NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 4 G 3.9981 8.3549 109.7418 45.5429 0.0000 173.1387 5 S 4.3747 8.6895 113.8461 60.3960 63.6074 175.4103 6 R 3.8341 8.1595 120.4772 59.3917 31.2978 177.2747 7 R 3.6341 8.0565 116.8838 59.4277 29.7246 176.3475 8 Y 4.4209 7.9948 111.9945 57.7018 38.1787 174.9250 9 D 4.5608 7.7330 121.1413 53.7774 41.2601 176.4735 10 S 4.1447 8.7354 123.5575 59.6473 63.3145 173.9454 11 R 3.7968 8.6139 120.2822 57.0610 26.6811 176.9823 12 T 3.7838 7.8339 107.6194 63.3754 70.0008 175.5911 13 T 4.5768 7.1948 112.5551 61.2384 69.2090 173.1400 14 I 4.5123 7.3060 113.9095 59.6861 41.0368 174.7142 15 F 4.9042 8.4329 119.8845 56.6558 40.0290 176.1836 16 S 4.6626 8.5286 118.6695 55.8974 64.0413 173.4647 17 P 3.7066 0.0000 0.0000 65.7169 31.0371 177.4095 18 E 4.1427 8.1172 114.8585 56.2004 29.7863 176.0593 19 G 3.5347 8.7323 107.8585 47.0222 0.0000 173.7383 20 R 4.6335 7.8517 116.4143 53.6635 33.9199 175.7357 21 L 4.6548 7.9848 119.9511 53.6512 41.9057 177.0199 22 Y 3.6504 7.2764 120.9003 61.5661 37.8403 178.9028 23 Q 4.0125 8.0468 117.7510 59.1903 28.9102 179.4215 24 V 3.5738 7.5915 118.5558 66.0140 31.6898 177.8013 25 E 3.9753 8.1109 118.3219 59.7495 29.2904 179.0372 26 Y 4.4737 8.1251 116.7340 60.8375 37.7927 178.2457 27 A 4.0520 8.4337 122.2071 55.1006 18.5139 179.5432 28 L 3.9215 8.1237 117.6089 58.0420 41.4899 179.2778 29 E 3.9557 8.0756 118.0405 59.3265 29.7809 178.6847 30 S 4.3069 8.0677 113.0693 61.5541 62.5078 175.9981 31 I 3.7164 7.9652 123.0442 64.4933 36.6720 178.3060 32 S 4.2389 8.0588 113.3719 60.7492 62.7376 175.1060 33 H 4.6717 7.9069 117.9814 54.8505 29.3083 174.7938 34 A 4.3647 7.5769 124.9011 50.8010 19.4568 177.5709 35 G 4.0166 8.5110 106.9160 46.4193 0.0000 173.5669 36 T 4.3258 8.6551 120.5364 63.4166 69.9079 173.1606 37 A 5.1636 8.5070 126.1499 50.2134 21.9572 175.2506 38 I 4.5248 9.4164 123.6728 59.3403 40.6850 175.1263 39 G 4.3417 8.6513 111.8900 44.6239 0.0000 171.7822 40 I 4.6910 8.8871 126.9563 59.4973 40.6733 174.2168 41 M 4.7815 8.8126 126.6133 54.0567 33.5251 175.2490 42 A 4.6854 8.5820 130.6996 50.4739 21.5378 176.3351 43 S 4.3662 8.6076 112.0025 60.5967 63.3555 174.7287 44 D 4.8801 9.2795 119.3105 50.3513 39.6901 176.2154 45 G 4.1676 6.9542 107.6628 45.7881 0.0000 171.6593 46 I 5.0928 7.5932 119.1433 59.3803 41.0917 175.4788 47 V 4.4810 8.9427 124.9586 61.0508 34.4586 174.1425 48 L 5.2767 8.6422 126.4877 52.9413 44.3329 175.6697 49 A 4.8868 9.1147 124.7859 50.2476 22.7064 174.5216 50 A 4.9704 8.3908 120.9539 50.5076 22.6521 175.2455 51 E 4.3798 9.1818 123.0488 54.4922 31.1215 175.8650 52 R 4.0418 8.5781 127.0728 56.1494 30.5516 176.2145 53 K 4.0987 8.5772 124.6952 56.4205 33.1417 172.9610 54 V 3.1697 8.5220 130.7631 62.8164 32.2543 171.4364 55 T 4.6340 8.0552 114.4044 61.0226 71.4561 171.8417 56 S 4.6445 8.0363 114.4059 57.0026 65.4735 174.6136 57 T 3.9390 8.4264 119.6366 66.1156 68.2683 175.8742 58 L 4.2603 7.5420 119.2894 55.4073 42.2513 176.8744 59 L 3.8537 7.2373 121.0758 54.9125 42.1592 175.9386 60 E 4.0979 8.7095 127.4569 56.0665 29.7823 175.6485 61 Q 4.2364 8.6108 128.1388 58.2166 29.8401 177.3678 62 D 4.3854 8.1466 116.7501 57.0197 40.9170 176.9984 63 T 4.3589 7.7509 112.5937 63.2492 69.1306 174.3302 63A S 4.5398 7.4608 116.6176 57.7575 63.5222 174.3821 64 T 4.1273 7.8333 119.7507 63.3832 69.7769 172.8587 65 E 4.8208 8.4543 122.6464 54.7238 31.5472 176.9345 66 K 4.6366 7.6889 116.4252 55.5967 35.6715 175.3990 67 L 5.1477 7.6238 119.2046 53.0641 