NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3089 8.1933 115.3911 57.5073 64.6513 174.5507 2 W 4.4179 8.4014 121.1174 59.0858 28.8039 177.1630 3 Q 4.1361 8.7616 121.2484 59.1472 28.9569 177.6532 4 A 4.0784 8.2102 121.8909 55.3034 18.4316 179.2764 5 Y 3.8577 7.7863 114.0381 60.9994 37.8607 178.7882 6 V 3.6769 7.9101 118.6926 66.2517 31.7403 177.7980 7 D 4.3373 8.5493 118.9346 57.7190 40.6462 179.0027 8 T 3.8336 8.0109 115.8630 66.8728 68.4473 177.3994 9 S 4.1600 7.8834 114.9005 61.0421 63.5233 175.3758 10 L 4.3875 7.8500 120.7542 56.7458 42.0951 178.8035 11 L 4.6162 7.9772 120.3889 57.3243 41.5873 179.7058 12 G 3.9974 8.1379 105.4160 46.2492 0.0000 175.2172 13 T 4.0937 7.6777 111.3051 62.6721 69.0406 175.8574 14 G 3.9549 8.0204 108.6792 45.4399 0.0000 173.7862 15 K 4.4650 7.8311 116.6143 55.7156 34.1124 176.0598 16 I 4.6190 7.5690 120.1854 59.4909 39.3678 175.2368 17 D 4.7244 8.5552 125.1274 54.3838 40.6886 177.0545 18 R 4.5890 7.5845 117.3833 54.6266 34.6448 173.8253 19 A 5.2263 8.6540 122.8535 50.9164 23.3836 174.8153 20 A 5.2285 9.4213 120.1603 50.5614 23.6821 175.2747 21 I 4.8892 9.0848 120.3391 59.6054 40.3229 175.4118 22 V 4.4211 8.2144 119.8185 58.6807 35.7851 175.2574 23 S 2.8501 7.4309 117.6943 58.3231 62.6986 175.6220 24 R 3.6674 7.9937 125.3427 58.9042 29.9954 177.5954 25 A 4.0424 7.7923 118.9878 52.7498 18.7408 177.8213 26 G 3.8047 7.6902 103.6097 46.2523 0.0000 174.1619 27 D 4.6632 7.8102 117.5222 52.9606 40.4539 175.8287 28 S 4.4529 7.2676 112.8531 57.9248 65.0948 174.3512 29 V 4.3047 8.2565 121.4606 61.4720 31.9199 175.6863 30 W 4.7643 8.6437 127.9502 59.4052 29.8660 176.7377 31 A 4.7897 7.9826 117.7557 51.3185 21.8575 175.2016 32 A 5.2283 8.5846 120.8541 50.6078 22.5445 176.5533 33 S 4.4888 9.3486 115.9338 57.5854 64.8668 173.7363 34 A 4.1810 8.5234 124.3399 54.0400 18.3162 178.2942 35 G 3.9518 9.0928 111.0524 45.5807 0.0000 173.8594 36 F 4.7980 7.8255 122.4556 56.3804 38.1062 172.5531 37 N 4.6794 8.1325 121.8420 50.9371 39.7217 174.0574 38 L 4.5997 8.0370 124.1665 52.8368 43.1239 177.5105 39 S 4.3470 8.8028 119.5244 57.4560 65.1217 173.4375 40 P 4.2140 0.0000 0.0000 65.8542 31.1468 178.7773 41 Q 3.9493 7.9744 117.9030 59.0708 29.0502 178.0367 42 E 3.9359 8.0261 119.4085 59.4363 29.5394 179.4230 43 I 3.7598 7.7004 113.1496 63.9391 37.6649 178.2635 44 Q 4.0569 8.1285 120.0468 58.7306 28.4968 178.9674 45 G 3.5545 8.0027 106.5143 47.4825 0.0000 175.6699 46 L 3.7982 8.0322 122.4872 57.7821 42.2865 178.7501 47 A 4.1822 8.1887 120.6145 55.4089 18.3757 179.4789 48 A 4.1352 8.2600 119.2553 55.0469 18.0080 179.9618 49 G 3.4433 8.0382 104.4293 48.1918 0.0000 175.9859 50 F 4.2370 7.6162 118.6076 59.9893 38.9267 177.3140 51 Q 4.3465 7.5482 115.8056 57.1130 30.1431 176.0273 52 D 4.7737 7.7441 118.6272 50.9843 41.8394 173.5423 53 P 4.3312 0.0000 0.0000 64.2146 31.7075 176.3016 54 P 4.5639 0.0000 0.0000 65.2641 31.0922 178.6205 55 S 4.1891 7.9743 113.1595 61.4161 62.9468 176.3281 56 M 4.0554 7.7916 123.3208 57.3441 31.2707 178.6731 57 F 4.2471 7.7034 118.0417 60.2776 39.1528 177.0527 58 G 3.7988 8.0875 106.3945 48.8184 0.0000 174.8367 59 T 3.8872 7.8443 111.3840 61.8423 69.2563 175.8977 60 G 4.0175 7.8512 110.2841 45.3960 0.0000 171.8578 61 I 4.2655 8.0937 119.1849 59.5200 38.5045 175.1648 62 I 4.8353 8.3221 126.9893 59.6043 38.0879 175.2654 63 L 4.6282 8.6236 125.0837 54.1027 45.3222 176.7848 64 A 3.9823 9.1917 124.4195 52.1206 16.0762 177.6863 65 G 3.9096 8.9752 105.5466 46.7511 0.0000 173.6961 66 Q 4.4248 7.9417 120.4560 53.5667 31.5869 173.9445 67 K 4.9448 8.3286 126.0318 55.7374 33.5799 175.0415 68 Y 4.8048 8.8331 124.3746 55.8547 41.5183 175.1440 69 I 4.1838 8.6076 124.3011 61.6285 38.5403 175.6014 