NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.1967 8.3044 120.3535 51.3054 34.5548 174.0985 2 L 3.7752 9.6087 127.2677 54.4826 41.6995 171.9511 3 M 4.0144 8.6491 123.0448 53.2877 34.4356 172.1295 4 P 4.4585 0.0000 0.0000 63.0989 31.7972 177.2287 5 R 4.2001 8.4924 120.4783 57.9124 30.6879 177.2073 6 R 4.4562 7.5472 115.3618 55.5926 33.8112 173.9683 7 M 4.8837 8.3862 122.0428 53.2596 35.2825 176.0795 8 K 3.9677 8.5135 119.6910 58.5378 32.6951 177.3799 9 Y 4.8249 7.5054 114.5387 55.9940 41.7924 175.2990 10 R 4.1212 9.0570 123.6804 58.8831 30.4721 177.0541 11 K 4.7297 7.8202 114.9173 54.5583 35.0680 175.3409 12 Q 4.5116 8.0545 117.5672 54.2635 31.5243 174.3674 13 Q 4.1960 8.4253 118.2291 56.4298 29.4809 177.5463 14 R 4.1494 8.7500 117.7179 58.7108 30.4664 178.6535 15 G 4.0325 8.1443 105.2952 44.7023 0.0000 171.9730 16 R 4.6365 8.1455 117.3490 54.0200 32.9291 174.7421 17 L 4.4767 8.2827 122.3833 53.4880 43.1590 176.6567 18 K 4.1186 9.2677 126.3819 57.0288 30.8653 176.8832 19 G 4.2640 8.9853 113.0477 47.1691 0.0000 176.2285 20 A 4.5930 7.6434 121.7152 51.0882 17.8141 179.1101 21 T 4.2398 8.8790 114.4645 64.9863 74.1714 174.7221 22 K 3.7662 8.6008 119.0237 56.0518 31.7133 174.6717 23 G 4.1288 8.3106 108.8426 46.9195 0.0000 171.8976 24 G 3.6201 7.7514 105.9810 46.4736 0.0000 174.7301 25 D 5.2445 8.1183 117.0848 52.3836 40.2650 175.3714 26 Y 5.4377 6.9569 117.0244 55.0511 41.4119 175.5406 27 V 3.7281 9.0096 120.8221 65.3864 31.6372 178.5137 28 A 4.0086 8.5528 117.2857 53.4859 19.2072 176.6876 29 F 4.7531 9.1214 109.8108 57.1430 38.8325 178.9618 30 G 4.2846 7.3563 121.9533 46.8964 0.0000 172.1850 31 D 4.3946 8.6384 117.9192 56.6030 41.4613 177.1859 32 Y 5.1130 8.1126 114.2233 56.1420 42.5389 174.8664 33 G 4.6973 8.8651 107.9306 44.4590 0.0000 170.7952 34 L 5.5800 8.9024 121.2324 53.0479 45.0454 175.6013 35 V 5.1557 8.8962 124.7702 59.7893 34.8871 174.3337 36 A 4.6261 8.7771 123.9174 51.7470 19.5768 177.9374 37 L 4.6210 8.5191 121.1817 55.3607 43.6401 176.9423 38 E 4.8915 7.8843 116.0488 53.3731 32.4078 174.1553 39 P 4.8618 0.0000 0.0000 63.2457 32.5470 174.8637 40 A 4.2391 8.4281 121.8534 51.7645 23.5596 174.9358 41 W 5.3818 8.7356 119.2450 55.6430 30.5864 176.2636 42 I 4.6860 8.8059 127.1459 60.0273 38.3948 175.6953 43 T 4.5123 9.5088 118.1037 60.7505 70.0458 175.3255 44 A 3.9432 8.7319 128.3456 55.7448 18.3558 179.6975 45 Q 4.3841 8.0886 108.5929 57.3718 29.0768 177.0556 46 Q 4.3641 8.7540 119.4441 58.4011 29.5193 177.8014 47 I 3.9446 7.6427 120.1302 64.5569 36.8567 177.8768 48 E 4.0788 8.5864 119.1997 58.1812 29.3518 178.3765 49 A 4.0972 7.8390 120.3004 55.2763 18.7878 179.1632 50 A 3.7504 7.9334 118.8204 54.9766 18.5696 179.2983 51 R 4.1233 8.2882 116.9191 59.8462 30.1796 178.7121 52 V 3.5366 7.5154 116.4867 66.0377 31.4851 177.8819 53 A 4.0007 8.0471 120.2662 55.2187 17.8790 178.6406 54 M 3.6446 8.4962 118.0045 58.4091 32.4302 178.2909 55 V 3.3898 7.8942 111.9070 64.8766 31.7809 178.7541 56 R 3.7701 7.4432 115.8778 59.7279 29.9918 177.5964 57 H 4.2324 7.4516 116.8243 57.9472 31.2000 175.1591 58 F 4.9194 7.6512 116.7502 53.5499 37.3991 173.1751 59 R 4.0765 8.3754 125.6992 59.1099 30.5647 176.4347 60 R 3.8655 8.9338 119.1095 57.0292 27.9030 177.2811 61 G 3.8258 7.9817 107.6554 45.0156 0.0000 177.0437 62 G 4.0134 7.3885 110.8237 44.6982 0.0000 175.4236 63 K 4.5133 9.1654 126.9603 54.3511 35.0043 174.0844 64 I 4.4692 8.4117 127.9695 60.1254 39.0613 175.0545 65 F 5.1068 9.1383 125.9023 55.9395 41.3097 174.8580 66 I 3.6644 8.4268 119.1452 59.2696 36.5002 175.2882 67 R 3.9343 8.3862 130.9601 