43.7095 175.5957 68 Y 4.8128 8.8303 121.6373 55.8611 41.7325 174.9897 69 K 4.2663 8.8245 124.4345 55.6760 33.2327 176.1467 70 L 4.4292 8.5215 125.5597 56.0741 42.9483 175.2475 71 N 4.8821 7.6856 113.6921 52.8605 41.6896 173.0237 72 D 4.6680 8.6279 116.4432 55.5423 41.5147 177.0694 73 K 4.6816 7.9608 116.4423 55.6081 35.4584 175.6653 74 I 5.1076 7.7624 120.1919 59.6430 40.3548 174.4361 75 A 5.0741 8.5937 125.0094 50.9814 23.1340 175.5847 76 V 4.9638 8.9774 112.0235 59.5173 36.5366 174.4421 77 A 5.3032 8.8142 124.4540 50.3275 21.4363 175.7327 78 V 4.5956 8.8136 122.3581 61.2643 34.0477 175.5056 79 A 4.2813 8.9133 127.5065 53.1101 21.5420 174.0964 80 G 3.6579 8.6800 112.4601 45.0719 0.0000 172.7675 81 L 4.0716 8.6755 125.6174 54.9892 41.7489 177.7385 82 T 3.8496 8.8816 121.3988 66.7747 68.3359 176.0217 83 A 4.0015 8.0673 121.7947 55.5385 18.3498 179.2448 84 D 4.4413 8.1361 116.4467 57.4085 40.9812 178.6568 85 A 3.9617 8.0888 121.3604 55.3209 18.3916 179.4867 86 E 3.7719 8.4003 117.3355 59.3924 29.3151 179.5838 87 I 3.6846 7.5323 119.5772 64.5486 37.1821 178.4006 88 L 3.7937 7.5356 119.0714 57.7504 41.3491 179.6393 89 I 3.4963 8.1455 120.0894 64.3684 37.1596 177.9462 90 N 4.2779 8.2012 118.0203 56.9365 38.7447 177.0464 91 T 3.9164 7.7690 110.8676 64.4569 68.8099 176.4565 92 A 3.9292 8.0860 123.8812 55.2536 18.4365 179.8232 93 R 3.9254 8.3042 116.8345 59.3868 29.9568 179.5056 94 I 3.7918 7.6089 119.3733 64.4876 37.1956 177.7577 95 H 4.2194 8.4943 119.0330 59.1341 29.6397 177.0004 96 A 3.9579 8.0214 122.5299 55.5580 18.2830 179.7700 97 Q 4.0478 7.9788 115.9783 58.9219 28.6304 178.7345 98 N 4.3361 8.6076 118.1643 56.3620 38.5430 176.6207 99 Y 3.9277 8.0969 120.8851 60.7861 38.9201 178.0047 100 L 4.5382 8.1051 122.4850 57.6433 41.9176 178.8824 101 K 3.9787 7.9049 118.8072 59.5047 32.1719 178.7816 102 T 3.7722 7.8189 115.6406 65.8073 68.4951 175.0632 103 Y 4.5289 7.5140 114.9861 56.7928 39.3436 175.2792 104 N 4.4154 8.2618 116.1525 53.8146 36.7958 173.8617 105 E 4.8505 7.8368 114.4210 54.6560 33.9266 174.9938 106 D 4.6641 8.5619 121.5349 54.0320 41.5832 176.2691 107 I 2.7167 8.0685 123.1092 59.6180 38.5323 174.0497 108 P 4.1015 0.0000 0.0000 62.7218 32.1642 176.9136 109 V 3.4366 8.4344 122.5826 66.4994 31.3163 178.1625 110 E 3.8014 7.9573 118.0547 59.1648 29.4962 178.4604 111 I 3.6614 7.3881 119.7949 64.3023 37.2046 178.1612 112 L 3.9489 7.5716 120.6346 58.0164 42.0201 179.0128 113 V 2.9635 7.3108 118.0496 65.7015 31.3508 178.0517 114 R 3.8490 8.4213 118.8772 59.0461 29.9785 178.5380 115 R 3.8124 7.7260 118.2501 59.4292 30.1601 178.4102 116 L 3.9641 7.6774 118.4731 58.0713 41.6333 179.8083 117 S 4.2160 8.1056 114.9636 61.7261 62.7158 176.5107 118 D 4.5057 8.2493 121.6556 57.1877 40.2628 178.8354 119 I 3.7720 7.3568 119.1824 64.4029 37.3470 178.1311 120 K 4.2363 8.0167 119.1569 59.8230 31.9891 179.1160 121 Q 4.1544 8.7760 120.1106 59.0724 28.8161 178.7930 122 G 3.6252 8.1503 106.9088 47.9590 0.0000 174.8974 123 Y 4.0045 7.9904 116.2191 59.4559 37.8200 177.4958 124 T 4.2781 7.6421 116.6371 64.2819 69.4286 175.0864 125 Q 4.3936 7.6442 119.8675 56.4307 30.5845 174.4825 126 H 4.6971 7.6029 110.5119 55.1915 30.8361 172.7254 127 G 3.8558 9.4981 108.5408 44.5679 0.0000 175.5948 128 G 4.1411 8.0976 105.4860 46.0784 0.0000 173.0306 129 L 4.7179 6.9380 118.5049 52.1567 43.8733 176.7845 130 R 4.1200 8.1595 117.0599 55.3909 30.1290 174.7260 131 P 4.5271 0.0000 0.0000 62.0854 32.2772 175.7440 132 F 4.4006 8.4549 118.4859 