NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 P 4.4077 0.0000 0.0000 63.6080 33.0037 174.2985 2 I 3.9586 7.9116 119.1808 61.7556 44.3885 170.3467 3 V 3.9664 7.9647 120.7044 62.9593 31.6407 176.6885 4 Q 4.1142 7.4352 121.0780 56.8722 29.8279 175.0543 5 N 4.8867 8.4493 110.8359 52.5723 39.7864 176.5670 6 L 3.7262 8.0750 115.8177 55.5023 40.1984 174.5437 7 Q 4.3905 7.7854 117.2874 55.3225 28.6526 176.7511 8 G 4.2426 7.6104 105.8259 45.7516 0.0000 171.9558 9 Q 4.7172 8.1657 127.6221 55.4858 27.1775 178.3142 10 M 4.1714 8.8238 127.5409 57.5782 31.8474 176.5237 11 V 3.7568 7.4456 119.5120 63.7542 32.1906 174.4515 12 H 5.0032 8.1491 118.2554 55.3843 30.6605 172.7746 13 Q 4.5339 8.4720 117.0481 54.2669 32.9896 174.5851 14 A 4.2727 8.4492 123.6049 51.1325 19.6955 177.2510 15 I 3.4809 8.5857 121.0494 61.1766 38.4223 176.3058 16 S 4.1093 8.7760 121.9561 58.4569 63.3733 172.9382 17 P 4.2795 0.0000 0.0000 65.6586 31.0464 178.7883 18 R 3.9506 8.0085 116.5288 59.7342 30.0626 178.9406 19 T 3.8968 7.7514 114.6929 66.4322 68.5711 176.3616 20 L 4.0146 8.0987 122.1914 58.5031 42.2213 178.6860 21 N 4.3820 8.8397 116.4986 56.3368 38.3327 177.2216 22 A 4.0488 8.1041 122.1766 54.8110 18.4736 179.3308 23 W 4.6366 8.2215 126.8933 61.0873 30.6917 177.8148 24 V 3.2643 7.7467 117.4555 66.0556 30.8915 177.5005 25 K 3.7285 8.1854 118.8459 59.6684 31.9291 178.6582 26 V 3.5452 8.0627 118.4843 66.4230 31.4176 178.3387 27 V 3.3634 7.3707 117.3719 65.3286 30.9777 177.6657 28 E 3.7622 7.9325 119.1202 58.9086 29.5439 177.8635 29 E 4.2668 8.5088 117.4839 57.4360 30.2230 177.6963 30 K 4.3274 8.3123 116.2678 56.5347 33.7414 177.0974 31 A 3.5281 8.0038 122.0340 52.9716 17.4518 177.3643 32 F 5.1497 8.2843 111.8395 58.4173 39.6931 176.3681 33 S 4.3659 7.6886 115.5791 57.1727 63.3718 173.1081 34 P 4.2973 0.0000 0.0000 65.6956 30.4061 177.4143 35 E 4.2136 8.1635 115.5401 57.0354 30.2672 178.6966 36 V 3.9935 8.3829 121.7745 64.8784 31.4491 178.4970 37 I 3.7920 7.4689 120.2964 63.8396 37.0581 176.3191 38 P 4.2578 0.0000 0.0000 66.1767 31.2948 178.6446 39 M 4.1666 7.8776 116.0880 58.1553 31.5566 178.5614 40 F 3.4168 7.8001 119.9407 61.3292 39.9421 176.8784 41 S 3.7449 8.0242 114.3850 61.4446 62.3737 176.7829 42 A 3.9465 7.6683 122.4219 54.8088 18.1588 178.7220 43 L 4.4576 7.3375 115.1429 54.7525 42.5353 177.0490 44 S 4.3128 7.3077 111.8243 57.6826 63.0278 171.3537 45 E 3.6384 8.4718 121.1080 56.4522 29.1858 177.3580 46 G 4.2419 8.6831 116.7790 44.2420 0.0000 170.1846 47 A 4.6158 7.2208 121.7018 50.9967 20.9139 176.9378 48 T 4.3077 8.1647 109.2544 60.6121 71.3113 173.7618 49 P 4.4063 0.0000 0.0000 66.1630 31.3064 178.6851 50 Q 3.9655 8.3668 117.9667 59.4509 29.0926 177.7803 51 D 4.4753 7.7663 119.1458 57.6008 40.8741 179.1967 52 L 4.0187 8.0491 119.1277 58.0188 41.6662 179.2525 53 N 4.5415 8.6538 116.7592 56.5889 38.4365 177.6174 54 T 3.9241 8.5109 117.5071 67.0130 68.7396 176.1255 55 M 4.2822 8.1454 120.3859 58.8205 31.8494 178.6254 56 L 4.2968 8.0401 117.6440 