NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.3729 8.1776 115.2783 57.8358 63.7427 174.6620 2 I 3.2644 8.0222 121.1671 63.2212 37.5822 176.6901 3 Q 4.0190 8.0268 120.8189 58.1244 29.6260 178.1772 4 A 4.1558 7.4168 119.8003 53.5059 19.3562 177.7743 5 E 3.6013 7.5440 117.2133 55.8540 29.6421 178.1697 6 E 3.8341 8.2561 121.6018 58.4415 29.9596 177.5693 7 W 4.6002 6.8694 115.0889 56.5422 28.8465 174.8828 8 Y 5.0039 7.6311 122.3083 56.9751 37.3908 175.2157 9 F 4.4661 9.1137 126.1439 56.5050 40.5635 178.1164 10 G 3.5099 5.5726 111.6818 46.7180 0.0000 176.5948 11 K 4.4828 8.6346 120.1952 54.4114 30.2484 175.0064 12 I 4.6479 7.4389 114.7311 58.1039 41.0375 176.8371 13 T 4.3817 8.0401 112.2825 60.8086 71.3676 175.7322 14 R 3.7889 9.0967 121.7931 59.5868 29.9915 178.5751 15 R 3.8700 7.8955 117.9658 59.4758 30.1676 177.9789 16 E 3.9750 8.0122 119.5449 59.1773 29.6078 178.9282 17 S 4.0947 8.1231 114.5130 61.3607 63.0468 176.3795 18 E 4.0132 8.2957 122.2880 58.9256 28.9479 179.1902 19 R 3.8762 7.8235 118.2436 59.4493 30.2554 178.3292 20 L 4.1387 7.7768 117.6566 57.6320 41.7102 179.0009 21 L 4.2114 7.7462 117.5198 56.0807 42.9048 177.5306 22 L 4.3941 7.8379 120.9707 54.0214 40.9232 176.2151 23 N 4.9328 7.5440 117.3961 51.2362 41.5766 174.7543 24 A 4.0558 8.7729 128.0752 55.2125 18.5180 178.2419 25 E 4.1807 8.7794 114.1469 57.8258 29.9947 176.8717 26 N 4.4315 8.0219 117.9150 52.4026 38.8570 173.4065 27 P 4.5820 0.0000 0.0000 61.1653 32.9278 175.8602 28 R 3.8200 8.1636 117.7858 58.1917 30.3134 177.4281 29 G 4.1376 9.2257 109.9170 46.5382 0.0000 173.2070 30 T 4.7872 7.6228 117.4576 63.8671 69.8426 173.5504 31 F 5.7941 9.0935 119.2696 56.6935 42.1841 172.4189 32 L 4.6409 8.2562 117.0059 54.8689 43.4225 173.8339 33 V 5.2332 9.1533 120.5456 61.4004 34.5968 174.6751 34 R 4.9192 9.0937 122.9617 54.6918 33.5419 173.7750 35 E 4.7273 8.9385 118.7645 56.1983 30.2647 177.2587 36 S 4.3149 8.1408 117.8200 58.2388 62.6107 174.3154 37 E 4.1592 9.0666 126.8071 58.9479 29.5314 177.8763 38 T 4.3323 7.7922 106.0456 61.8318 70.8417 173.9896 39 T 4.3129 8.0251 120.2636 61.4463 68.3993 174.3057 40 K 4.0172 8.3878 126.6724 57.8097 33.2571 177.5761 41 G 3.7065 8.7865 108.7728 45.6005 0.0000 172.6716 42 A 4.8344 7.3588 121.1012 50.1791 22.4882 175.5119 43 Y 4.8906 8.8120 117.0009 56.3731 42.3076 174.3426 44 C 5.2987 9.5293 116.9574 58.2754 32.6520 173.5662 45 L 4.9748 9.3801 126.2818 53.8722 43.2321 174.9427 46 S 5.1267 8.8776 123.8418 57.2754 64.8799 173.7739 47 V 5.1030 8.8345 124.7866 61.0441 34.7571 174.8080 48 S 4.9831 9.3141 122.9617 58.2880 65.0368 172.4491 49 D 5.2147 9.0479 120.8695 53.1674 45.5700 173.5490 50 F 5.5112 8.7621 119.5955 58.2035 42.2429 172.4479 51 D 4.6205 7.3438 123.7827 52.0595 42.2992 176.0014 52 N 4.4070 8.7255 116.2872 55.8733 38.6013 176.6696 53 A 4.0878 7.7121 120.8773 54.6305 18.9203 178.6578 54 K 4.0507 8.9456 115.0267 56.4441 33.6153 179.8674 55 G 3.2921 7.9073 108.1032 45.2209 0.0000 172.1744 56 L 4.9493 8.5657 125.1541 55.0228 42.8740 176.9174 57 N 5.0988 9.0119 122.5581 51.8609 41.4207 173.1016 58 V 4.9365 8.2590 117.9580 61.0374 34.7220 174.5080 59 K 4.5866 8.7045 124.0531 54.7648 36.1722 174.8204 60 H 5.1188 8.1810 118.9809 54.1707 31.8972 172.4487 61 Y 4.7164 8.6449 120.8518 55.8645 40.8919 174.7450 62 K 4.7338 8.7686 125.4240 56.0155 34.0066 175.2132 63 I 4.7355 8.8499 129.3115 60.2341 38.5639 175.2141 64 R 4.5929 8.9786 127.2669 54.8195 32.1941 175.7094 65 K 4.5069 8.0779 122.2176 54.5992 34.7791 175.9483 66 L 4.4009 8.6545 127.8167 54.1409 42.6427 177.5679 67 D 4.5213 8.3789 119.4536 56.3225 41.1197 178.0067 68 S 4.2350 7.8707 114.1196 59.3566 63.1754 173.8486 69 G 4.0973 8.0060 108.4466 45.4328 0.0000 174.7479 70 G 4.0486 7.9695 105.7144 46.0713 0.0000 172.7408 71 F 5.5789 9.0894 119.9906 55.9075 42.4040 174.2355 72 Y 5.1004 8.5332 117.8602 57.4784 41.0099 174.7796 73 I 4.3274 9.0949 120.2460 62.2449 38.5382 176.1839 74 T 4.7392 7.8413 114.6680 