57.2545 40.2231 177.4972 133 G 4.0400 8.7016 115.0884 44.9215 0.0000 172.7727 134 V 4.8852 7.3231 118.3024 61.4472 35.8999 175.0438 135 S 4.6754 8.5813 121.6054 56.7320 66.4494 173.0596 136 F 5.3019 8.8443 122.0882 55.6747 42.0568 174.9019 137 I 4.5196 8.3019 122.0652 59.9336 39.8024 174.0422 138 Y 4.9962 8.9240 124.9290 56.4088 39.8516 175.2179 139 A 4.6595 9.4973 126.3804 50.3448 21.4373 175.0041 140 G 5.1624 8.5068 107.2915 45.8606 0.0000 169.7444 141 Y 4.9668 8.3998 119.7753 55.9471 41.7165 173.7299 142 D 4.6408 7.4333 124.1438 51.7627 42.6595 173.7761 143 D 4.6144 8.2998 116.7467 53.6595 39.7966 176.4569 144 R 4.0844 8.3685 126.3843 57.3131 30.2684 174.7449 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 4 G 8.35 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 S 8.69 4.37 0.00 4.04 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 6 R 8.16 3.83 0.00 1.84 1.91 0.00 3.17 0.00 0.00 3.25 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 7 R 8.06 3.63 0.00 1.51 1.10 0.00 2.34 0.00 0.00 2.93 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.37 0.00 8 Y 7.99 4.42 0.00 2.95 2.98 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 9 D 7.73 4.56 0.00 2.71 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 0.00 0.00 0.00 0.00 10 S 8.74 4.14 0.00 3.91 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 11 R 8.61 3.80 0.00 2.01 1.97 0.00 3.12 0.00 0.00 3.21 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.65 0.00 12 T 7.83 3.78 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 1.22 0.00 0.00 13 T 7.19 4.58 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 1.19 0.00 0.00 14 I 7.31 4.51 1.97 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 1.70 1.20 0.93 0.00 0.00 15 F 8.43 4.90 0.00 3.09 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 16 S 8.53 4.66 0.00 3.69 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 17 P 0.00 3.71 0.00 2.09 2.20 0.00 3.76 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 18 E 8.12 4.14 0.00 1.88 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 0.00 2.29 2.35 0.00 19 G 8.73 3.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 R 7.85 4.63 0.00 1.65 1.77 0.00 3.05 0.00 0.00 3.10 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.50 0.00 21 L 7.98 4.65 0.00 1.58 1.50 0.83 0.26 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 22 Y 7.28 3.65 0.00 2.87 2.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 Q 8.05 4.01 0.00 2.14 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.91 0.00 0.00 0.00 0.00 0.00 2.49 2.46 0.00 24 V 7.59 3.57 2.17 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 1.07 0.00 0.00 0.91 0.00 0.00 25 E 8.11 3.98 0.00 1.95 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 2.39 2.35 0.00 26 Y 8.13 4.47 0.00 3.00 2.91 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 27 A 8.43 4.05 1.43 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 0.00 0.00 28 L 8.12 3.92 0.00 1.94 1.76 0.94 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 29 E 8.08 3.96 0.00 2.15 2.25 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 2.38 2.45 0.00 30 S 8.07 4.31 0.00 4.00 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 31 I 7.97 3.72 1.98 0.00 0.00 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 1.80 0.74 0.94 0.00 0.00 32 S 8.06 4.24 0.00 3.95 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 33 H 7.91 4.67 0.00 3.29 3.36 0.00 5.65 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.58 