 4.61 0.00 2.65 2.44 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 26 K 8.85 4.09 0.00 1.67 1.80 0.00 1.83 0.00 0.00 2.46 0.00 0.00 2.69 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.48 1.32 7.81 27 H 8.87 4.61 0.00 3.18 3.08 0.00 5.66 0.00 0.00 0.00 0.00 6.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 28 T 8.27 4.58 4.12 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 1.14 0.00 0.00 29 Y 8.34 4.32 0.00 3.03 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 30 H 8.75 5.40 0.00 3.08 3.25 0.00 5.72 0.00 0.00 0.00 0.00 6.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 31 I 8.53 4.65 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 1.42 1.41 0.92 0.00 0.00 32 K 8.45 4.80 0.00 1.77 1.70 0.00 1.50 0.00 0.00 1.79 0.00 0.00 2.94 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.33 1.40 7.81 33 I 8.08 5.16 1.48 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 1.77 0.36 0.00 0.00 34 T 7.75 4.90 4.12 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 1.14 0.00 0.00 35 N 8.66 4.38 0.00 2.72 2.90 0.00 0.00 7.22 8.50 0.00 0.00 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 A 8.45 4.25 1.28 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 0.00 0.00 0.00 0.00 0.00 37 G 7.71 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 38 G 8.55 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 39 R 7.48 4.86 0.00 1.62 1.80 0.00 3.19 0.00 0.00 3.25 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.55 0.00 40 R 8.57 4.99 0.00 2.00 2.08 0.00 3.08 0.00 0.00 3.35 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.33 0.00 41 I 8.17 4.74 2.21 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 0.75 1.10 0.00 0.00 42 G 9.05 4.75 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 0.00 0.00 0.00 43 W 9.49 6.30 0.00 3.87 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 44 A 8.89 4.84 0.94 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 0.00 0.00 45 I 8.00 5.61 1.95 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.97 1.06 0.00 0.00 46 K 8.48 4.78 0.00 1.70 1.66 0.00 1.61 0.00 0.00 1.88 0.00 0.00 2.87 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.42 1.47 7.81 47 T 8.50 5.17 4.28 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 0.00 0.00 1.26 0.00 0.00 48 T 8.14 3.77 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 49 N 7.97 4.77 0.00 2.72 2.69 0.00 0.00 6.88 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 50 M 8.77 4.81 0.00 1.99 2.06 0.00 0.00 0.00 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.49 0.00 51 R 7.87 4.43 0.00 1.76 1.93 0.00 3.36 0.00 0.00 3.21 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.54 0.00 52 R 7.96 4.11 0.00 1.69 1.90 0.00 3.19 0.00 0.00 3.26 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 53 L 7.29 4.72 0.00 1.53 1.61 1.07 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 54 S 8.69 4.48 0.00 3.86 3.94 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 55 V 8.35 5.25 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 1.16 0.00 0.00 0.96 0.00 0.00 56 D 8.47 5.04 0.00 2.55 2.49 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 57 P 0.00 4.65 0.00 2.06 2.05 0.00 3.95 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.08 0.00 58 P 0.00 4.32 0.00 2.04 2.25 0.00 3.52 0.00 0.00 4.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.85 0.00 59 C 6.32 4.57 0.00 1.75 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 60 G 6.69 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 61 V 8.57 4.89 2.25 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 0.97 0.00 0.00 1.28 0.00 0.00 62 L 9.05 4.57 0.00 1.89 1.61 1.11 0.71 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 63 D 8.39 5.15 0.00 2.90 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 64 P 0.00 4.10 0.00 1.93 2.20 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 2.03 2.18 0.00 65 K 8.39 3.89 0.00 1.89 1.86 0.00 1.77 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.33 1.33 7.81 66 E 7.93 4.65 0.00 2.12 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 2.25 2.28 0.00 67 K 8.53 5.10 0.00 1.65 1.66 0.00 1.73 0.00 0.00 1.72 0.00 0.00 2.98 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.32 1.39 7.81 68 V 8.38 4.60 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 0.55 0.00 0.00 1.08 0.00 0.00 69 L 8.56 5.10 0.00 1.55 1.64 0.96 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 70 M 8.72 5.01 0.00 2.16 1.90 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.68 2.58 0.00 71 A 8.75 4.88 1.31 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 0.00 0.00 0.00 72 V 8.43 4.55 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 0.99 0.00 0.00 0.96 0.00 0.00 73 S 8.99 4.97 0.00 3.95 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 74 C 8.37 4.81 0.00 2.98 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 75 D 8.34 4.78 0.00 2.62 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 