59.7195 69.0449 174.8406 75 S 2.7900 8.5977 123.2738 60.6722 62.9563 175.9097 76 R 3.8639 7.3752 118.5357 58.3630 29.8218 176.5415 77 T 4.0822 7.6849 114.5561 61.4184 68.6341 173.2796 78 Q 4.7316 7.5466 124.1018 54.1649 31.3055 175.1016 79 F 4.9510 8.4831 116.7725 56.2363 43.0577 175.5874 80 N 4.8287 8.4274 119.9797 54.2698 38.8638 175.7960 81 S 4.3280 7.5225 111.9450 56.1520 66.3970 176.3058 82 L 3.4066 6.9180 124.1107 58.2198 41.8879 178.9648 83 Q 4.1751 8.0124 117.4788 59.4196 28.6375 179.0555 84 Q 3.9384 7.9821 118.8047 58.5343 28.6322 178.5440 85 L 2.4400 7.3816 121.3600 57.5454 42.2378 179.0084 86 V 3.1763 7.6493 118.2470 65.9334 31.0864 177.6902 87 A 3.8647 7.5173 118.8305 55.2732 18.4585 178.6284 88 Y 3.9315 7.7836 117.9669 60.9979 38.8277 177.5949 89 Y 4.4844 7.7534 117.3823 59.0739 37.8237 177.4322 90 S 4.5163 7.3926 116.3731 58.8952 63.2104 174.4141 91 K 4.2606 7.5063 120.9266 56.1324 33.9587 175.5804 92 H 4.7156 7.4102 114.9945 53.6536 32.1268 174.1301 93 A 4.0791 8.7351 126.8890 54.5704 19.8584 179.4716 94 D 4.3771 7.7676 112.8341 55.9542 40.1135 175.6078 95 G 3.9164 8.9539 116.9784 46.5211 0.0000 173.5706 96 L 3.8360 7.8626 121.3243 53.9007 42.2177 177.9571 97 C 3.9471 8.7054 116.0220 61.0850 29.7693 173.3190 98 H 4.3839 7.0294 117.0378 55.1571 32.7887 173.6977 99 R 4.1394 7.5297 120.3035 55.5424 30.1644 175.9871 100 L 4.2606 8.5334 121.3288 55.4385 41.9283 176.6945 101 T 4.4060 9.3583 113.7172 63.0083 70.5187 174.6620 102 T 4.8011 7.8179 116.7256 59.0410 71.1117 172.5518 103 V 3.3331 8.5719 128.5841 62.7152 32.2408 174.9554 104 C 4.0362 8.6751 129.1279 59.2727 31.6134 171.9675 105 P 4.5239 0.0000 0.0000 62.7947 31.8098 176.5274 106 T 4.2893 8.3734 116.0313 64.0768 68.4863 174.9388 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 8.18 4.37 0.00 3.83 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 0.00 2 I 8.02 3.26 1.36 0.00 0.00 0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 -0.36 0.75 0.00 0.00 3 Q 8.03 4.02 0.00 2.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.10 0.00 0.00 0.00 0.00 0.00 2.21 2.24 0.00 4 A 7.42 4.16 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 5 E 7.54 3.60 0.00 1.16 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 1.96 1.47 0.00 6 E 8.26 3.83 0.00 1.98 1.97 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 2.31 2.26 0.00 7 W 6.87 4.60 0.00 3.56 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 8 Y 7.63 5.00 0.00 2.86 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 9 F 9.11 4.47 0.00 2.75 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 10 G 5.57 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 0.00 0.00 0.00 11 K 8.63 4.48 0.00 1.95 1.78 0.00 1.75 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.43 1.56 7.81 12 I 7.44 4.65 1.90 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 1.51 0.86 1.02 0.00 0.00 13 T 8.04 4.38 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 1.21 0.00 0.00 14 R 9.10 3.79 0.00 1.75 2.00 0.00 2.51 0.00 0.00 2.90 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.32 0.00 15 R 7.90 3.87 0.00 1.90 1.90 0.00 3.23 0.00 0.00 3.26 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.68 0.00 16 E 8.01 3.97 0.00 2.08 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 0.00 2.33 2.38 0.00 17 S 8.12 4.09 0.00 4.04 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 18 E 8.30 4.01 0.00 2.23 2.04 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 2.37 2.50 0.00 19 R 7.82 3.88 0.00 1.93 2.09 0.00 3.27 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.67 0.00 20 L 7.78 4.14 0.00 1.73 1.66 0.97 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 21 L 7.75 4.21 0.00 1.60 1.70 0.88 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 22 L 7.84 4.39 0.00 1.74 1.66 0.95 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 23 N 7.54 4.93 0.00 2.68 2.63 0.00 0.00 6.91 7.86 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 24 A 