4.36 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 35 G 8.51 4.02 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 0.00 0.00 0.00 36 T 8.66 4.33 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 37 A 8.51 5.16 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 38 I 9.42 4.52 1.87 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 1.16 0.98 0.92 0.00 0.00 39 G 8.65 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 0.00 0.00 0.00 0.00 40 I 8.89 4.69 1.88 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 1.12 0.77 0.92 0.00 0.00 41 M 8.81 4.78 0.00 2.03 1.98 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 2.52 2.55 0.00 42 A 8.58 4.69 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 43 S 8.61 4.37 0.00 4.00 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 44 D 9.28 4.88 0.00 2.77 2.75 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 45 G 6.95 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 0.00 0.00 0.00 46 I 7.59 5.09 1.90 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 0.76 0.97 0.00 0.00 47 V 8.94 4.48 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 1.07 0.00 0.00 0.93 0.00 0.00 48 L 8.64 5.28 0.00 1.52 1.54 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 49 A 9.11 4.89 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 50 A 8.39 4.97 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 51 E 9.18 4.38 0.00 2.02 1.83 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 2.24 2.27 0.00 52 R 8.58 4.04 0.00 1.83 1.94 0.00 3.24 0.00 0.00 3.14 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.60 0.00 53 K 8.58 4.10 0.00 1.71 1.70 0.00 2.04 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.40 1.42 7.81 54 V 8.52 3.17 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 0.84 0.00 0.00 0.93 0.00 0.00 55 T 8.06 4.63 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 56 S 8.04 4.64 0.00 3.82 3.69 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 57 T 8.43 3.94 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 58 L 7.54 4.26 0.00 1.64 1.71 0.92 0.84 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 59 L 7.24 3.85 0.00 1.59 1.74 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 60 E 8.71 4.10 0.00 1.95 1.86 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 2.29 2.35 0.00 61 Q 8.61 4.24 0.00 2.11 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.26 6.67 0.00 0.00 0.00 0.00 0.00 2.37 2.36 0.00 62 D 8.15 4.39 0.00 2.68 2.71 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 63 T 7.75 4.36 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 63A S 7.46 4.54 0.00 4.03 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 64 T 7.83 4.13 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 0.67 0.00 0.00 65 E 8.45 4.82 0.00 2.07 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 2.13 2.22 0.00 66 K 7.69 4.64 0.00 1.63 1.81 0.00 1.68 0.00 0.00 1.80 0.00 0.00 2.91 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.42 1.41 7.81 67 L 7.62 5.15 0.00 1.33 1.47 0.90 0.72 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 68 Y 8.83 4.81 0.00 2.89 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 69 K 8.82 4.27 0.00 1.74 1.76 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.93 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.51 1.49 7.81 70 L 8.52 4.43 0.00 1.68 1.69 0.90 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 0.00 0.00 0.00 0.00 0.00 0.00 71 N 7.69 4.88 0.00 2.65 2.79 0.00 