NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 R 3.9320 8.1085 120.8530 56.3352 32.1923 177.4660 2 A 3.6755 7.5967 119.2464 54.2395 18.2988 177.6353 3 D 4.3107 8.8140 117.4026 57.1676 41.7245 176.6434 4 E 2.5757 7.9533 118.8932 58.9403 29.4824 178.9795 5 Q 3.8138 7.8021 117.7722 58.7851 28.7730 178.6615 6 A 4.0102 8.1318 122.1972 55.2635 18.5416 179.5277 7 F 4.5818 8.6075 112.3090 59.0236 38.1185 176.8555 8 L 4.4309 7.9400 119.3297 55.9804 41.8791 178.7792 9 V 3.7670 8.1200 119.0199 65.6465 31.4733 177.7749 10 A 4.0989 8.3171 120.6985 55.1061 18.2477 179.3006 11 L 3.4112 8.1169 118.8602 58.2226 41.9953 178.3221 12 Y 4.1834 8.2511 119.8691 60.6963 38.6516 178.1329 13 K 3.5162 8.0612 120.1551 59.6863 32.4021 177.9532 14 Y 4.0078 8.1484 119.9410 60.9926 38.6323 178.1044 15 M 4.0484 8.8172 118.1881 57.9244 31.3458 178.4767 16 K 3.8118 7.9941 120.9884 59.0821 32.1314 177.6991 17 E 4.2066 7.9135 116.4995 57.0930 29.4528 176.8466 18 R 4.3584 6.6938 115.1338 56.2497 30.8044 175.8269 19 K 3.8960 7.9547 114.6148 57.6929 30.4766 176.4740 20 T 4.7005 7.8680 112.3819 61.9030 69.1652 172.1871 21 P 4.5712 0.0000 0.0000 62.4127 32.7186 177.9970 22 I 3.7191 8.6516 119.6695 64.2472 37.1168 178.1350 23 E 3.9888 8.4489 118.9774 58.3200 29.3331 177.5821 24 R 4.5576 8.0225 113.9166 55.7649 30.2336 176.5938 25 I 4.5852 7.7193 117.9787 59.5069 37.2777 173.6452 26 P 4.0583 0.0000 0.0000 65.2822 31.8298 176.5485 27 Y 4.8521 7.4140 113.5984 56.2761 42.0768 173.3999 28 L 4.7896 8.4648 122.8433 52.9460 44.4207 176.4872 29 G 4.2189 8.8031 111.5534 48.6704 0.0000 173.9839 30 F 4.7438 8.3998 119.5965 58.9239 40.8016 175.2752 31 K 4.1195 7.4410 120.5645 54.4933 34.2285 174.8695 32 Q 4.6687 8.3100 117.8840 55.7679 29.3559 176.6663 33 I 3.6812 8.6899 119.3787 65.4945 37.2950 177.2762 34 N 4.1285 8.0898 113.2573 53.7682 35.5526 174.1925 35 L 4.0636 7.9308 125.8228 58.0661 42.7608 177.8100 36 W 4.4197 8.6568 116.0215 60.1404 27.5713 178.2659 37 T 3.5232 6.8204 115.9296 66.4897 67.9789 176.6908 38 M 4.1837 7.7171 118.6766 58.2774 31.0492 178.1729 39 F 4.5348 8.7605 122.4407 61.4434 39.8107 177.1610 40 Q 3.7083 8.5928 117.0389 58.8197 28.2195 178.4127 41 A 3.8481 8.2002 122.8169 55.1265 18.4684 179.3117 42 A 3.5754 8.1017 119.4664 55.4626 18.1448 179.8892 43 Q 3.7885 7.8085 115.5010 58.2586 28.5604 178.5259 44 K 4.0829 7.6078 120.6528 59.2214 32.1046 178.3711 45 L 4.3643 7.6095 115.2862 55.1358 41.5235 177.4018 46 G 3.8521 7.1291 106.5929 46.0205 0.0000 175.1255 47 G 4.2132 8.2336 111.3493 44.1213 0.0000 174.6457 48 Y 3.8093 8.4304 117.9627 60.3652 38.2969 178.1781 49 E 3.9666 8.0841 119.1362 59.7884 29.6507 178.9779 50 T 3.7963 7.6502 115.2739 66.4368 68.4254 176.7000 51 I 3.4579 7.3921 121.8082 64.7834 36.8294 178.6276 52 T 3.7783 7.4965 114.9095 66.3136 68.3488 176.6631 53 A 4.1582 7.9720 121.7307 54.1737 18.4768 178.1031 54 R 4.3767 7.3806 112.2406 54.5815 32.8055 175.1327 55 R 3.8255 7.8467 116.4120 57.3753 27.9128 176.7935 56 Q 4.2365 7.4392 115.4760 56.4701 29.6386 175.8237 57 W 4.1866 8.0924 119.7546 60.6000 28.6245 177.7580 58 K 3.9821 8.2950 119.0606 59.8546 31.5892 178.3135 59 H 4.3786 8.5709 116.7011 58.4720 28.6824 177.7096 60 I 3.6944 7.6891 121.3667 64.6004 36.9353 177.4064 61 Y 4.3968 8.5942 120.6594 60.7769 38.1944 178.0555 62 D 4.1229 7.5353 116.9744 57.3516 41.5195 177.5342 63 E 4.0218 7.9698 118.3205 59.0234 29.6237 178.5173 64 L 4.1924 8.3331 118.8772 57.8516 42.1595 177.8761 65 G 3.7535 6.8008 103.3380 44.5139 0.0000 171.5089 66 G 3.6803 7.5906 108.5565 43.8752 0.0000 173.7282 67 N 4.3644 9.2656 121.5959 50.3008 39.8995 171.0393 68 P 4.2208 0.0000 0.0000 64.6922 31.2938 176.9137 69 G 3.9646 9.2160 110.7147 45.0774 0.0000 172.7593 70 S 4.7352 7.2763 113.8699 57.1207 64.7247 174.0526 71 T 4.5160 8.0417 114.5395 61.6884 68.7666 174.8585 72 S 4.6331 7.7354 113.4745 58.9874 63.4211 176.4269 73 A 3.8798 8.1427 125.4197 56.3039 18.2926 180.4604 74 A 4.5800 7.7446 116.4377 53.6848 19.0308 179.6307 75 T 3.7621 7.4770 113.0272 66.6575 67.8641 176.4885 76 C 4.0297 7.5567 118.2520 