8.77 4.06 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 25 E 8.78 4.18 0.00 2.03 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 2.31 2.26 0.00 26 N 8.02 4.43 0.00 2.84 2.77 0.00 0.00 6.97 7.29 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 27 P 0.00 4.58 0.00 2.15 2.02 0.00 3.78 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 1.98 0.00 28 R 8.16 3.82 0.00 1.47 1.72 0.00 3.34 0.00 0.00 3.26 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.65 0.00 29 G 9.23 4.14 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 30 T 7.62 4.79 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 1.21 0.00 0.00 31 F 9.09 5.79 0.00 3.24 3.12 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 32 L 8.26 4.64 0.00 1.16 1.10 0.71 -0.27 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 33 V 9.15 5.23 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 1.37 0.00 0.00 1.08 0.00 0.00 34 R 9.09 4.92 0.00 2.00 1.97 0.00 3.01 0.00 0.00 3.15 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.67 0.00 35 E 8.94 4.73 0.00 1.95 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 2.49 2.51 0.00 36 S 8.14 4.31 0.00 3.87 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 37 E 9.07 4.16 0.00 1.98 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 2.31 2.28 0.00 38 T 7.79 4.33 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 39 T 8.03 4.31 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 1.19 0.00 0.00 40 K 8.39 4.02 0.00 1.83 1.79 0.00 1.65 0.00 0.00 1.69 0.00 0.00 3.00 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.37 1.36 7.81 41 G 8.79 3.71 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 0.00 0.00 0.00 42 A 7.36 4.83 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 43 Y 8.81 4.89 0.00 3.17 3.19 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 0.00 44 C 9.53 5.30 0.00 2.88 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 45 L 9.38 4.97 0.00 1.79 1.71 1.05 0.66 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 46 S 8.88 5.13 0.00 3.80 3.71 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 47 V 8.83 5.10 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 1.10 0.00 0.00 1.12 0.00 0.00 48 S 9.31 4.98 0.00 3.92 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 49 D 9.05 5.21 0.00 2.78 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 50 F 8.76 5.51 0.00 3.07 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 51 D 7.34 4.62 0.00 2.66 2.63 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 0.00 52 N 8.73 4.41 0.00 2.70 2.90 0.00 0.00 6.91 7.35 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 53 A 7.71 4.09 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 K 8.95 4.05 0.00 1.58 1.80 0.00 1.77 0.00 0.00 1.67 0.00 0.00 2.96 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.40 1.32 7.81 55 G 7.91 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 0.00 0.00 0.00 56 L 8.57 4.95 0.00 1.97 1.72 1.09 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 57 N 9.01 5.10 0.00 2.84 2.83 0.00 0.00 5.94 7.60 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 58 V 8.26 4.94 2.04 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 0.67 0.00 0.00 0.92 0.00 0.00 59 K 8.70 4.59 0.00 1.62 1.16 0.00 1.62 0.00 0.00 1.54 0.00 0.00 2.84 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.30 1.58 7.81 60 H 8.18 5.12 0.00 2.85 3.10 0.00 5.64 0.00 0.00 0.00 0.00 6.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 Y 8.64 4.72 0.00 2.94 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 62 K 8.77 4.73 0.00 1.88 1.73 0.00 1.72 0.00 0.00 1.82 0.00 0.00 2.86 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.50 1.62 7.81 63 I 8.85 4.74 2.19 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 1.33 0.76 1.20 0.00 0.00 64 R 8.98 4.59 0.00 0.67 1.54 0.00 3.19 0.00 0.00 3.09 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.67 0.00 65 K 8.08 4.51 0.00 1.41 1.51 0.00 0.84 0.00 0.00 0.61 0.00 0.00 2.74 0.00 0.00 2.67 0.00 0.00 0.00 0.00 1.07 1.22 7.81 66 L 8.65 4.40 0.00 1.79 1.61 1.