0.00 7.24 8.37 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 72 D 8.63 4.67 0.00 2.73 2.71 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 73 K 7.96 4.68 0.00 1.71 2.04 0.00 1.71 0.00 0.00 2.13 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.47 1.47 7.81 74 I 7.76 5.11 1.89 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 1.25 0.91 0.98 0.00 0.00 75 A 8.59 5.07 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 76 V 8.98 4.96 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 0.35 0.00 0.00 0.93 0.00 0.00 77 A 8.81 5.30 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 78 V 8.81 4.60 2.23 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 0.66 0.00 0.00 1.21 0.00 0.00 79 A 8.91 4.28 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 80 G 8.68 3.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 8.68 4.07 0.00 1.65 1.65 0.92 0.87 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 82 T 8.88 3.85 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 1.32 0.00 0.00 83 A 8.07 4.00 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 84 D 8.14 4.44 0.00 2.94 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 85 A 8.09 3.96 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 86 E 8.40 3.77 0.00 2.10 1.94 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 2.00 2.43 0.00 87 I 7.53 3.68 2.10 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 1.79 1.82 0.99 0.00 0.00 88 L 7.54 3.79 0.00 1.86 1.63 0.61 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 89 I 8.15 3.50 1.81 0.00 0.00 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.81 0.78 0.00 0.00 90 N 8.20 4.28 0.00 2.81 2.93 0.00 0.00 7.02 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 T 7.77 3.92 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 1.23 0.00 0.00 92 A 8.09 3.93 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 93 R 8.30 3.93 0.00 2.00 2.00 0.00 3.12 0.00 0.00 3.18 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 1.81 0.00 94 I 7.61 3.79 2.04 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 1.42 0.83 0.94 0.00 0.00 95 H 8.49 4.22 0.00 3.23 3.45 0.00 5.79 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 96 A 8.02 3.96 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 97 Q 7.98 4.05 0.00 2.21 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.41 6.76 0.00 0.00 0.00 0.00 0.00 2.59 2.56 0.00 98 N 8.61 4.34 0.00 2.92 2.89 0.00 0.00 6.56 7.15 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 99 Y 8.10 3.93 0.00 3.17 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 0.00 100 L 8.11 4.54 0.00 1.92 1.89 1.04 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 101 K 7.90 3.98 0.00 1.87 1.91 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.39 1.44 7.81 102 T 7.82 3.77 3.52 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 0.09 0.00 0.00 103 Y 7.51 4.53 0.00 2.61 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 0.00 104 N 8.26 4.42 0.00 2.90 2.93 0.00 0.00 6.72 7.15 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 0.00 105 E 7.84 4.85 0.00 2.15 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 0.00 2.35 2.55 0.00 106 D 8.56 4.66 0.00 2.69 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 0.00 107 I 8.07 2.72 1.51 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 -0.36 0.75 0.00 0.00 108 P 0.00 4.10 0.00 2.01 1.82 0.00 2.86 0.00 0.00 3.