NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 S 4.4392 8.2929 115.2992 58.0045 63.7389 175.1720 3 R 3.8757 8.6278 129.9438 60.9881 29.3524 173.9593 4 A 4.2717 8.1777 121.0762 54.6252 18.7723 179.2008 5 K 3.8555 7.9578 117.8887 59.6994 32.3689 178.8106 6 R 3.9077 7.8471 118.5351 59.6226 29.8176 178.3555 7 I 3.7666 7.6738 118.8788 64.8225 37.1868 178.2338 8 M 4.2738 8.2867 121.8652 59.1659 31.7279 179.6082 9 K 4.0528 8.4303 123.8710 59.7528 31.6225 180.7556 10 E 4.1957 8.2190 118.8647 59.6706 29.3452 179.5121 11 I 3.6324 7.4812 119.8549 64.4522 37.0770 178.3490 12 Q 3.9784 8.1966 120.1823 58.9708 28.6374 177.9212 13 A 3.9748 8.1148 121.4834 55.2231 18.5628 179.4974 14 V 3.6892 7.6119 116.7946 66.1043 31.3932 178.5123 15 K 4.0383 7.7197 116.9681 59.2735 31.9737 178.5595 16 D 4.6037 8.2992 117.7455 55.0798 42.5567 176.0308 17 D 4.9655 7.6053 119.5217 51.4168 41.1743 174.1560 18 P 4.2344 0.0000 0.0000 65.4752 31.9247 179.4550 19 A 4.0769 7.9875 120.3055 54.5220 18.4498 178.2238 20 A 4.1210 7.9777 117.8673 53.4292 18.6931 177.0464 21 H 3.9853 7.8495 111.7165 57.2284 26.7956 174.5412 22 I 4.9704 7.7817 118.0239 59.8481 39.6289 175.9294 23 T 4.7334 8.5861 115.0523 59.7917 72.0679 172.5237 24 L 5.0828 8.4118 124.8726 53.5189 44.8941 175.1906 25 E 4.7086 9.0485 124.9387 54.3236 33.9646 175.2937 26 F 4.4571 8.6737 121.0784 57.9099 39.5062 175.7597 27 V 3.8519 8.4207 122.0506 64.7046 31.8308 175.9177 28 S 4.8131 7.5543 111.8779 55.9365 66.3673 174.2863 29 E 3.9288 8.9544 117.7983 59.1046 29.0962 178.0606 30 S 4.5327 7.9057 111.2991 57.5408 63.9286 172.8283 31 D 4.6415 7.7254 121.6390 53.2838 41.2044 175.8967 32 I 4.1588 8.3453 126.3381 62.2871 38.8656 175.4412 33 H 4.6348 8.3517 115.6914 56.3899 30.2873 173.9940 34 H 5.3306 8.3438 119.6903 54.5341 31.7756 172.8995 35 L 5.3232 9.1461 125.2256 52.8227 46.5685 175.4509 36 K 4.9236 9.0599 119.2933 54.6945 35.1549 176.0076 37 G 4.5680 9.1934 112.5344 44.5649 0.0000 172.1872 38 T 5.9817 9.1139 111.7582 58.5714 72.4726 172.6897 39 F 5.4123 8.2029 117.0357 55.5125 42.1409 172.9362 40 L 5.1464 8.7640 118.6631 52.8814 43.5614 177.0644 41 G 4.2994 9.2018 110.4326 45.6925 0.0000 171.9905 42 P 4.6372 0.0000 0.0000 61.6937 32.0566 174.6015 43 P 4.5514 0.0000 0.0000 64.0777 31.9372 176.3498 44 G 3.9565 9.3877 108.2426 46.1954 0.0000 173.1822 45 T 4.8273 7.4201 108.6247 58.5188 72.1311 172.7513 46 P 4.3173 0.0000 0.0000 64.6236 31.5133 176.9457 47 Y 5.0203 7.5671 115.8890 57.2035 38.4662 175.1568 48 E 4.2793 7.9481 122.0618 57.6571 30.1379 176.8920 49 G 4.0302 9.1895 113.8544 45.0168 0.0000 173.6549 50 G 3.7537 7.9059 107.1194 45.1560 0.0000 172.7730 51 K 4.8660 7.9124 123.6192 54.3111 34.1824 175.1590 52 F 4.7060 8.7203 126.8382 55.7165 41.4782 174.7809 53 V 4.7099 9.0509 123.9246 61.2179 33.6418 174.4365 54 V 4.5530 8.9452 127.9677 60.8678 34.2797 173.8623 55 D 4.8227 9.3626 128.8846 54.1061 42.6722 174.8089 56 I 4.9554 9.1431 129.0024 60.1046 40.6857 174.7848 57 E 5.0698 9.1586 125.7197 54.8665 32.3615 171.8640 58 V 4.2637 8.4164 120.1207 58.1935 33.0235 175.1506 59 P 4.4647 0.0000 0.0000 62.3040 32.1261 176.9944 60 M 4.0677 8.5076 118.5669 58.3194 32.3424 176.6639 61 E 4.5178 8.0879 116.1729 55.9729 30.1978 175.1293 62 Y 4.1939 7.7078 121.0265 57.6643 39.1240 173.9440 63 P 3.2396 0.0000 0.0000 62.5360 31.3103 176.5785 64 F 4.8751 7.6050 117.2571 58.1164 39.5418 175.9416 65 K 4.6966 7.6386 119.6280 53.2372 34.8799 174.1712 66 P 2.9700 0.0000 0.0000 61.5478 31.7890 174.0593 67 P 4.3476 0.0000 0.0000 62.0450 32.9962 175.2021 68 K 4.2937 8.9793 123.4604 55.7882 33.2613 175.1096 69 M 5.2571 8.5094 126.8983 53.7199 34.9677 175.5233 70 Q 4.7379 8.7488 121.2835 54.2171 33.5194 174.1778 71 F 4.3497 9.1991 123.4597 58.4300 