NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 9 K 4.2080 8.3144 120.1354 56.8842 33.5730 173.2385 10 V 3.8100 8.6706 118.4146 59.8909 31.1255 170.0621 11 K 4.0260 8.7987 118.8770 56.1180 36.0896 171.9079 12 R 3.4717 8.2895 118.3357 56.5831 30.0990 176.0485 13 Q 4.5691 7.6301 123.4506 56.7671 28.9758 177.0874 14 V 4.4800 8.2914 101.2754 60.9621 34.2400 172.2382 15 A 3.8084 7.9814 121.0050 53.3877 18.8011 176.9834 16 S 5.4678 8.5519 119.1278 59.2199 63.2161 174.7310 17 G 4.1483 8.0363 110.1461 45.6733 0.0000 172.9408 18 R 5.0669 8.6880 118.6712 54.2000 34.3629 175.0705 19 A 4.7966 8.3773 123.6435 50.6495 21.2583 174.5854 20 Y 5.1634 8.8743 120.0054 57.3607 40.6459 175.3198 21 I 4.8629 8.8431 124.1530 59.8880 40.6113 174.0457 22 H 5.0624 9.7500 128.3582 54.6835 31.2535 173.4472 23 A 4.9719 8.8617 129.9107 50.2324 20.0356 175.4474 24 S 5.1253 8.2783 119.9499 58.0263 64.8574 173.2170 25 Y 4.1744 8.7939 114.1000 59.4611 39.1742 176.2366 26 N 4.7770 7.9636 113.5584 52.3293 39.3270 173.4557 27 N 4.2268 7.3822 116.4428 54.4495 42.2736 172.4310 28 T 4.9537 7.4216 111.9943 62.9216 72.8050 172.8442 29 I 5.0948 8.8421 118.0725 59.7492 42.0687 174.1818 30 V 5.5954 8.9958 115.0027 59.4944 36.2702 174.3477 31 T 5.1204 8.7233 118.6979 60.4913 70.5250 172.1132 32 I 4.9844 9.1304 130.5483 60.4112 39.1757 174.8625 33 T 4.8655 8.7235 118.5721 60.6691 72.3651 172.4473 34 D 4.8556 8.0046 119.7168 51.2301 41.6684 175.2580 35 P 4.3256 0.0000 0.0000 64.7766 31.3667 176.6943 36 D 4.7682 9.2114 116.2142 53.5617 42.3609 176.5336 37 G 4.1511 9.1345 108.1098 45.1585 0.0000 173.8434 38 N 4.6088 8.4109 117.8732 51.6969 37.9163 172.2352 39 P 4.4930 0.0000 0.0000 61.2332 31.6891 176.0765 40 I 4.2563 8.3498 124.2204 62.4247 39.2817 175.5510 41 T 4.1671 7.5607 114.3308 61.8095 70.5236 171.3077 42 W 5.4196 7.7543 121.0156 56.2927 31.4148 172.5202 43 S 4.4165 9.0372 114.0007 57.9322 66.1814 173.5668 44 S 4.9560 8.4606 115.9775 57.7628 64.4690 177.7161 45 G 4.1474 8.2438 108.1846 48.9423 0.0000 176.2610 46 G 3.9006 7.8190 107.8451 47.0591 0.0000 175.1869 47 V 3.7454 8.3569 120.6004 65.7764 31.8782 177.6382 48 I 3.9626 7.3049 120.0589 61.4863 36.4793 178.2652 49 G 4.1018 8.1372 113.2389 46.3278 0.0000 175.1563 50 Y 4.6839 7.4372 117.1938 57.9802 38.8426 174.9500 51 K 4.6178 8.2198 122.7294 55.6430 36.5879 176.6681 52 G 3.8896 8.5737 109.7195 46.3388 0.0000 175.5833 53 S 4.3742 8.4934 114.8372 59.5121 63.6495 176.2522 54 R 3.9282 7.3266 120.2234 58.6562 29.9497 177.6244 55 K 4.2396 7.9764 118.1316 59.4057 31.7850 178.7159 56 G 3.9371 7.8396 104.1532 46.2271 0.0000 173.2868 57 T 4.2160 7.5965 118.6646 62.3984 69.5720 173.3617 58 P 4.2423 0.0000 0.0000 66.3780 31.0824 177.9732 59 Y 4.2405 8.1720 118.3446 60.5528 38.7520 177.9904 60 A 3.7105 8.1383 120.8563 54.9800 18.8733 179.0680 61 A 4.2153 8.2510 118.9488 55.1745 18.3155 178.3386 62 Q 4.1737 7.6689 118.2489 57.2029 29.1835 177.2456 63 L 3.7366 7.8358 119.1143 57.9617 41.8972 179.6503 64 A 3.8605 8.4593 120.3623 55.3190 18.4867 179.5145 65 A 3.9876 7.5797 117.7805 55.5555 17.8899 179.0869 66 L 4.0682 7.8948 118.1021 56.8365 41.6468 178.4915 67 D 4.3556 8.5842 119.7309 58.4603 41.5136 178.2002 68 A 3.8945 8.6348 121.8173 53.7831 18.0711 178.8534 69 A 3.9093 8.2327 116.7598 55.0865 18.8438 179.8697 70 K 3.6343 9.1229 117.2881 59.9472 32.2175 179.2945 71 K 4.0394 8.5436 118.2139 58.5572 32.0125 178.8817 72 A 4.2452 7.7263 120.3533 54.3160 18.5637 179.3015 73 M 4.1306 8.6159 117.2710 58.5642 32.2983 178.0483 74 A 4.2704 7.5196 120.2456 55.6695 17.0182 179.8179 75 Y 4.4594 7.9161 111.8958 57.7996 38.1055 176.2781 76 G 3.9293 8.1755 106.6497 