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 1.95 0.00 109 V 8.43 3.44 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 0.92 0.00 0.00 0.89 0.00 0.00 110 E 7.96 3.80 0.00 1.97 1.82 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 2.28 2.30 0.00 111 I 7.39 3.66 1.77 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 1.34 0.89 0.87 0.00 0.00 112 L 7.57 3.95 0.00 1.56 1.68 0.87 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 113 V 7.31 2.96 1.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.33 0.00 0.00 0.01 0.00 0.00 114 R 8.42 3.85 0.00 1.79 1.85 0.00 3.13 0.00 0.00 3.08 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.61 0.00 115 R 7.73 3.81 0.00 2.00 2.07 0.00 3.14 0.00 0.00 3.05 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.13 1.59 0.00 116 L 7.68 3.96 0.00 1.72 1.74 0.74 0.74 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 0.00 117 S 8.11 4.22 0.00 4.02 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 0.00 118 D 8.25 4.51 0.00 2.92 2.74 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 0.00 119 I 7.36 3.77 2.06 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 1.78 0.71 0.98 0.00 0.00 120 K 8.02 4.24 0.00 2.09 1.97 0.00 1.79 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.49 1.57 7.81 121 Q 8.78 4.15 0.00 2.17 2.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.39 2.56 0.00 122 G 8.15 3.63 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 0.00 0.00 0.00 123 Y 7.99 4.00 0.00 3.12 3.04 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 0.00 0.00 0.00 124 T 7.64 4.28 4.48 0.00 0.00 0.00 0.00 0.00 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 0.00 125 Q 7.64 4.39 0.00 1.96 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.45 6.63 0.00 0.00 0.00 0.00 0.00 2.29 2.23 0.00 126 H 7.60 4.70 0.00 3.18 3.20 0.00 5.75 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 0.00 127 G 9.50 3.86 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 0.00 0.00 0.00 128 G 8.10 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 0.00 129 L 6.94 4.72 0.00 1.47 1.61 0.88 0.82 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 0.00 130 R 8.16 4.12 0.00 1.91 1.92 0.00 3.00 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.53 0.00 131 P 0.00 4.53 0.00 2.09 2.10 0.00 3.67 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.13 0.00 132 F 8.45 4.40 0.00 2.90 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 0.00 133 G 8.70 4.04 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 0.00 0.00 0.00 0.00 0.00 0.00 134 V 7.32 4.89 1.85 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 -0.23 0.00 0.00 0.83 0.00 0.00 135 S 8.58 4.68 0.00 3.81 3.63 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 0.00 136 F 8.84 5.30 0.00 2.56 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 0.00 0.00 0.00 0.00 137 I 8.30 4.52 1.88 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 1.26 0.74 0.95 0.00 0.00 138 Y 8.92 5.00 0.00 2.77 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 0.00 139 A 9.50 4.66 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 0.00 140 G 8.51 5.16 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 0.00 0.00 0.00 141 Y 8.40 4.97 0.00 2.98 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 0.00 142 D 7.43 4.64 0.00 2.58 2.42 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 0.00 143 D 8.30 4.61 0.00 2.82 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 0.00 144 R 8.37 4.08 0.00 1.61 1.80 0.00 3.23 0.00 0.00 3.19 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 1.47 0.00