39.3904 176.0663 72 D 4.4923 9.3181 125.0432 57.4562 41.4404 177.9785 73 T 3.9690 8.0832 114.7215 63.3690 68.9113 173.6838 74 K 4.2405 8.6463 128.1494 56.1091 32.5602 176.0769 75 V 4.7708 8.4621 124.8918 61.3302 34.5091 173.6341 76 Y 3.8924 8.6310 127.3419 56.4352 38.4049 173.9143 77 H 4.9631 7.9043 125.0054 54.0900 33.2389 172.4201 78 P 3.9832 0.0000 0.0000 65.3482 31.3818 177.3959 79 N 4.7470 7.9884 112.8378 52.6335 38.8829 173.7621 80 I 4.9089 7.3926 118.5890 59.1070 40.8909 175.2771 81 S 4.2905 8.9300 120.9381 58.2321 62.4548 175.0751 82 S 4.7019 9.1731 122.6387 59.7821 63.2237 175.0120 83 V 4.1858 7.9658 119.7707 64.4084 32.3836 176.2398 84 T 4.3305 8.1379 106.9530 60.9454 70.1860 175.5494 85 G 4.0939 8.5715 109.3437 46.1511 0.0000 172.9413 86 A 4.4906 7.7421 121.9302 52.0815 19.5272 177.0781 87 I 4.8312 8.3561 120.7549 59.6821 40.3114 175.1851 88 C 4.6136 8.7433 126.9903 58.0231 32.3594 172.6894 89 L 4.5816 8.0708 127.4863 53.3410 45.1520 175.8407 90 D 4.4280 9.0473 126.1491 56.4996 39.4161 178.6638 91 I 3.9380 7.7446 111.6252 62.7749 37.7930 176.4462 92 L 4.3230 7.9110 121.5425 55.7167 42.1327 177.3239 93 K 4.2749 7.9545 118.8373 53.8563 33.4838 181.4091 94 N 4.9616 8.7370 117.7876 53.3994 40.6723 175.1735 95 A 4.7432 7.8474 120.5253 51.4758 19.6611 176.7226 96 W 4.4979 8.1349 128.3954 58.8462 31.7917 175.3164 97 S 4.4203 6.4700 116.2603 55.8079 64.8976 173.0309 98 P 4.3599 0.0000 0.0000 64.3617 31.2620 177.9342 99 V 3.6983 6.8862 110.9440 62.9234 31.8181 176.6383 100 I 3.6950 6.7771 121.8867 60.9385 37.4008 176.3306 101 T 4.6552 8.0511 115.6495 60.2118 72.0696 175.9716 102 L 4.0800 8.9263 121.3941 57.5533 41.4022 179.8139 103 K 3.9115 8.0738 119.5677 59.7047 32.2539 178.8758 104 S 4.1172 8.2313 114.0595 61.0189 63.1129 176.1907 105 A 4.0385 8.3681 124.9217 55.0388 18.2186 179.5724 106 L 3.8345 8.1196 117.5786 58.0086 41.7940 179.8067 107 I 3.6182 7.9587 120.1290 64.2144 36.9846 178.5410 108 S 4.1607 8.0587 114.9441 60.9232 62.9219 176.5696 109 L 3.8769 7.3891 122.6361 57.5288 41.2324 178.9904 110 Q 3.5748 7.0605 118.8528 58.9296 28.8225 178.2639 111 A 3.9821 7.6610 121.6861 54.7326 18.1783 179.3077 112 L 3.8054 7.5749 118.1460 58.2977 42.2288 178.7749 113 L 3.6371 7.4812 117.6430 57.8568 41.5562 179.1016 114 Q 4.3791 7.7081 117.9172 57.7345 30.1601 176.2370 115 S 4.6493 7.8481 115.7125 55.0482 63.2184 171.4355 116 P 4.2041 0.0000 0.0000 62.7137 32.1635 176.7177 117 E 4.5513 8.8672 121.1409 53.2179 29.3794 174.8002 118 P 4.1029 0.0000 0.0000 65.0789 31.8620 177.2542 119 N 4.6519 7.9457 112.6719 53.6539 39.0870 174.8739 120 D 4.7617 7.6170 118.0452 51.0524 41.0736 172.2113 121 P 4.5060 0.0000 0.0000 62.1911 32.4946 176.9957 122 Q 4.0763 8.5105 122.5358 57.2593 29.8650 175.2268 123 D 4.7249 7.6199 117.4173 51.7660 42.8732 175.7995 124 A 3.9432 8.4367 129.5418 55.2892 18.5675 178.4745 125 E 4.5005 8.0985 118.4258 59.0253 29.8035 179.0042 126 V 3.4110 7.9829 118.0391 65.9068 31.5183 177.8677 127 A 3.8759 8.0551 120.5348 55.1308 18.2812 179.6153 128 Q 3.9622 8.2477 116.7266 59.3042 28.7713 178.4786 129 H 4.3043 8.1887 119.1956 59.4959 29.7407 176.7367 130 Y 3.7616 7.8877 120.1635 60.5601 38.6098 177.6608 131 L 4.0429 7.8739 118.8903 57.8618 41.8195 179.4129 132 R 4.2906 8.1948 117.4590 58.2068 31.2885 176.9049 133 D 4.6412 8.1212 118.1631 51.8844 42.7046 175.0665 134 R 3.8722 8.1760 124.6101 58.7167 30.2872 177.4215 135 E 3.9485 8.0827 118.0737 59.4750 29.5332 179.0480 136 S 4.1085 8.1896 112.7336 61.1405 62.3631 175.9089 137 F 3.7994 8.6540 123.7870 61.4051 39.1200 176.8408 138 N 4.0872 8.4777 116.1425 56.1736 38.3133 177.4024 139 K 3.8145 8.0908 119.8469 59.9458 32.0961 179.5136 140 T 3.7486 7.5079 115.1946 66.2259 68.2789 176.8510 141 A 3.6912 