62.7343 28.2135 176.1505 77 T 3.7517 7.2527 117.2316 66.0269 67.9378 176.4255 78 R 3.1046 6.2496 120.4976 59.3464 29.7115 178.7363 79 R 4.2147 7.1501 115.6587 58.9582 30.3116 178.6028 80 H 4.4840 7.7179 115.9695 59.0917 28.9345 176.7360 81 Y 4.2080 8.6192 121.9346 60.7220 38.4568 177.5327 82 E 4.2159 8.2652 115.5453 57.8046 29.9446 177.2509 83 R 4.5818 8.1322 116.7317 55.6516 32.0358 175.4867 84 L 4.6130 7.6114 117.3628 54.8769 43.9026 175.6961 85 I 4.4049 7.2272 114.1426 60.9608 43.7088 175.5109 86 L 3.9100 7.6952 122.1402 57.8835 41.7509 176.8985 87 P 4.4603 0.0000 0.0000 64.9109 31.8326 176.8273 88 Y 4.4832 7.6437 115.8389 58.8906 39.3364 177.1051 89 E 3.4548 8.3846 118.6535 58.4404 28.9488 178.8163 90 R 3.7819 7.8993 120.1143 59.6239 30.0234 177.9236 91 F 4.2486 7.7263 114.1700 59.5462 37.9024 177.8522 92 I 3.7596 6.7196 120.1335 63.5593 36.8920 177.1137 93 K 5.0553 7.5668 119.0817 55.9543 32.3993 176.7634 94 G 4.1269 7.7070 104.6295 46.3508 0.0000 173.9881 95 E 4.7624 8.1487 116.9431 55.9611 31.6500 174.8883 96 E 4.7620 7.9043 118.5782 56.5274 36.1344 174.6731 97 D 4.3920 7.9079 115.5401 53.7488 44.6891 174.7281 98 K 4.5022 8.5855 127.0434 54.1325 31.8461 173.5717 99 P 4.4980 0.0000 0.0000 62.3829 32.0404 176.7804 100 L 4.5447 7.5509 119.5801 52.3998 42.3686 174.2336 101 P 4.5948 0.0000 0.0000 61.2536 32.3350 175.6680 102 P 4.3319 0.0000 0.0000 64.0173 31.4865 176.2594 103 I 4.0370 7.0620 120.0155 61.0007 37.0841 175.4614 104 K 4.4687 7.7982 123.4439 55.6494 34.2352 173.7625 105 P 4.4887 0.0000 0.0000 64.4075 33.3798 177.1652 106 R 4.3460 6.9277 122.6250 55.2342 36.2542 174.5819 107 K 4.1537 9.0434 115.7869 56.5159 32.0907 176.2409 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 R 8.11 3.93 0.00 1.50 1.67 0.00 2.94 0.00 0.00 2.90 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.50 0.00 2 A 7.60 3.68 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 3 D 8.81 4.31 0.00 2.87 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 4 E 7.95 2.58 0.00 2.11 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 0.00 2.57 2.49 0.00 5 Q 7.80 3.81 0.00 2.04 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.23 6.72 0.00 0.00 0.00 0.00 0.00 2.19 2.04 0.00 6 A 8.13 4.01 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 7 F 8.61 4.58 0.00 3.24 3.35 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 8 L 7.94 4.43 0.00 1.72 1.71 0.96 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 9 V 8.12 3.77 2.26 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 1.20 0.00 0.00 0.99 0.00 0.00 10 A 8.32 4.10 1.57 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 11 L 8.12 3.41 0.00 0.65 1.46 0.34 0.43 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 12 Y 8.25 4.18 0.00 3.11 3.21 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 0.00 13 K 8.06 3.52 0.00 1.82 1.94 0.00 1.72 0.00 0.00 1.57 0.00 0.00 2.90 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.40 1.35 7.81 14 Y 8.15 4.01 0.00 3.20 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 15 M 8.82 4.05 0.00 2.23 2.39 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.73 2.83 0.00 16 K 7.99 3.81 0.00 1.49 1.64 0.00 1.49 0.00 0.00 1.25 0.00 0.00 2.82 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.27 1.33 7.81 17 E 7.91 4.21 0.00 1.96 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 2.16 2.24 0.00 18 R 6.69 4.36 0.00 1.80 1.76 0.00 2.84 0.00 0.00 2.25 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.41 0.00 19 K 7.95 3.90 0.00 1.83 1.87 0.00 1.61 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.32 1.34 7.81 20 T 7.87 4.70 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 1.22 0.00 0.00 21 P 0.00 4.57 0.00 2.43 2.20 0.00 3.70 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.00 0.00 22 I 8.65 3.72 1.78 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 1.43 0.82 0.81 0.00 0.00 23 E 8.45 3.99 0.00 2.01 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 2.33 2.48 0.00 24 R 8.02 4.56 0.00 1.88 1.98 0.00 3.01 0.00 0.00 3.23 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.56 