58.3039 42.0901 178.9976 57 N 4.5156 8.5459 116.7135 56.8737 38.6119 176.8714 58 T 4.0246 8.3660 116.9767 66.0003 68.8976 177.3004 59 V 4.4325 7.5653 119.0147 61.1496 32.2932 176.6872 60 G 4.0740 7.9150 103.8586 45.0118 0.0000 175.1535 61 G 4.0877 7.8641 110.8981 48.1923 0.0000 173.5949 62 H 4.8449 7.8483 114.6351 52.4162 31.2005 174.0619 63 Q 4.0070 9.0961 123.5004 59.7835 28.0270 178.1534 64 A 3.9374 8.0940 122.2701 55.6329 18.1810 179.2771 65 A 4.0934 7.7312 116.4995 55.2299 18.9387 179.5152 66 M 3.9915 8.1970 116.6740 58.4994 31.9090 178.8057 67 Q 3.9250 7.9508 119.3764 59.4700 29.1828 177.8405 68 M 4.3401 7.4546 120.2107 57.7950 31.9782 178.6163 69 L 3.9222 8.1507 120.5665 57.7458 42.2868 178.8842 70 K 3.9480 8.2177 120.0036 59.4803 32.2591 178.3270 71 E 3.9677 8.6506 118.2655 60.1013 29.1441 179.3743 72 T 3.9338 7.7043 116.5620 66.1380 68.4811 176.6689 73 I 3.8033 7.8037 121.7084 64.5807 37.1477 178.1139 74 N 4.3129 8.2121 117.0493 56.5001 38.3841 177.3454 75 E 3.8798 8.2044 119.7868 59.4583 29.4889 179.3649 76 E 3.5024 8.2011 118.6125 58.9715 29.2116 179.2250 77 A 3.3022 7.8462 120.9977 54.8572 18.4453 179.6077 78 A 3.9470 8.0702 119.4734 55.0025 18.3592 179.4165 79 E 3.8040 8.1525 117.9516 59.2304 29.5111 178.5709 80 W 4.3334 7.9306 127.0118 61.0371 30.9290 177.3109 81 D 4.6092 8.1166 118.6191 57.1510 39.9997 178.3928 82 R 3.8316 7.7671 119.1684 59.4735 30.0189 177.0911 83 L 4.3617 7.4708 114.4234 56.0674 40.9687 177.1096 84 H 4.6531 7.9544 116.3970 53.4047 29.0760 172.4769 85 P 4.2745 0.0000 0.0000 63.2048 31.6630 178.0170 86 V 3.1755 7.6318 117.7789 65.4506 30.7418 173.8774 87 H 3.6909 8.1011 114.8549 58.4108 26.3514 173.4503 88 A 3.6657 8.2229 123.3011 51.5270 16.1150 178.0375 89 G 4.1773 8.1985 106.2597 46.3626 0.0000 173.5151 90 P 4.5991 0.0000 0.0000 60.4676 30.0909 175.9563 91 I 3.4007 7.4617 113.2476 62.9125 38.2754 172.2578 92 A 3.6684 8.9083 135.0000 50.3920 17.3521 174.9680 93 P 4.5433 0.0000 0.0000 62.4932 31.5775 176.9998 94 G 4.7847 8.3257 124.9629 46.3055 0.0000 172.3078 95 Q 4.2875 6.9461 117.1806 55.2842 29.6282 176.6343 96 M 3.7594 8.7233 120.4532 56.6756 32.3459 174.9919 97 R 4.1825 7.4256 117.5650 54.8148 30.9653 175.3531 98 E 4.2626 8.6841 120.1370 54.9482 30.3394 174.7893 99 P 3.7575 0.0000 0.0000 62.7659 31.8488 176.4176 100 R 4.7269 8.1453 121.8804 54.4943 33.0793 176.9617 101 G 3.9451 9.2832 110.2726 48.3504 0.0000 176.2632 102 S 4.1599 8.0658 116.0145 60.6662 62.9696 176.2541 103 D 4.2521 7.7078 122.3978 57.4587 40.6002 178.4669 104 I 3.1713 7.5498 118.8265 64.0317 37.0105 178.0450 105 A 2.5800 7.5911 120.3486 52.8165 18.2608 178.0522 106 G 3.9573 7.7278 105.5781 45.3622 0.0000 175.2523 107 T 4.0278 7.7437 109.1685 64.1117 68.7809 174.9788 108 T 4.7013 7.9088 111.4494 60.7651 68.8784 173.6497 109 S 4.9943 7.9195 115.4758 57.0176 66.2381 173.1747 110 T 4.2929 8.4936 114.0917 60.6475 71.3941 175.5506 111 L 3.9022 8.4733 123.8197 58.8351 41.8576 179.4917 112 Q 3.8917 7.9315 117.0472 58.8508 