70 T 4.3076 8.7222 124.4258 63.9374 68.7264 174.9034 71 I 4.5204 8.9042 127.5132 62.0855 39.8003 176.3780 72 R 4.7978 7.7608 120.6861 54.5686 33.7137 174.1591 73 A 4.6357 8.4968 127.1693 50.9045 21.7817 174.7219 74 E 4.6842 9.5790 121.4436 54.8235 34.1437 176.8370 75 G 4.0814 8.9029 108.0381 48.7927 0.0000 174.6105 76 R 4.4650 8.0590 116.1436 55.4802 32.2047 175.2832 77 S 5.3645 8.0231 113.3282 56.7304 66.8531 173.1083 78 I 4.7800 9.1469 125.0961 59.8322 40.3133 174.0039 79 Y 5.4807 9.2127 125.5113 56.2461 41.1519 175.3439 80 G 4.7028 9.1680 109.1562 44.3365 0.0000 171.4268 81 K 5.1683 9.2553 119.6810 55.0149 36.5515 175.2290 82 L 4.8199 8.9620 123.8626 53.9177 43.6145 178.6531 83 Q 3.4145 8.7742 127.6439 56.9189 28.1720 175.8541 84 K 4.3491 8.9819 129.9171 57.6767 32.9624 175.4735 85 E 4.4572 7.7967 119.4985 54.8252 32.6491 174.8140 86 G 3.8182 5.9711 105.8817 46.0776 0.0000 172.1179 87 I 5.1270 7.4704 111.9039 58.9395 41.2820 174.5744 88 I 4.7369 9.0120 124.9115 59.7976 40.2000 174.1122 89 C 6.0332 9.1978 124.7140 57.1616 31.1674 173.2155 90 V 4.9854 8.4157 122.7611 60.9762 34.3592 173.9102 91 A 4.3263 8.5960 131.0217 51.6642 19.1054 177.2632 92 T 4.5079 8.2362 114.7000 60.2822 71.3909 174.1521 93 K 4.0564 8.4034 121.3636 59.5235 32.5200 178.8343 94 L 4.6531 7.8496 116.5875 54.7010 43.6368 174.9963 95 C 4.7812 8.0074 112.6910 56.3263 34.0164 172.8105 96 I 4.7616 8.3217 119.1235 59.3617 40.0424 175.0922 97 L 4.5435 8.7405 127.9480 54.0145 43.2566 175.9693 98 V 4.8505 9.1438 124.0951 61.2756 34.2765 174.2657 99 S 5.0513 9.3091 124.6953 57.0267 66.0396 172.6328 100 H 5.0692 9.2461 126.1544 54.9881 31.4463 173.3217 101 Y 5.1513 8.1438 123.7908 54.6124 41.0907 174.1101 102 P 4.9654 0.0000 0.0000 61.3017 33.4992 175.9367 103 E 4.1630 9.1860 117.9675 58.9464 29.1412 178.0080 104 T 4.2134 7.8954 105.8546 62.6168 69.5794 174.1730 105 T 4.6715 7.3734 113.0822 59.6446 70.7947 174.5995 106 L 4.0961 8.6261 125.1388 53.8840 42.5781 176.1653 107 P 3.2593 0.0000 0.0000 65.6616 31.1860 178.9630 108 G 3.6351 7.9453 103.5832 47.8745 0.0000 175.3161 109 E 3.8562 7.9199 120.2676 59.1625 29.6378 179.3779 110 A 3.8436 7.5127 120.0008 54.7986 18.4578 179.2820 111 A 3.5670 7.9324 119.6392 55.0487 18.4789 179.4129 112 K 3.7373 7.9585 118.0540 59.9123 32.1565 178.8143 113 I 3.6490 7.6087 119.5647 64.8540 37.1057 178.4697 114 T 3.9802 7.8195 113.3641 64.7888 67.1500 176.2529 115 E 4.0205 8.7801 121.0949 59.2204 29.4716 179.1626 116 A 4.0184 8.0937 120.7157 55.2465 18.5781 179.4469 117 L 3.9885 8.1943 118.6540 58.0796 41.9891 179.1771 118 A 4.0406 8.0163 120.8533 55.3873 18.4529 179.2654 119 D 4.3914 8.2779 117.4060 57.5671 40.8720 178.3034 120 Y 4.0717 8.2903 119.9790 60.9850 38.8138 178.3293 121 L 4.1178 8.3622 119.6698 57.8278 41.8064 179.7618 122 V 3.7181 8.4374 118.7132 66.0121 31.2738 178.1537 123 G 3.6684 8.3772 104.5028 48.0312 0.0000 175.4526 124 V 3.8037 7.6317 119.2807 63.8461 31.5489 176.6335 125 G 4.0722 7.3500 106.0067 45.4860 0.0000 173.4110 126 Y 4.3650 8.9131 124.2369 57.8840 38.2490 175.6003 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 S 8.19 4.31 0.00 4.05 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 2 W 8.40 4.42 0.00 3.64 3.42 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 3 Q 8.76 4.14 0.00 2.28 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.90 0.00 0.00 0.00 0.00 0.00 2.49 2.72 0.00 4 A 8.21 4.08 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 5 Y 7.79 3.86 0.00 3.46 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 6 V 7.91 3.68 2.35 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 1.23 0.00 0.00 1.10 0.00 0.00 7 D 8.55 4.34 0.00 2.69 2.69 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 