59.4827 30.3555 176.8606 68 I 4.1971 7.3182 110.0388 59.8460 39.0928 174.7300 69 F 4.7853 8.2361 122.7285 55.9268 41.6028 173.0259 70 P 4.9498 0.0000 0.0000 62.7874 29.1973 175.1452 71 D 4.5845 8.1270 122.7404 53.3052 40.7281 175.7609 72 K 4.4801 7.6616 121.8589 54.5937 34.2112 173.1202 73 P 4.1759 0.0000 0.0000 61.8377 32.5399 174.7948 74 Y 4.4618 8.6468 127.0933 56.9929 39.7875 174.3203 75 T 4.7491 8.0161 123.4396 62.4307 70.5485 174.5129 76 K 4.2635 8.3807 125.1917 55.2751 35.4549 175.8687 77 K 4.1703 8.6304 126.9243 55.4415 32.7589 174.8084 78 P 4.4358 0.0000 0.0000 61.9730 31.9194 176.1979 79 L 3.9995 8.1888 122.1068 56.2884 42.3259 176.3602 80 E 3.7637 8.8106 124.1960 57.5913 26.6097 174.6149 81 V 4.1904 7.6613 111.3393 60.1114 33.6017 175.3396 82 R 4.4989 7.9301 120.2748 54.5825 31.8499 176.3983 83 M 4.0096 8.1687 118.6579 56.8823 32.2933 177.2965 84 G 3.7755 8.3363 107.8972 45.7864 0.0000 172.3038 85 K 3.5194 8.6297 113.5332 56.9767 27.8727 176.5293 86 G 3.9446 7.9036 103.9646 44.9799 0.0000 171.8200 87 K 4.1953 8.1553 119.5512 54.8317 32.9843 176.2862 88 G 3.9561 8.4499 112.5577 46.8351 0.0000 171.8524 89 N 4.8872 8.4116 116.1947 51.8365 41.0123 175.0436 90 V 3.8327 8.0511 120.8853 63.0289 31.4966 175.0994 91 E 4.0726 9.3387 131.1234 58.3747 29.5767 177.0561 92 G 4.0955 7.4208 106.8264 45.6069 0.0000 169.5231 93 Y 5.2209 8.6448 116.4472 56.5167 42.6250 175.0515 94 V 5.3418 9.0642 115.0590 58.6159 36.4296 174.1894 95 A 4.7884 8.0816 121.6592 50.0700 21.9014 175.6300 96 V 4.1588 8.5137 123.5393 63.0001 32.6797 175.4468 97 V 4.4475 8.8911 127.2832 61.2600 33.9926 174.3180 98 K 4.9303 8.5961 126.8466 53.7886 34.8729 174.2766 99 P 4.2705 0.0000 0.0000 64.9276 31.8482 176.8699 100 G 3.9831 10.2976 111.4858 44.8602 0.0000 172.4731 101 R 4.6912 7.5924 120.3490 55.2284 31.7778 175.3496 102 V 4.4057 9.0520 127.5075 63.0383 31.7425 175.1427 103 M 4.2713 9.3086 128.2512 56.9065 33.7009 176.3486 104 F 5.4328 8.2276 115.3955 55.8721 43.6993 174.0497 105 E 5.3655 9.0548 119.2373 55.3461 34.2849 174.9733 106 V 4.8773 8.6921 116.4237 60.0010 35.6477 174.2430 107 A 4.7619 8.4320 120.1003 51.8499 23.0758 176.3078 108 G 3.9591 9.4689 106.0518 45.9368 0.0000 174.2863 109 V 4.2213 7.4981 115.7430 59.7347 34.2435 173.4921 110 T 3.9346 8.2426 115.7151 62.7364 67.4140 173.3961 111 E 3.7601 8.4870 120.1809 57.9695 29.6629 177.4394 112 E 3.8912 7.9939 118.8516 58.6130 29.5542 178.7785 113 Q 4.1354 7.8937 117.6854 58.5993 29.1482 177.6538 114 A 3.9876 7.2965 121.0701 55.5311 18.1253 179.4887 115 M 3.8691 7.7591 116.0331 58.4964 32.3297 178.4696 116 E 3.9787 7.8875 118.7868 59.5790 29.9457 177.9499 117 A 3.5994 8.3742 120.5087 55.8599 18.4284 179.3404 118 L 3.8233 8.3661 116.1671 57.7575 41.5808 180.1276 119 R 3.8727 7.6903 118.0054 59.3601 30.3048 178.3456 120 I 3.8726 7.5293 118.9970 64.2293 37.3331 177.7836 121 A 3.8608 8.0032 121.8170 55.3183 18.0420 179.9576 122 G 3.5088 7.8500 103.4364 48.1557 0.0000 175.3642 123 H 4.4135 8.0418 116.6645 57.2603 28.7844 176.7457 124 K 4.3881 7.4588 118.6374 55.2620 32.6040 175.9067 125 L 4.8309 7.0498 119.6205 52.1968 44.0191 174.9240 126 P 4.4688 0.0000 0.0000 63.7491 31.7119 175.1798 127 I 4.9382 7.1296 111.3220 57.8263 41.3844 174.6866 128 K 4.4413 8.5947 121.2617 56.2359 33.4483 176.6852 129 T 5.7516 7.9723 113.4847 59.5921 72.2590 172.7224 130 K 4.4541 8.1536 119.2045 55.8962 35.3989 175.1577 131 I 4.8968 8.4882 128.0908 61.1622 39.2144 174.6699 132 V 4.4769 8.6436 115.8872 62.1295 36.8007 176.4557 133 R 3.9221 8.7826 123.5795 56.3815 28.2928 176.0141 134 