0.00 25 I 7.72 4.59 1.82 0.00 0.00 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.83 0.78 0.00 0.00 26 P 0.00 4.06 0.00 1.64 1.93 0.00 3.72 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.96 0.00 27 Y 7.41 4.85 0.00 2.91 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 28 L 8.46 4.79 0.00 1.78 1.83 1.11 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 29 G 8.80 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 0.00 0.00 0.00 0.00 30 F 8.40 4.74 0.00 2.99 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 31 K 7.44 4.12 0.00 1.75 1.66 0.00 1.78 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.33 1.18 7.81 32 Q 8.31 4.67 0.00 2.18 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.94 6.76 0.00 0.00 0.00 0.00 0.00 2.37 2.44 0.00 33 I 8.69 3.68 1.85 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 1.34 0.72 0.95 0.00 0.00 34 N 8.09 4.13 0.00 2.81 2.61 0.00 0.00 6.93 6.89 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 35 L 7.93 4.06 0.00 1.72 1.75 0.89 1.00 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 36 W 8.66 4.42 0.00 3.91 3.27 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 37 T 6.82 3.52 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 0.96 0.00 0.00 38 M 7.72 4.18 0.00 2.44 2.75 0.00 0.00 0.00 0.00 0.00 2.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.97 2.70 0.00 39 F 8.76 4.53 0.00 3.27 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 40 Q 8.59 3.71 0.00 2.34 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.75 7.14 0.00 0.00 0.00 0.00 0.00 2.62 2.37 0.00 41 A 8.20 3.85 1.40 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 0.00 0.00 0.00 0.00 0.00 0.00 42 A 8.10 3.58 1.11 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 0.00 0.00 43 Q 7.81 3.79 0.00 1.83 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 7.05 0.00 0.00 0.00 0.00 0.00 1.49 1.62 0.00 44 K 7.61 4.08 0.00 1.88 1.85 0.00 1.59 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.38 1.43 7.81 45 L 7.61 4.36 0.00 1.41 1.47 0.86 1.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 46 G 7.13 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 0.00 0.00 0.00 47 G 8.23 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 0.00 0.00 0.00 0.00 48 Y 8.43 3.81 0.00 3.11 3.10 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 49 E 8.08 3.97 0.00 2.06 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 2.47 2.51 0.00 50 T 7.65 3.80 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 1.14 0.00 0.00 51 I 7.39 3.46 1.56 0.00 0.00 0.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.10 -0.09 0.33 0.00 0.00 52 T 7.50 3.78 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 1.18 0.00 0.00 53 A 7.97 4.16 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 54 R 7.38 4.38 0.00 1.83 1.83 0.00 3.44 0.00 0.00 3.32 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.73 0.00 55 R 7.85 3.83 0.00 1.95 2.01 0.00 3.34 0.00 0.00 3.18 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.70 0.00 56 Q 7.44 4.24 0.00 1.97 1.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 6.65 0.00 0.00 0.00 0.00 0.00 2.20 2.25 0.00 57 W 8.09 4.19 0.00 3.41 3.28 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 58 K 8.30 3.98 0.00 1.92 1.80 0.00 1.60 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.56 7.81 59 H 8.57 4.38 0.00 3.30 3.31 0.00 5.68 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 I 7.69 3.69 2.19 0.00 0.00 -0.