46.8597 0.0000 174.3191 77 M 4.4717 8.1884 118.3130 54.6094 33.4845 174.1134 78 Q 4.4245 8.2928 122.3445 56.7352 32.3196 175.1928 79 S 5.2572 7.8826 119.6753 56.3356 63.3765 172.3587 80 V 4.8348 7.8264 120.7765 60.2886 34.1627 174.1892 81 D 5.0594 8.3413 122.9779 52.5953 43.0754 175.8054 82 V 4.3953 8.2348 123.7881 62.4823 33.4747 174.8651 83 I 4.9779 8.6848 126.7042 59.7276 41.1468 174.4823 84 V 4.7873 8.4957 119.8427 59.5824 34.5522 175.0785 85 R 4.7556 9.1433 123.4004 55.3891 34.0617 174.7665 86 G 4.3181 9.2103 107.9748 46.0104 0.0000 173.0469 87 T 4.5895 7.9020 112.0873 62.8035 69.9337 174.9599 88 G 3.8321 8.1545 108.9904 44.4541 0.0000 173.3682 89 A 3.7047 8.0777 120.3196 55.7609 18.1909 180.3363 90 G 4.0996 6.4433 102.1718 43.0162 0.0000 175.5976 91 R 3.9847 9.3713 122.1228 59.1368 30.3361 176.6718 92 E 3.8516 8.2136 118.4801 59.6226 29.6152 178.3390 93 Q 3.8904 8.1726 118.6243 59.3122 28.8143 179.0522 94 A 3.9604 7.5758 120.6780 55.5754 18.7502 179.0299 95 I 3.6606 7.7740 117.9624 64.8782 37.2085 178.4665 96 R 3.9158 8.0961 117.5664 59.8105 29.8831 178.8792 97 A 4.1062 8.3451 120.4297 54.6475 18.1473 178.7061 98 L 4.3566 7.9181 115.3884 55.8978 41.8050 178.5353 99 Q 4.2132 7.7967 118.5805 58.2791 29.1947 177.6001 100 A 4.1245 7.9878 122.0915 54.9562 18.5416 178.8815 101 S 4.0544 7.3546 112.0409 61.7527 62.9289 174.2560 102 G 3.3036 7.4878 113.9282 43.9908 0.0000 172.9692 103 L 4.5214 7.5487 121.2118 53.5451 43.5754 176.5550 104 Q 4.2354 8.9773 123.7260 54.9228 28.9923 174.7380 105 V 4.1917 8.1226 119.4942 60.0831 28.8786 175.9694 106 K 3.9851 8.3967 121.4737 58.9141 32.0725 176.0610 107 S 4.7134 7.7482 111.7741 57.3035 66.8567 172.0100 108 I 4.9757 8.2382 120.9103 59.6277 40.0711 175.4453 109 V 4.3846 8.2452 125.0905 61.3444 34.7769 173.4024 110 D 4.9812 8.8053 127.7959 53.7368 42.3081 176.0717 111 D 4.7585 8.9124 124.8832 53.0484 41.7712 172.6409 112 T 4.4343 8.0011 117.9689 60.1829 70.2845 172.1942 113 P 4.1541 0.0000 0.0000 63.1731 30.1978 175.6126 114 V 4.1996 7.9128 124.6011 59.0613 31.6162 174.2126 115 P 4.2949 0.0000 0.0000 63.0416 32.3522 176.8502 116 H 4.5725 8.4013 119.6961 55.6979 27.9031 175.7527 117 N 4.1029 7.9878 118.1208 53.3094 35.8862 174.2166 118 G 3.7975 8.1600 108.7353 46.0176 0.0000 171.9993 119 C 4.3802 8.3807 115.8424 58.5980 29.9408 173.3350 120 R 4.2112 8.1474 121.7442 55.1930 30.4596 174.5444 121 P 4.4206 0.0000 0.0000 61.6588 32.5158 176.4370 122 K 3.9133 8.8128 121.2802 57.6897 32.7242 179.0262 123 K 4.4573 8.2554 125.0901 59.1470 32.9233 176.6781 124 K 3.9331 7.6104 119.9140 59.7086 32.4630 177.8722 125 F 4.1786 8.7332 120.4135 59.4642 39.5314 176.5538 126 R 4.0030 7.8603 120.8745 59.7179 30.5510 178.3769 127 K 4.3587 7.2537 112.4393 57.7351 29.8455 174.1841 128 A 4.5609 8.5242 129.7088 51.1300 19.4954 176.6777 129 S 4.5461 9.1991 116.3638 60.5955 62.9159 175.4996 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 9 K 8.31 4.21 0.00 1.75 1.85 0.00 1.59 0.00 0.00 1.71 0.00 0.00 2.99 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.35 1.51 7.81 10 V 8.67 3.81 2.06 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 0.69 0.00 0.00 0.92 0.00 0.00 11 K 8.80 4.03 0.00 1.49 1.35 0.00 1.63 0.00 0.00 1.49 0.00 0.00 2.74 0.00 0.00 2.55 0.00 0.00 0.00 0.00 1.04 1.09 7.81 12 R 8.29 3.47 0.00 1.88 1.90 0.00 3.31 0.00 0.00 3.24 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.48 0.00 13 Q 7.63 4.57 0.00 2.07 2.