7.6871 122.9479 54.8972 18.1816 179.5637 142 A 4.5417 7.8977 120.8301 54.5641 18.4418 179.4686 143 L 3.8701 7.8494 118.8691 58.4052 42.1287 179.4498 144 W 4.4097 8.6807 118.7837 59.8702 28.9338 178.7598 145 T 4.0906 8.2403 115.9283 66.7180 67.7329 176.7528 146 R 4.4037 7.8589 119.9396 58.8858 30.2292 178.8812 147 L 3.7919 8.0584 117.4143 57.1233 41.6038 178.2749 148 Y 4.7677 7.9591 113.1538 57.4439 39.8238 176.6794 149 A 4.5054 8.0369 120.4426 51.6419 19.7908 176.3352 150 S 4.2312 7.8041 120.0724 58.8774 63.2005 174.1243 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 2 S 8.29 4.44 0.00 3.90 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 3 R 8.63 3.88 0.00 1.94 1.92 0.00 3.30 0.00 0.00 3.34 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.33 0.00 4 A 8.18 4.27 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 5 K 7.96 3.86 0.00 1.90 2.02 0.00 1.68 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.46 1.47 7.81 6 R 7.85 3.91 0.00 2.00 2.16 0.00 3.23 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.91 0.00 7 I 7.67 3.77 2.09 0.00 0.00 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.93 1.06 0.00 0.00 8 M 8.29 4.27 0.00 2.12 2.29 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.67 3.05 0.00 9 K 8.43 4.05 0.00 1.75 1.83 0.00 1.82 0.00 0.00 1.65 0.00 0.00 2.89 0.00 0.00 2.81 0.00 0.00 0.00 0.00 1.38 1.36 7.81 10 E 8.22 4.20 0.00 2.17 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.61 0.00 11 I 7.48 3.63 2.06 0.00 0.00 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 1.42 1.48 0.91 0.00 0.00 12 Q 8.20 3.98 0.00 2.20 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.79 0.00 0.00 0.00 0.00 0.00 2.37 2.64 0.00 13 A 8.11 3.97 1.38 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 14 V 7.61 3.69 2.20 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 1.00 0.00 0.00 0.97 0.00 0.00 15 K 7.72 4.04 0.00 1.89 1.86 0.00 1.76 0.00 0.00 1.71 0.00 0.00 3.03 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.68 7.81 16 D 8.30 4.60 0.00 2.77 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 17 D 7.61 4.97 0.00 2.58 2.51 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 18 P 0.00 4.23 0.00 2.25 2.30 0.00 3.84 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.98 0.00 19 A 7.99 4.08 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 20 A 7.98 4.12 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 21 H 7.85 3.99 0.00 3.38 3.48 0.00 5.82 0.00 0.00 0.00 0.00 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 I 7.78 4.97 1.90 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 1.60 0.88 1.00 0.00 0.00 23 T 8.59 4.73 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 1.21 0.00 0.00 24 L 8.41 5.08 0.00 1.55 1.40 0.84 0.74 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 25 E 9.05 4.71 0.00 1.84 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 2.19 2.21 0.00 26 F 8.67 4.46 0.00 2.92 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 27 V 8.42 3.85 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 0.72 0.00 0.00 0.71 0.00 0.00 28 S 7.55 4.81 0.00 3.99 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 29 E 8.95 3.93 0.00 2.08 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 0.00 2.26 2.31 0.00 30 S 7.91 4.53 0.00 3.82 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 31 D 7.73 4.64 0.00 2.64 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 32 I 8.35 4.16 1.81 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 1.46 1.19 0.84 0.00 0.00 33 H 8.35 4.63 0.00 3.18 3.46 0.00 5.82 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 34 H 8.34 5.33 0.00 3.18 3.19 0.00 5.63 0.00 0.00 0.00 0.00 6.