R 4.2624 5.8400 111.7801 55.8699 33.9108 173.6431 135 D 4.3713 7.7610 116.9900 55.4388 39.2862 177.0885 136 A 4.4369 7.8921 126.2871 52.8141 19.2902 178.8900 137 Y 4.3534 7.1435 113.4857 57.7312 36.1503 175.5213 138 D 4.8145 8.3366 129.1297 53.1888 42.3422 175.7078 139 E 4.4530 7.3596 112.4865 56.7947 30.3177 178.6971 140 A 3.9289 7.7026 117.7439 52.9799 18.4060 178.4543 141 Q 4.1202 7.8564 122.2899 56.6813 29.1868 173.3597 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 M 8.30 4.20 0.00 2.01 2.04 0.00 0.00 0.00 0.00 0.00 -0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.52 2.51 0.00 2 L 9.61 3.78 0.00 1.85 2.00 1.21 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 3 M 8.65 4.01 0.00 1.81 0.99 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.41 0.00 4 P 0.00 4.46 0.00 1.89 2.02 0.00 2.55 0.00 0.00 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 2.00 0.00 5 R 8.49 4.20 0.00 1.79 1.97 0.00 3.24 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.66 0.00 6 R 7.55 4.46 0.00 1.74 1.78 0.00 3.13 0.00 0.00 3.21 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.62 0.00 7 M 8.39 4.88 0.00 2.03 1.98 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 2.49 2.55 0.00 8 K 8.51 3.97 0.00 1.67 1.20 0.00 1.71 0.00 0.00 1.79 0.00 0.00 3.00 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.42 7.81 9 Y 7.51 4.82 0.00 2.90 2.82 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 10 R 9.06 4.12 0.00 1.84 2.02 0.00 3.17 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 1.67 1.68 0.00 11 K 7.82 4.73 0.00 1.69 1.64 0.00 1.70 0.00 0.00 1.72 0.00 0.00 3.02 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.29 1.38 7.81 12 Q 8.05 4.51 0.00 2.04 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.99 0.00 0.00 0.00 0.00 0.00 2.17 2.31 0.00 13 Q 8.43 4.20 0.00 2.06 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 7.06 0.00 0.00 0.00 0.00 0.00 2.35 2.35 0.00 14 R 8.75 4.15 0.00 1.97 2.39 0.00 3.44 0.00 0.00 3.43 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.77 0.00 15 G 8.14 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 16 R 8.15 4.64 0.00 1.75 1.79 0.00 3.22 0.00 0.00 3.21 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.58 0.00 17 L 8.28 4.48 0.00 1.66 1.63 0.88 1.09 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 18 K 9.27 4.12 0.00 1.75 1.60 0.00 1.69 0.00 0.00 1.73 0.00 0.00 3.10 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.51 7.81 19 G 8.99 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 0.00 0.00 0.00 0.00 20 A 7.64 4.59 1.08 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 21 T 8.88 4.24 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 1.30 0.00 0.00 22 K 8.60 3.77 0.00 1.87 1.88 0.00 1.94 0.00 0.00 1.72 0.00 0.00 2.82 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.32 1.42 7.81 23 G 8.31 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 24 G 7.75 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 0.00 0.00 0.00 0.00 25 D 8.12 5.24 0.00 2.84 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 26 Y 6.96 5.44 0.00 3.28 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 27 V 9.01 3.73 1.70 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 1.07 0.00 0.00 0.02 0.00 0.00 28 A 8.55 4.01 1.88 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 0.00 0.00 29 F 9.12 4.75 0.00 3.25 2.43 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 30 G 7.36 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 0.00 0.00 0.00 0.00 31 D 8.64 4.39 0.00 2.64 2.36 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 