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 7.56 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 14 V 8.29 4.48 2.10 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 0.65 0.00 0.00 0.97 0.00 0.00 15 A 7.98 3.81 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 16 S 8.55 5.47 0.00 3.95 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 0.00 17 G 8.04 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 0.00 0.00 0.00 18 R 8.69 5.07 0.00 1.58 1.24 0.00 3.17 0.00 0.00 3.41 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.50 0.00 19 A 8.38 4.80 1.18 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 0.00 0.00 20 Y 8.87 5.16 0.00 3.22 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 21 I 8.84 4.86 1.91 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 1.16 1.11 0.94 0.00 0.00 22 H 9.75 5.06 0.00 3.19 3.22 0.00 5.76 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 A 8.86 4.97 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 24 S 8.28 5.13 0.00 3.94 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 25 Y 8.79 4.17 0.00 3.02 3.03 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 26 N 7.96 4.78 0.00 2.78 2.89 0.00 0.00 6.69 8.00 0.00 0.00 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 N 7.38 4.23 0.00 2.80 2.70 0.00 0.00 6.97 7.22 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 28 T 7.42 4.95 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 1.29 0.00 0.00 29 I 8.84 5.09 2.19 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.98 0.96 0.00 0.00 30 V 9.00 5.60 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 0.89 0.00 0.00 0.99 0.00 0.00 31 T 8.72 5.12 4.34 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 1.30 0.00 0.00 32 I 9.13 4.98 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 1.30 0.51 0.94 0.00 0.00 33 T 8.72 4.87 4.40 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 1.44 0.00 0.00 34 D 8.00 4.86 0.00 2.92 2.96 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 35 P 0.00 4.33 0.00 2.07 2.18 0.00 3.64 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 2.05 2.14 0.00 36 D 9.21 4.77 0.00 2.70 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 37 G 9.13 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 0.00 0.00 0.00 38 N 8.41 4.61 0.00 3.10 2.82 0.00 0.00 7.07 8.03 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 39 P 0.00 4.49 0.00 2.09 2.07 0.00 3.66 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 2.02 2.18 0.00 40 I 8.35 4.26 1.86 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 1.10 0.85 0.58 0.00 0.00 41 T 7.56 4.17 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 1.07 0.00 0.00 42 W 7.75 5.42 0.00 3.57 3.03 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 43 S 9.04 4.42 0.00 3.68 3.78 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 44 S 8.46 4.96 0.00 4.26 4.16 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 45 G 8.24 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 0.00 0.00 0.00 46 G 7.82 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 0.00 0.00 0.00 47 V 8.36 3.75 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 0.73 0.00 0.00 0.88 0.00 0.00 48 I 7.30 3.96 1.71 0.00 0.00 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 1.36 0.80 0.63 0.00 0.00 49 G 8.14 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 50 Y 7.44 4.68 0.00 3.30 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 51 K 8.22 4.62 0.00 1.79 1.65 0.00 1.82 0.00 0.00 1.86 0.00 0.00 2.94 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.43 1.45 7.81 52 G 8.57 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 0.00 0.00 0.00 53 S 8.49 4.37 0.00 4.02 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 54 R 7.33 3.93 0.00 1.81 1.91 0.00 3.14 0.00 0.00 3.01 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.55 