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 0.00 0.00 0.00 0.00 0.00 0.00 67 D 8.38 4.52 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 68 S 7.87 4.23 0.00 3.86 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 69 G 8.01 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 0.00 0.00 0.00 0.00 70 G 7.97 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 71 F 9.09 5.58 0.00 3.18 3.09 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 72 Y 8.53 5.10 0.00 3.38 3.14 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 0.00 0.00 0.00 0.00 73 I 9.09 4.33 1.91 0.00 0.00 0.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.40 0.95 0.00 0.00 74 T 7.84 4.74 4.33 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 1.31 0.00 0.00 75 S 8.60 2.79 0.00 3.46 3.41 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 76 R 7.38 3.86 0.00 1.80 1.96 0.00 3.18 0.00 0.00 3.16 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.70 0.00 77 T 7.68 4.08 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 0.72 0.00 0.00 78 Q 7.55 4.73 0.00 1.85 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.91 6.79 0.00 0.00 0.00 0.00 0.00 2.12 2.20 0.00 79 F 8.48 4.95 0.00 3.35 2.93 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 80 N 8.43 4.83 0.00 3.32 2.97 0.00 0.00 6.80 7.45 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 81 S 7.52 4.33 0.00 3.88 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 82 L 6.92 3.41 0.00 1.07 1.54 0.80 0.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 83 Q 8.01 4.18 0.00 2.21 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.38 6.68 0.00 0.00 0.00 0.00 0.00 2.57 2.91 0.00 84 Q 7.98 3.94 0.00 2.30 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.19 6.81 0.00 0.00 0.00 0.00 0.00 2.41 2.38 0.00 85 L 7.38 2.44 0.00 1.64 1.63 1.23 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.65 3.18 1.64 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 0.26 0.00 0.00 0.07 0.00 0.00 87 A 7.52 3.86 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 88 Y 7.78 3.93 0.00 2.83 2.38 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 89 Y 7.75 4.48 0.00 2.95 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 90 S 7.39 4.52 0.00 3.91 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 91 K 7.51 4.26 0.00 1.44 1.32 0.00 1.52 0.00 0.00 1.60 0.00 0.00 3.02 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.15 1.22 7.81 92 H 7.41 4.72 0.00 2.67 3.09 0.00 5.67 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 A 8.74 4.08 1.25 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 0.00 0.00 94 D 7.77 4.38 0.00 3.10 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 0.00 0.00 0.00 95 G 8.95 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 96 L 7.86 3.84 0.00 1.63 1.24 0.36 -0.37 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 97 C 8.71 3.95 0.00 3.34 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 98 H 7.03 4.38 0.00 2.95 3.18 0.00 5.75 0.00 0.00 0.00 0.00 6.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 99 R 7.53 4.14 0.00 2.04 1.92 0.00 3.12 0.00 0.00 3.24 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.59 0.00 100 L 8.53 4.26 0.00 1.18 0.32 0.14 0.34 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 0.00 101 T 9.36 4.41 4.30 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 1.34 0.00 0.00 102 T 7.82 4.80 4.30 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 1.27 0.00 0.00 103 V 8.57 3.33 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 0.91 0.00 0.00 1.08 0.00 0.00 104 C 8.68 4.04 0.00 2.83 2.47 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 0.00 105 P 0.00 4.52 0.00 2.10 1.99 0.00 3.73 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.12 0.00 106 T 8.37 4.29 4.24 0.00 0.00 0.00 0.00 0.00 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