32 Y 8.11 5.11 0.00 2.91 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 33 G 8.87 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 34 L 8.90 5.58 0.00 1.85 1.67 0.99 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 35 V 8.90 5.16 2.18 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 0.83 0.00 0.00 1.08 0.00 0.00 36 A 8.78 4.63 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 37 L 8.52 4.62 0.00 1.58 1.72 0.99 0.69 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 38 E 7.88 4.89 0.00 1.99 2.01 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 2.25 2.26 0.00 39 P 0.00 4.86 0.00 2.09 2.10 0.00 3.81 0.00 0.00 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.96 0.00 40 A 8.43 4.24 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 41 W 8.74 5.38 0.00 3.14 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 42 I 8.81 4.69 1.90 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 1.07 1.04 0.00 0.00 43 T 9.51 4.51 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 1.22 0.00 0.00 44 A 8.73 3.94 1.42 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 0.00 0.00 45 Q 8.09 4.38 0.00 2.19 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.59 6.82 0.00 0.00 0.00 0.00 0.00 2.34 2.35 0.00 46 Q 8.75 4.36 0.00 2.39 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.50 6.84 0.00 0.00 0.00 0.00 0.00 2.32 2.39 0.00 47 I 7.64 3.94 2.06 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.84 1.02 0.00 0.00 48 E 8.59 4.08 0.00 2.21 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 2.34 2.40 0.00 49 A 7.84 4.10 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 50 A 7.93 3.75 1.03 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 51 R 8.29 4.12 0.00 2.04 2.05 0.00 3.17 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.79 0.00 52 V 7.52 3.54 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 0.93 0.00 0.00 0.99 0.00 0.00 53 A 8.05 4.00 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 54 M 8.50 3.64 0.00 1.84 1.98 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.31 2.59 0.00 55 V 7.89 3.39 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 0.84 0.00 0.00 0.92 0.00 0.00 56 R 7.44 3.77 0.00 1.87 1.95 0.00 3.33 0.00 0.00 3.12 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.83 0.00 57 H 7.45 4.23 0.00 3.05 3.26 0.00 5.69 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 F 7.65 4.92 0.00 3.05 3.23 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 59 R 8.38 4.08 0.00 1.86 1.98 0.00 3.37 0.00 0.00 3.23 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 60 R 8.93 3.87 0.00 1.96 2.01 0.00 3.22 0.00 0.00 3.24 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.63 0.00 61 G 7.98 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 62 G 7.39 4.01 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 0.00 63 K 9.17 4.51 0.00 1.73 1.29 0.00 1.75 0.00 0.00 2.02 0.00 0.00 3.06 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.21 1.40 7.81 64 I 8.41 4.47 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 1.52 0.87 1.06 0.00 0.00 65 F 9.14 5.11 0.00 2.96 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 66 I 8.43 3.66 1.73 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 1.26 0.55 0.95 0.00 0.00 67 R 8.39 3.93 0.00 1.71 2.00 0.00 2.91 0.00 0.00 3.14 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.48 0.00 68 I 7.32 4.20 1.84 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 1.04 0.63 0.85 0.00 0.00 69 F 8.24 4.79 0.00 2.77 2.92 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 70 P 0.00 4.95 0.00 2.06 1.95 0.00 2.89 0.00 0.