1.24 0.00 55 K 7.98 4.24 0.00 2.07 2.16 0.00 1.88 0.00 0.00 1.87 0.00 0.00 3.06 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.67 1.64 7.81 56 G 7.84 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 0.00 0.00 0.00 57 T 7.60 4.22 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 1.27 0.00 0.00 58 P 0.00 4.24 0.00 2.31 2.35 0.00 3.75 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 2.15 2.07 0.00 59 Y 8.17 4.24 0.00 3.11 3.13 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 60 A 8.14 3.71 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 61 A 8.25 4.22 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 62 Q 7.67 4.17 0.00 2.14 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.58 0.00 0.00 0.00 0.00 0.00 2.25 2.38 0.00 63 L 7.84 3.74 0.00 1.46 1.53 0.70 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 64 A 8.46 3.86 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 65 A 7.58 3.99 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 66 L 7.89 4.07 0.00 1.85 1.61 0.90 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 67 D 8.58 4.36 0.00 2.53 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 68 A 8.63 3.89 1.36 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 0.00 0.00 0.00 69 A 8.23 3.91 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 70 K 9.12 3.63 0.00 2.04 1.87 0.00 1.62 0.00 0.00 1.61 0.00 0.00 2.96 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.45 1.49 7.81 71 K 8.54 4.04 0.00 1.81 1.70 0.00 1.52 0.00 0.00 1.44 0.00 0.00 2.83 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.36 1.49 7.81 72 A 7.73 4.25 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 73 M 8.62 4.13 0.00 1.97 2.15 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.80 0.00 74 A 7.52 4.27 1.52 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 0.00 0.00 0.00 75 Y 7.92 4.46 0.00 3.02 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 76 G 8.18 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 0.00 0.00 0.00 77 M 8.19 4.47 0.00 1.92 2.04 0.00 0.00 0.00 0.00 0.00 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.55 0.00 78 Q 8.29 4.42 0.00 1.98 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.69 0.00 0.00 0.00 0.00 0.00 2.34 2.34 0.00 79 S 7.88 5.26 0.00 3.87 4.19 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 80 V 7.83 4.83 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 1.18 0.00 0.00 0.90 0.00 0.00 81 D 8.34 5.06 0.00 2.56 2.50 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 82 V 8.23 4.40 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 0.92 0.00 0.00 0.90 0.00 0.00 83 I 8.68 4.98 1.53 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 1.22 0.41 1.20 0.00 0.00 84 V 8.50 4.79 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 0.74 0.00 0.00 1.07 0.00 0.00 85 R 9.14 4.76 0.00 1.76 1.77 0.00 3.13 0.00 0.00 3.19 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.63 0.00 86 G 9.21 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 0.00 0.00 0.00 0.00 87 T 7.90 4.59 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 1.21 0.00 0.00 88 G 8.15 3.83 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 0.00 0.00 0.00 89 A 8.08 3.70 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 90 G 6.44 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 91 R 9.37 3.98 0.00 2.04 1.89 0.00 3.09 0.00 0.00 3.17 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 92 E 8.21 3.85 0.00 2.11 1.93 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 2.38 2.44 0.00 93 Q 8.17 3.89 0.00 2.21 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.69 0.00 0.00 