28.7092 178.3000 113 E 3.3742 7.6457 119.0249 59.5102 29.4770 179.3457 114 Q 4.4798 8.0565 117.7495 59.2715 28.5416 179.3801 115 I 3.7441 7.3329 119.4071 64.2913 37.6037 178.1040 116 G 3.7008 7.9376 106.8232 47.8891 0.0000 175.6715 117 W 4.3663 7.8319 121.3376 59.5041 28.8777 177.7930 118 M 4.5757 7.9102 115.8104 55.7887 32.8342 177.1420 119 T 4.7345 7.5185 108.5826 59.8749 69.0975 172.0125 120 H 4.7221 7.6355 122.5055 55.3607 33.4505 172.5297 121 N 4.6119 8.1633 121.0886 51.2608 36.7108 172.6665 122 P 4.5743 0.0000 0.0000 60.2559 32.4804 174.3543 123 P 4.3616 0.0000 0.0000 63.2734 31.1115 176.1603 124 I 4.1256 8.1987 125.7617 59.5557 37.1735 176.2986 125 P 4.6038 0.0000 0.0000 61.8858 28.2678 177.3881 126 V 3.2630 7.6515 114.9587 65.4916 31.9224 178.7128 127 G 3.6067 7.8466 105.8254 47.1234 0.0000 175.2617 128 E 3.8406 7.9470 121.3639 58.8962 29.7371 178.7643 129 I 3.4320 7.8517 120.1792 64.5270 37.1602 177.7813 130 Y 3.5003 7.4501 120.2603 60.3862 38.0023 178.0809 131 K 3.8903 8.1823 120.7377 58.9358 32.1688 179.2219 132 R 3.9699 7.7834 118.7395 58.9578 30.1711 178.6006 133 W 4.4595 8.0644 118.2234 60.0068 29.0293 178.3196 134 I 3.5807 7.7171 119.4320 64.5953 36.5170 178.4161 135 I 3.6535 7.4232 119.6408 64.5503 36.5068 178.4807 136 L 4.1827 8.0881 119.8310 57.5777 41.4375 179.9303 137 G 3.5725 7.9530 105.8029 47.5868 0.0000 175.8619 138 L 3.7216 8.0812 122.2895 57.4143 41.7285 179.3504 139 N 4.3641 8.4884 116.5567 55.1558 37.2695 177.1560 140 K 4.0717 7.6621 120.2563 59.2583 31.9959 178.8839 141 I 3.7112 7.3103 119.1925 63.9154 37.2011 177.8990 142 V 3.8183 7.8424 120.3841 65.8129 31.1245 177.8519 143 R 3.9741 7.5290 115.9930 59.5203 30.1573 178.3575 144 M 4.7869 8.1156 117.4292 53.2056 33.6939 176.5334 145 Y 5.6936 6.8080 134.3130 58.6832 41.7421 170.6662 146 S 4.3651 7.6988 123.0900 58.0618 70.0800 174.9749 147 P 4.6575 0.0000 0.0000 61.8847 32.9097 174.0523 148 T 4.2067 7.6431 107.8675 62.3305 69.7459 177.6400 149 S 4.5085 7.3577 121.6047 57.2492 67.0841 174.9231 150 I 4.1150 8.1462 111.4995 60.9644 35.5061 175.7899 151 L 4.2652 7.6621 126.4199 55.6143 41.6856 176.8103 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 P 0.00 4.41 0.00 2.16 2.27 0.00 3.57 0.00 0.00 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.97 2.03 0.00 2 I 7.91 3.96 1.97 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 1.31 0.70 0.92 0.00 0.00 3 V 7.96 3.97 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 0.85 0.00 0.00 0.96 0.00 0.00 4 Q 7.44 4.11 0.00 2.02 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5.33 7.18 0.00 0.00 0.00 0.00 0.00 2.46 2.29 0.00 5 N 8.45 4.89 0.00 2.92 2.73 0.00 0.00 7.22 6.02 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 6 L 8.07 3.73 0.00 1.79 1.78 0.93 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 7 Q 7.79 4.39 0.00 2.16 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.55 0.00 0.00 0.00 0.00 0.00 2.34 2.45 0.00 8 G 7.61 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 0.00 0.00 0.00 0.00 9 Q 8.17 4.72 0.00 2.17 1.