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 1.70 0.00 71 D 8.13 4.58 0.00 2.72 2.86 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 0.00 0.00 0.00 0.00 72 K 7.66 4.48 0.00 1.66 1.44 0.00 1.34 0.00 0.00 0.82 0.00 0.00 2.85 0.00 0.00 2.76 0.00 0.00 0.00 0.00 1.10 1.27 7.81 73 P 0.00 4.18 0.00 1.82 1.62 0.00 3.66 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.39 0.00 74 Y 8.65 4.46 0.00 2.80 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 75 T 8.02 4.75 4.11 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 1.09 0.00 0.00 76 K 8.38 4.26 0.00 1.30 1.45 0.00 1.78 0.00 0.00 1.69 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.28 1.31 7.81 77 K 8.63 4.17 0.00 1.75 1.70 0.00 1.78 0.00 0.00 1.68 0.00 0.00 2.76 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.41 1.42 7.81 78 P 0.00 4.44 0.00 2.02 1.98 0.00 3.65 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.05 0.00 79 L 8.19 4.00 0.00 1.60 1.57 0.92 0.94 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 80 E 8.81 3.76 0.00 2.17 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 2.20 2.31 0.00 81 V 7.66 4.19 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 0.76 0.00 0.00 0.92 0.00 0.00 82 R 7.93 4.50 0.00 1.78 1.86 0.00 3.21 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.62 0.00 83 M 8.17 4.01 0.00 2.00 2.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.60 2.48 0.00 84 G 8.34 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 0.00 0.00 0.00 85 K 8.63 3.52 0.00 1.91 1.94 0.00 1.66 0.00 0.00 1.70 0.00 0.00 2.90 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.31 1.48 7.81 86 G 7.90 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 87 K 8.16 4.20 0.00 1.71 1.68 0.00 1.79 0.00 0.00 1.68 0.00 0.00 2.77 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.34 1.39 7.81 88 G 8.45 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 89 N 8.41 4.89 0.00 2.64 2.69 0.00 0.00 6.47 7.68 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 90 V 8.05 3.83 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 0.37 0.00 0.00 0.87 0.00 0.00 91 E 9.34 4.07 0.00 1.86 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 2.33 2.47 0.00 92 G 7.42 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 93 Y 8.64 5.22 0.00 2.83 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 94 V 9.06 5.34 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 0.69 0.00 0.00 0.20 0.00 0.00 95 A 8.08 4.79 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 96 V 8.51 4.16 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 0.92 0.00 0.00 0.95 0.00 0.00 97 V 8.89 4.45 2.14 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 0.96 0.00 0.00 1.06 0.00 0.00 98 K 8.60 4.93 0.00 1.79 1.83 0.00 1.77 0.00 0.00 1.92 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.48 1.49 7.81 99 P 0.00 4.27 0.00 2.05 2.21 0.00 3.82 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 2.04 2.12 0.00 100 G 10.30 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 0.00 0.00 0.00 101 R 7.59 4.69 0.00 2.02 1.90 0.00 3.32 0.00 0.00 3.08 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.60 0.00 102 V 9.05 4.41 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 0.94 0.00 0.00 1.08 0.00 0.00 103 M 9.31 4.27 0.00 1.97 2.37 0.00 0.00 0.00 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.78 2.54 0.00 104 F 8.23 5.43 0.00 2.98 2.97 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 0.00 0.00 0.00 105 E 9.05 5.37 0.00 2.17 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 2.32 2.37 0.00 106 V 8.69 4.88 2.14 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 0.90 0.00 0.00 1.12 0.00 0.00 107 A 8.43 4.76 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 0.00 108 G 9.47 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 0.00 109 V 7.50 4.22 1.