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 L 9.15 5.32 0.00 1.43 1.41 0.76 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 36 K 9.06 4.92 0.00 1.53 1.62 0.00 1.70 0.00 0.00 1.60 0.00 0.00 2.77 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.24 1.44 7.81 37 G 9.19 4.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 T 9.11 5.98 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 1.19 0.00 0.00 39 F 8.20 5.41 0.00 3.12 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 40 L 8.76 5.15 0.00 1.68 1.73 0.93 0.91 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 41 G 9.20 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 0.00 0.00 0.00 0.00 42 P 0.00 4.64 0.00 2.29 2.16 0.00 3.99 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 2.26 0.00 43 P 0.00 4.55 0.00 2.24 2.14 0.00 3.91 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.01 0.00 44 G 9.39 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 45 T 7.42 4.83 4.49 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 1.42 0.00 0.00 46 P 0.00 4.32 0.00 1.85 2.20 0.00 3.75 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 2.03 0.00 47 Y 7.57 5.02 0.00 3.28 3.34 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 48 E 7.95 4.28 0.00 2.24 1.92 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 2.38 2.34 0.00 49 G 9.19 4.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 7.91 3.75 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 51 K 7.91 4.87 0.00 1.69 1.54 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.90 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.23 1.31 7.81 52 F 8.72 4.71 0.00 1.88 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 53 V 9.05 4.71 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 0.96 0.00 0.00 0.91 0.00 0.00 54 V 8.95 4.55 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 0.63 0.00 0.00 0.48 0.00 0.00 55 D 9.36 4.82 0.00 3.04 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 56 I 9.14 4.96 1.76 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.99 0.64 0.74 0.00 0.00 57 E 9.16 5.07 0.00 1.60 1.81 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 2.12 2.12 0.00 58 V 8.42 4.26 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 0.34 0.00 0.00 0.88 0.00 0.00 59 P 0.00 4.46 0.00 2.22 2.14 0.00 3.59 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 2.23 2.07 0.00 60 M 8.51 4.07 0.00 2.00 2.12 0.00 0.00 0.00 0.00 0.00 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.64 0.00 61 E 8.09 4.52 0.00 2.14 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 2.45 2.35 0.00 62 Y 7.71 4.19 0.00 3.01 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 63 P 0.00 3.24 0.00 1.67 1.26 0.00 2.84 0.00 0.00 3.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.60 1.44 0.00 64 F 7.61 4.88 0.00 3.21 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 65 K 7.64 4.70 0.00 1.71 1.62 0.00 1.89 0.00 0.00 1.77 0.00 0.00 3.10 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.46 7.81 66 P 0.00 2.97 0.00 1.85 1.88 0.00 3.65 0.00 0.00 3.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 1.91 0.00 67 P 0.00 4.35 0.00 1.83 1.64 0.00 2.92 0.00 0.00 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.73 0.00 68 K 8.98 4.29 0.00 1.73 1.65 0.00 1.53 0.00 0.00 1.61 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.37 7.81 69 M 8.51 5.26 0.00 1.79 1.86 0.00 0.00 0.00 0.00 0.00 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.42 0.00 70 Q 8.75 4.74 0.00 1.98 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.97 0.00 0.00 0.00 0.00 0.00 2.30 2.34 0.00 71 F 9.20 4.35 0.00 3.06 3.38 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 72 D 9.32 4.49 0.00 2.57 2.76 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 73 T 8.08 3.97 4.68 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 1.43 0.00 0.00 74 K 8.65 4.24 0.00 1.42 1.11 0.00 1.08 0.00 0.00 0.61 0.00 0.00 2.33 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.41 1.51 7.81 75 V 8.46 4.77 1.81 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 0.82 0.00 0.00 1.00 0.00 0.00 76 Y 8.63 3.89 0.00 1.75 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 77 H 7.90 4.96 0.00 3.12 2.88 0.00 5.95 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 78 P 0.00 3.98 0.00 1.72 1.74 0.00 2.72 0.00 0.00 3.