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.25 1.09 0.00 0.00 61 Y 8.59 4.40 0.00 3.11 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 62 D 7.54 4.12 0.00 2.75 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 63 E 7.97 4.02 0.00 1.96 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 2.28 2.35 0.00 64 L 8.33 4.19 0.00 1.72 1.75 1.12 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 65 G 6.80 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 66 G 7.59 3.68 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 0.00 0.00 0.00 67 N 9.27 4.36 0.00 2.10 2.91 0.00 0.00 6.65 7.79 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 68 P 0.00 4.22 0.00 2.20 2.08 0.00 3.64 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 1.97 1.96 0.00 69 G 9.22 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 70 S 7.28 4.74 0.00 3.90 3.49 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 71 T 8.04 4.52 4.17 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 1.15 0.00 0.00 72 S 7.74 4.63 0.00 3.92 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 73 A 8.14 3.88 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 74 A 7.74 4.58 1.65 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 0.00 0.00 75 T 7.48 3.76 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 1.14 0.00 0.00 76 C 7.56 4.03 0.00 3.00 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 77 T 7.25 3.75 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 1.33 0.00 0.00 78 R 6.25 3.10 0.00 0.67 1.66 0.00 3.05 0.00 0.00 3.13 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.89 0.00 79 R 7.15 4.21 0.00 1.79 1.93 0.00 3.16 0.00 0.00 3.14 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.54 0.00 80 H 7.72 4.48 0.00 3.36 3.34 0.00 5.65 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 Y 8.62 4.21 0.00 3.43 3.45 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 82 E 8.27 4.22 0.00 2.28 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 0.00 2.67 2.42 0.00 83 R 8.13 4.58 0.00 1.82 1.97 0.00 3.30 0.00 0.00 3.18 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.69 0.00 84 L 7.61 4.61 0.00 1.63 1.71 0.91 0.96 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 85 I 7.23 4.40 1.65 0.00 0.00 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.03 0.64 -0.12 0.00 0.00 86 L 7.70 3.91 0.00 1.50 1.78 0.70 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.46 0.00 2.41 2.23 0.00 3.72 0.00 0.00 3.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 2.16 0.00 88 Y 7.64 4.48 0.00 2.95 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 89 E 8.38 3.45 0.00 2.13 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 0.00 2.44 2.31 0.00 90 R 7.90 3.78 0.00 1.84 1.98 0.00 3.17 0.00 0.00 3.37 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 91 F 7.73 4.25 0.00 3.07 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 I 6.72 3.76 1.79 0.00 0.00 0.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 -0.36 0.97 0.00 0.00 93 K 7.57 5.06 0.00 1.78 1.78 0.00 1.62 0.00 0.00 1.61 0.00 0.00 3.05 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.41 1.31 7.81 94 G 7.71 4.13 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 E 8.15 4.76 0.00 2.10 1.87 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 2.22 2.22 0.00 96 E 7.90 4.76 0.00 1.93 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 2.24 2.33 0.00 97 D 7.91 4.39 0.00 2.73 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 98 K 8.59 4.50 0.00 1.72 1.69 0.00 1.83 0.00 0.00 1.77 0.00 0.00 2.90 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.31 1.39 7.81 99 P 0.00 4.50 0.00 2.22 2.15 0.00 3.79 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.01 0.00 100 L 7.55 4.54 0.00 1.78 1.68 1.05 1.12 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 0.00 101 P 0.00 4.59 0.00 2.22 2.17 0.00 3.68 0.00 0.00 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 1.94 0.00 102 P 0.00 4.33 0.00 2.21 2.22 0.00 3.76 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 0.00 103 I 7.06 4.04 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 1.29 0.70 0.90 0.00 0.00 104 K 7.80 4.47 0.00 1.70 1.64 0.00 1.76 0.00 0.00 1.72 0.00 0.00 3.01 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.25 1.25 7.81 105 P 0.00 4.49 0.00 2.16 2.15 0.00 3.78 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 1.97 1.94 0.00 106 R 6.93 4.35 0.00 1.72 0.86 0.00 3.22 0.00 0.00 3.21 7.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.60 0.00 107 K 9.04 4.15 0.00 1.77 1.69 0.00 1.82 0.00 0.00 1.73 0.00 0.00 2.81 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.42 1.41 7.81