0.00 0.00 0.00 2.70 2.57 0.00 94 A 7.58 3.96 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 95 I 7.77 3.66 1.94 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 1.62 0.91 0.91 0.00 0.00 96 R 8.10 3.92 0.00 1.85 2.02 0.00 3.13 0.00 0.00 3.35 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.84 0.00 97 A 8.35 4.11 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 98 L 7.92 4.36 0.00 1.78 1.70 0.91 0.81 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 99 Q 7.80 4.21 0.00 2.18 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.22 6.98 0.00 0.00 0.00 0.00 0.00 2.52 2.50 0.00 100 A 7.99 4.12 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 0.00 101 S 7.35 4.05 0.00 3.99 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 0.00 102 G 7.49 3.30 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 0.00 103 L 7.55 4.52 0.00 1.64 1.77 0.93 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 104 Q 8.98 4.24 0.00 2.07 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 7.05 0.00 0.00 0.00 0.00 0.00 2.29 2.32 0.00 105 V 8.12 4.19 2.06 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 0.91 0.00 0.00 1.01 0.00 0.00 106 K 8.40 3.99 0.00 1.71 1.83 0.00 1.74 0.00 0.00 2.15 0.00 0.00 2.94 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.56 1.60 7.81 107 S 7.75 4.71 0.00 3.83 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 0.00 108 I 8.24 4.98 1.86 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 1.21 0.66 0.90 0.00 0.00 109 V 8.25 4.38 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 0.95 0.00 0.00 0.92 0.00 0.00 110 D 8.81 4.98 0.00 2.72 2.55 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 0.00 111 D 8.91 4.76 0.00 2.71 2.55 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 0.00 112 T 8.00 4.43 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 1.25 0.00 0.00 113 P 0.00 4.15 0.00 2.17 2.14 0.00 3.74 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 2.01 1.98 0.00 114 V 7.91 4.20 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 0.87 0.00 0.00 0.97 0.00 0.00 115 P 0.00 4.29 0.00 2.19 2.07 0.00 3.77 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.99 0.00 116 H 8.40 4.57 0.00 3.17 3.30 0.00 5.85 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 N 7.99 4.10 0.00 2.88 2.87 0.00 0.00 6.95 7.65 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 0.00 118 G 8.16 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 0.00 119 C 8.38 4.38 0.00 2.95 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 0.00 120 R 8.15 4.21 0.00 1.76 1.81 0.00 3.23 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.64 0.00 121 P 0.00 4.42 0.00 2.12 1.98 0.00 3.75 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 2.04 2.10 0.00 122 K 8.81 3.91 0.00 1.67 1.73 0.00 1.56 0.00 0.00 1.51 0.00 0.00 2.79 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.28 7.81 123 K 8.26 4.46 0.00 1.82 1.77 0.00 1.74 0.00 0.00 1.75 0.00 0.00 2.87 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.52 1.50 7.81 124 K 7.61 3.93 0.00 2.00 2.11 0.00 1.57 0.00 0.00 1.58 0.00 0.00 3.14 0.00 0.00 3.28 0.00 0.00 0.00 0.00 1.39 1.45 7.81 125 F 8.73 4.18 0.00 2.91 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 0.00 126 R 7.86 4.00 0.00 1.87 2.13 0.00 3.27 0.00 0.00 3.24 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.61 0.00 127 K 7.25 4.36 0.00 1.87 2.14 0.00 1.70 0.00 0.00 1.71 0.00 0.00 3.02 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.42 1.52 7.81 128 A 8.52 4.56 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 0.00 129 S 9.20 4.55 0.00 3.95 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