76 T 8.73 4.48 4.52 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 1.31 0.00 0.00 77 F 7.47 4.62 0.00 2.97 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 78 N 8.54 4.60 0.00 2.92 2.79 0.00 0.00 6.93 7.23 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 79 A 8.22 4.62 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 80 A 7.89 4.35 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 81 T 7.49 4.78 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 82 E 8.03 4.66 0.00 2.10 1.84 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 2.23 2.47 0.00 83 D 8.76 4.48 0.00 2.77 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 84 L 8.07 4.69 0.00 1.63 1.62 0.90 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 85 N 7.70 4.93 0.00 2.63 2.73 0.00 0.00 7.09 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 86 N 8.29 4.96 0.00 2.68 2.75 0.00 0.00 7.09 8.06 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 87 D 8.28 5.00 0.00 2.77 2.68 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 0.00 0.00 0.00 0.00 88 R 8.39 4.99 0.00 1.83 1.97 0.00 2.96 0.00 0.00 3.35 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 89 I 8.43 4.82 1.91 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.87 1.04 0.00 0.00 90 T 8.70 4.99 4.39 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 1.31 0.00 0.00 91 I 8.88 5.18 2.00 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 1.32 1.27 1.00 0.00 0.00 92 E 9.19 5.79 0.00 2.35 2.27 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 2.43 2.61 0.00 93 W 8.44 6.30 0.00 3.67 3.51 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 94 T 8.50 4.68 3.63 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 0.51 0.00 0.00 95 N 8.90 4.76 0.00 2.65 2.80 0.00 0.00 6.16 7.63 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 96 T 7.69 3.15 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 0.35 0.00 0.00 97 P 0.00 4.30 0.00 2.25 2.22 0.00 2.60 0.00 0.00 2.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 98 D 8.73 4.36 0.00 2.65 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 99 G 8.84 3.91 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 0.00 0.00 0.00 0.00 0.00 0.00 100 A 7.68 4.17 1.23 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 0.00 101 A 8.55 4.42 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 0.00 102 K 8.20 4.44 0.00 1.82 1.85 0.00 1.90 0.00 0.00 1.76 0.00 0.00 3.01 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.49 1.51 7.81 103 Q 7.78 4.79 0.00 2.04 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.84 0.00 0.00 0.00 0.00 0.00 2.14 2.14 0.00 104 F 9.16 3.72 0.00 3.00 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 0.00 105 R 5.84 4.07 0.00 0.67 0.66 0.00 2.97 0.00 0.00 2.97 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.19 0.00 106 R 7.85 3.65 0.00 1.78 1.77 0.00 3.17 0.00 0.00 3.22 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.56 0.00 107 E 7.77 4.04 0.00 1.94 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 0.00 2.39 2.37 0.00 108 W 7.42 4.61 0.00 3.68 3.07 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 0.00 109 F 8.43 4.62 0.00 3.09 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 0.00 110 Q 7.97 4.84 0.00 2.10 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.48 6.64 0.00 0.00 0.00 0.00 0.00 2.38 2.45 0.00 111 G 7.88 4.20 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 0.00 112 D 8.59 4.60 0.00 2.64 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 0.00 0.00 0.00 0.00 113 G 8.91 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 114 M 8.02 4.74 0.00 2.00 1.89 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.36 2.31 0.00 115 V 7.98 4.03 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 0.20 0.00 0.00 0.55 0.00 0.00 116 R 7.30 4.25 0.00 1.14 0.66 0.00 3.02 0.00 0.00 2.95 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 1.17 0.00 117 R 7.88 5.25 0.00 1.87 1.76 0.00 3.32 0.00 0.00 3.31 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.80 0.00 118 K 9.06 4.77 0.00 1.91 1.72 0.00 1.78 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.46 1.66 7.81 119 N 8.82 5.76 0.00 2.63 2.85 0.00 0.00 7.44 7.91 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 0.00 120 L 8.36 4.67 0.00 1.64 1.55 0.96 1.00 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 P 0.00 4.58 0.00 2.05 2.16 0.00 3.60 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 2.06 1.96 0.00 122 I 7.94 4.21 1.91 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.85 0.20 0.00 0.00 123 E 7.87 4.75 0.00 1.80 1.63 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 2.19 2.22 0.00 124 Y 8.53 5.52 0.00 2.95 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 0.00 125 N 9.16 4.94 0.00 2.95 2.80 0.00 0.00 6.96 6.59 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 0.00 126 L 8.49 4.17 0.00 1.67 1.51 0.98 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00