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 1.42 0.00 79 N 7.99 4.75 0.00 2.79 2.75 0.00 0.00 6.90 7.36 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 80 I 7.39 4.91 1.65 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.39 0.64 0.00 0.00 81 S 8.93 4.29 0.00 3.86 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 82 S 9.17 4.70 0.00 4.38 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 83 V 7.97 4.19 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 0.90 0.00 0.00 1.01 0.00 0.00 84 T 8.14 4.33 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 85 G 8.57 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 0.00 0.00 0.00 86 A 7.74 4.49 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 87 I 8.36 4.83 1.93 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 1.60 1.03 1.00 0.00 0.00 88 C 8.74 4.61 0.00 3.13 2.83 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 89 L 8.07 4.58 0.00 1.73 1.46 0.91 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 90 D 9.05 4.43 0.00 2.92 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 91 I 7.74 3.94 2.07 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 1.49 0.75 0.99 0.00 0.00 92 L 7.91 4.32 0.00 1.89 1.76 0.99 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 93 K 7.95 4.27 0.00 1.74 1.46 0.00 1.76 0.00 0.00 1.70 0.00 0.00 2.94 0.00 0.00 2.83 0.00 0.00 0.00 0.00 1.29 1.24 7.81 94 N 8.74 4.96 0.00 2.70 2.88 0.00 0.00 6.68 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 95 A 7.85 4.74 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 96 W 8.13 4.50 0.00 3.59 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 97 S 6.47 4.42 0.00 3.62 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 P 0.00 4.36 0.00 2.04 1.95 0.00 3.65 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 2.26 2.42 0.00 99 V 6.89 3.70 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 0.57 0.00 0.00 0.75 0.00 0.00 100 I 6.78 3.70 0.56 0.00 0.00 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 1.04 -0.02 0.80 0.00 0.00 101 T 8.05 4.66 4.44 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 1.21 0.00 0.00 102 L 8.93 4.08 0.00 1.74 1.75 0.74 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.00 0.00 0.00 0.00 0.00 0.00 103 K 8.07 3.91 0.00 1.83 1.81 0.00 1.72 0.00 0.00 2.02 0.00 0.00 2.99 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.52 1.52 7.81 104 S 8.23 4.12 0.00 4.07 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 0.00 105 A 8.37 4.04 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.12 3.83 0.00 1.90 1.75 0.94 0.59 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 0.00 107 I 7.96 3.62 1.97 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 1.56 1.29 0.86 0.00 0.00 108 S 8.06 4.16 0.00 4.01 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 0.00 109 L 7.39 3.88 0.00 1.30 1.65 0.72 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 110 Q 7.06 3.57 0.00 1.62 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.82 0.00 0.00 0.00 0.00 0.00 2.40 2.75 0.00 111 A 7.66 3.98 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 0.00 112 L 7.57 3.81 0.00 1.68 1.79 0.94 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 113 L 7.48 3.64 0.00 1.64 1.12 0.22 -0.12 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 0.00 114 Q 7.71 4.38 0.00 2.09 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 7.10 0.00 0.00 0.00 0.00 0.00 2.40 2.46 0.00 115 S 7.85 4.65 0.00 3.82 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 0.00 116 P 0.00 4.20 0.00 1.12 1.07 0.00 3.60 0.00 0.00 3.