8 T 8.01 3.83 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 1.12 0.00 0.00 9 S 7.88 4.16 0.00 4.11 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 10 L 7.85 4.39 0.00 1.95 1.66 1.01 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 11 L 7.98 4.62 0.00 1.89 1.72 0.92 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 12 G 8.14 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 13 T 7.68 4.09 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 1.26 0.00 0.00 14 G 8.02 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 0.00 0.00 0.00 15 K 7.83 4.46 0.00 1.73 1.78 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.79 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.34 1.47 7.81 16 I 7.57 4.62 2.04 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 1.49 1.50 1.00 0.00 0.00 17 D 8.56 4.72 0.00 2.68 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 18 R 7.58 4.59 0.00 0.95 0.66 0.00 2.84 0.00 0.00 3.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.36 0.00 19 A 8.65 5.23 1.27 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 20 A 9.42 5.23 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 21 I 9.08 4.89 1.95 0.00 0.00 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 1.29 1.11 0.57 0.00 0.00 22 V 8.21 4.42 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 0.56 0.00 0.00 0.73 0.00 0.00 23 S 7.43 2.85 0.00 3.58 3.50 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 0.00 0.00 0.00 0.00 24 R 7.99 3.67 0.00 1.81 1.82 0.00 3.36 0.00 0.00 3.08 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.67 0.00 25 A 7.79 4.04 1.27 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 26 G 7.69 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 27 D 7.81 4.66 0.00 2.80 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 28 S 7.27 4.45 0.00 4.05 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 29 V 8.26 4.30 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 0.92 0.00 0.00 0.87 0.00 0.00 30 W 8.64 4.76 0.00 3.09 2.81 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 31 A 7.98 4.79 1.44 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 0.00 0.00 32 A 8.58 5.23 1.32 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 0.00 0.00 0.00 33 S 9.35 4.49 0.00 3.92 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 34 A 8.52 4.18 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 35 G 9.09 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 0.00 0.00 0.00 36 F 7.83 4.80 0.00 2.93 3.16 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 0.00 37 N 8.13 4.68 0.00 2.73 2.68 0.00 0.00 6.92 6.74 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 38 L 8.04 4.60 0.00 1.46 1.44 0.75 0.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 0.00 0.00 0.00 0.00 0.00 0.00 39 S 8.80 4.35 0.00 4.01 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 40 P 0.00 4.21 0.00 2.16 2.13 0.00 3.57 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 2.10 2.13 0.00 41 Q 7.97 3.95 0.00 2.09 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.92 0.00 0.00 0.00 0.00 0.00 2.40 2.43 0.00 42 E 8.03 3.94 0.00 2.17 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 0.00 2.43 2.28 0.00 43 I 7.70 3.76 1.78 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 1.66 0.79 0.82 0.00 0.00 44 Q 8.13 4.06 0.00 2.18 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.57 0.00 45 G 8.00 3.55 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 0.00 0.00 0.00 46 L 8.03 3.80 0.00 1.73 1.80 0.68 0.91 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 47 A 8.19 4.18 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 48 A 8.26 4.14 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 