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.49 0.00 0.00 0.64 0.00 0.00 110 T 8.24 3.93 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 1.24 0.00 0.00 111 E 8.49 3.76 0.00 2.11 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 2.05 1.97 0.00 112 E 7.99 3.89 0.00 2.09 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 2.31 2.33 0.00 113 Q 7.89 4.14 0.00 2.10 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.65 0.00 0.00 0.00 0.00 0.00 2.57 2.44 0.00 114 A 7.30 3.99 1.05 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 0.00 115 M 7.76 3.87 0.00 1.92 2.09 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.61 0.00 116 E 7.89 3.98 0.00 2.21 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 0.00 2.48 2.39 0.00 117 A 8.37 3.60 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 0.00 118 L 8.37 3.82 0.00 1.75 1.73 1.02 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 0.00 0.00 0.00 0.00 0.00 0.00 119 R 7.69 3.87 0.00 1.95 2.14 0.00 3.29 0.00 0.00 3.22 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 120 I 7.53 3.87 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 1.73 0.84 0.85 0.00 0.00 121 A 8.00 3.86 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 122 G 7.85 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 0.00 123 H 8.04 4.41 0.00 3.30 3.33 0.00 5.65 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 K 7.46 4.39 0.00 1.80 1.80 0.00 1.65 0.00 0.00 1.69 0.00 0.00 2.97 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.54 1.54 7.81 125 L 7.05 4.83 0.00 1.72 1.58 1.03 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 126 P 0.00 4.47 0.00 2.17 2.16 0.00 3.73 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 2.00 1.96 0.00 127 I 7.13 4.94 1.88 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 1.17 0.99 0.00 0.00 128 K 8.59 4.44 0.00 1.74 1.76 0.00 1.76 0.00 0.00 1.87 0.00 0.00 2.90 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.50 1.43 7.81 129 T 7.97 5.75 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 1.22 0.00 0.00 130 K 8.15 4.45 0.00 1.85 1.69 0.00 1.75 0.00 0.00 1.85 0.00 0.00 2.91 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.45 1.48 7.81 131 I 8.49 4.90 1.92 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 1.37 0.70 1.02 0.00 0.00 132 V 8.64 4.48 2.33 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 0.95 0.00 0.00 1.02 0.00 0.00 133 R 8.78 3.92 0.00 1.82 1.77 0.00 3.34 0.00 0.00 3.15 7.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.34 0.00 134 R 5.84 4.26 0.00 1.77 1.69 0.00 3.28 0.00 0.00 3.45 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.21 0.00 135 D 7.76 4.37 0.00 2.90 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 0.00 136 A 7.89 4.44 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 0.00 137 Y 7.14 4.35 0.00 3.07 3.01 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 0.00 138 D 8.34 4.81 0.00 2.58 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 0.00 139 E 7.36 4.45 0.00 1.22 1.71 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 2.42 2.32 0.00 140 A 7.70 3.93 1.21 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 0.00 141 Q 7.86 4.12 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.06 6.49 0.00 0.00 0.00 0.00 0.00 2.23 2.40 0.00