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 2.02 0.00 117 E 8.87 4.55 0.00 1.88 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 0.00 2.15 2.16 0.00 118 P 0.00 4.10 0.00 2.06 2.17 0.00 3.61 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.25 1.57 0.00 119 N 7.95 4.65 0.00 2.67 2.84 0.00 0.00 6.60 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 0.00 120 D 7.62 4.76 0.00 2.56 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 0.00 121 P 0.00 4.51 0.00 2.17 1.97 0.00 3.77 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.92 0.00 122 Q 8.51 4.08 0.00 2.06 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.27 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.32 0.00 123 D 7.62 4.72 0.00 2.76 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 0.00 124 A 8.44 3.94 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 0.00 125 E 8.10 4.50 0.00 2.11 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 2.44 2.35 0.00 126 V 7.98 3.41 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 0.50 0.00 0.00 0.36 0.00 0.00 127 A 8.06 3.88 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 0.00 128 Q 8.25 3.96 0.00 2.34 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.14 6.75 0.00 0.00 0.00 0.00 0.00 2.38 2.55 0.00 129 H 8.19 4.30 0.00 3.38 3.70 0.00 5.61 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 Y 7.89 3.76 0.00 2.13 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 0.00 131 L 7.87 4.04 0.00 1.81 1.70 0.92 0.93 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 0.00 132 R 8.19 4.29 0.00 1.86 2.01 0.00 3.26 0.00 0.00 3.17 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.79 0.00 133 D 8.12 4.64 0.00 2.69 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 0.00 134 R 8.18 3.87 0.00 1.57 1.75 0.00 2.22 0.00 0.00 2.93 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.19 0.00 135 E 8.08 3.95 0.00 2.05 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 2.40 2.36 0.00 136 S 8.19 4.11 0.00 4.06 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 0.00 137 F 8.65 3.80 0.00 3.07 3.24 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 0.00 138 N 8.48 4.09 0.00 2.92 2.82 0.00 0.00 7.10 8.13 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 0.00 139 K 8.09 3.81 0.00 1.90 1.81 0.00 1.65 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.42 1.57 7.81 140 T 7.51 3.75 3.62 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 0.04 0.00 0.00 141 A 7.69 3.69 0.69 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 0.00 142 A 7.90 4.54 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 0.00 143 L 7.85 3.87 0.00 1.88 1.98 0.87 1.15 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 0.00 144 W 8.68 4.41 0.00 3.62 3.65 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 0.00 145 T 8.24 4.09 4.51 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 1.33 0.00 0.00 146 R 7.86 4.40 0.00 1.89 1.92 0.00 3.09 0.00 0.00 3.05 7.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.66 0.00 147 L 8.06 3.79 0.00 0.28 0.57 0.49 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 0.00 0.00 0.00 0.00 0.00 0.00 148 Y 7.96 4.77 0.00 3.16 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 0.00 149 A 8.04 4.51 0.81 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 0.00 150 S 7.80 4.23 0.00 3.93 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