49 G 8.04 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 0.00 0.00 0.00 50 F 7.62 4.24 0.00 3.13 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 51 Q 7.55 4.35 0.00 2.28 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.03 7.21 0.00 0.00 0.00 0.00 0.00 2.40 2.42 0.00 52 D 7.74 4.77 0.00 2.70 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 53 P 0.00 4.33 0.00 2.19 2.00 0.00 3.94 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 2.13 2.27 0.00 54 P 0.00 4.56 0.00 2.20 2.17 0.00 3.81 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 2.14 2.19 0.00 55 S 7.97 4.19 0.00 4.00 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 56 M 7.79 4.06 0.00 1.79 1.96 0.00 0.00 0.00 0.00 0.00 1.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.40 0.00 57 F 7.70 4.25 0.00 3.12 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 58 G 8.09 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 59 T 7.84 3.89 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 1.25 0.00 0.00 60 G 7.85 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 0.00 0.00 0.00 61 I 8.09 4.27 1.95 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 1.18 0.73 0.87 0.00 0.00 62 I 8.32 4.84 1.87 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 1.42 0.56 0.96 0.00 0.00 63 L 8.62 4.63 0.00 1.83 1.49 0.90 0.39 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 64 A 9.19 3.98 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 65 G 8.98 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 66 Q 7.94 4.42 0.00 2.02 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.84 0.00 0.00 0.00 0.00 0.00 1.81 1.45 0.00 67 K 8.33 4.94 0.00 1.76 1.60 0.00 1.76 0.00 0.00 1.70 0.00 0.00 3.07 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.37 1.47 7.81 68 Y 8.83 4.80 0.00 2.85 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 69 I 8.61 4.18 1.95 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 1.23 0.73 1.00 0.00 0.00 70 T 8.72 4.31 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 0.33 0.00 0.00 71 I 8.90 4.52 2.03 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.98 1.08 0.00 0.00 72 R 7.76 4.80 0.00 1.71 1.21 0.00 2.21 0.00 0.00 3.00 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.44 0.00 73 A 8.50 4.64 0.75 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 74 E 9.58 4.68 0.00 1.93 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 2.21 2.17 0.00 75 G 8.90 4.08 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 R 8.06 4.47 0.00 1.84 1.91 0.00 3.36 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.54 0.00 77 S 8.02 5.36 0.00 3.81 3.50 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 0.00 0.00 0.00 0.00 78 I 9.15 4.78 1.55 0.00 0.00 -0.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.51 0.66 0.00 0.00 79 Y 9.21 5.48 0.00 2.79 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 80 G 9.17 4.70 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 0.00 0.00 0.00 81 K 9.26 5.17 0.00 1.88 2.00 0.00 1.34 0.00 0.00 1.67 0.00 0.00 2.88 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.40 1.42 7.81 82 L 8.96 4.82 0.00 1.67 1.56 0.77 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.77 3.41 0.00 2.24 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.90 6.69 0.00 0.00 0.00 0.00 0.00 2.27 2.35 0.00 84 K 8.98 4.35 0.00 1.85 1.89 0.00 1.67 0.00 0.00 1.84 0.00 0.00 2.99 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.52 1.48 7.81 85 E 7.80 4.46 0.00 1.99 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 2.31 2.24 0.00 86 G 5.97 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 0.00 0.00 0.00 87 I 7.47 5.13 1.65 0.00 0.00 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.06 -0.36 0.76 0.00 0.00 88 I 9.01 4.74 1.81 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.68 0.68 0.00 0.00 89 C 9.20 6.03 0.00 3.14 3.08 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 0.00 0.00 0.00 0.00 90 V 8.42 4.99 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 1.21 0.00 0.00 1.19 0.00 0.00 91 A 8.60 4.33 0.33 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 92 T 8.24 4.51 4.42 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 1.30 0.00 0.00 93 K 8.40 4.06 0.00 1.75 1.97 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.14 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.45 1.40 7.81 94 L 7.85 4.65 0.00 2.03 2.03 1.06 0.85 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 95 C 8.01 4.78 0.00 2.25 2.45 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 0.00 96 I 8.32 4.76 1.71 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 0.77 0.43 0.99 0.00 0.00 97 L 8.74 4.54 0.00 1.63 1.63 1.04 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 98 V 9.14 4.85 2.31 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 1.25 0.00 0.00 0.96 0.00 0.00 99 S 9.31 5.05 0.00 3.75 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 0.00 100 H 9.25 5.07 0.00 2.96 2.93 0.00 5.72 0.00 0.00 0.00 0.00 6.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 Y 8.14 5.15 0.00 3.08 2.91 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 0.00 102 P 0.00 4.97 0.00 2.27 2.43 0.00 3.95 0.00 0.00 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 1.97 0.00 103 E 9.19 4.16 0.00 1.97 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 0.00 2.33 2.32 0.00 104 T 7.90 4.21 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 1.23 0.00 0.00 105 T 7.37 4.67 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 1.40 0.00 0.00 106 L 8.63 4.10 0.00 1.64 1.53 0.89 0.82 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 0.00 107 P 0.00 3.26 0.00 2.05 2.06 0.00 3.54 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 2.14 2.29 0.00 108 G 7.95 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 0.00 109 E 7.92 3.86 0.00 1.99 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 2.26 2.31 0.00 110 A 7.51 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 111 A 7.93 3.57 1.01 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 0.00 0.00 112 K 7.96 3.74 0.00 1.87 2.06 0.00 1.53 0.00 0.00 1.65 0.00 0.00 3.03 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.42 1.53 7.81 113 I 7.61 3.65 1.83 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.49 0.90 0.00 0.00 114 T 7.82 3.98 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 1.24 0.00 0.00 115 E 8.78 4.02 0.00 2.19 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 2.60 2.61 0.00 116 A 8.09 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 0.00 117 L 8.19 3.99 0.00 1.82 1.76 1.06 1.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 118 A 8.02 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 119 D 8.28 4.39 0.00 2.93 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 0.00 120 Y 8.29 4.07 0.00 3.22 3.25 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 0.00 121 L 8.36 4.12 0.00 2.05 1.89 1.01 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 122 V 8.44 3.72 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 1.02 0.00 0.00 1.00 0.00 0.00 123 G 8.38 3.67 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 0.00 0.00 0.00 124 V 7.63 3.80 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 1.00 0.00 0.00 0.50 0.00 0.00 125 G 7.35 4.07 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 0.00 126 Y 8.91 4.37 0.00 3.21 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