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.90 0.00 0.00 0.00 0.00 0.00 2.41 2.43 0.00 10 M 8.82 4.17 0.00 1.97 2.12 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 2.60 2.59 0.00 11 V 7.45 3.76 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 0.77 0.00 0.00 0.97 0.00 0.00 12 H 8.15 5.00 0.00 3.14 3.18 0.00 5.56 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 13 Q 8.47 4.53 0.00 1.86 1.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.92 0.00 0.00 0.00 0.00 0.00 2.22 2.26 0.00 14 A 8.45 4.27 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 15 I 8.59 3.48 1.86 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 1.30 0.83 0.93 0.00 0.00 16 S 8.78 4.11 0.00 3.92 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 17 P 0.00 4.28 0.00 2.21 2.12 0.00 3.67 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.21 0.00 18 R 8.01 3.95 0.00 1.83 2.00 0.00 3.30 0.00 0.00 3.35 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.68 0.00 19 T 7.75 3.90 4.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 20 L 8.10 4.01 0.00 1.77 1.72 0.98 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 21 N 8.84 4.38 0.00 2.93 2.90 0.00 0.00 7.00 8.26 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 22 A 8.10 4.05 1.46 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 0.00 0.00 23 W 8.22 4.64 0.00 3.36 3.37 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 24 V 7.75 3.26 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 1.02 0.00 0.00 25 K 8.19 3.73 0.00 1.84 1.95 0.00 1.74 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.43 1.62 7.81 26 V 8.06 3.55 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 1.22 0.00 0.00 1.10 0.00 0.00 27 V 7.37 3.36 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 0.51 0.00 0.00 -0.43 0.00 0.00 28 E 7.93 3.76 0.00 1.98 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 2.27 0.00 29 E 8.51 4.27 0.00 2.08 1.96 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 2.27 2.47 0.00 30 K 8.31 4.33 0.00 1.96 1.80 0.00 1.69 0.00 0.00 1.66 0.00 0.00 3.03 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.77 1.45 7.81 31 A 8.00 3.53 1.15 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 32 F 8.28 5.15 0.00 2.74 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 33 S 7.69 4.37 0.00 3.96 3.99 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 0.00 0.00 0.00 34 P 0.00 4.30 0.00 2.25 2.39 0.00 3.69 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 2.09 1.99 0.00 35 E 8.16 4.21 0.00 2.23 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 0.00 2.39 2.35 0.00 36 V 8.38 3.99 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 1.01 0.00 0.00 1.35 0.00 0.00 37 I 7.47 3.79 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 1.51 0.53 0.97 0.00 0.00 38 P 0.00 4.26 0.00 2.21 2.14 0.00 3.78 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.16 2.22 0.00 39 M 7.88 4.17 0.00 2.27 2.38 0.00 0.00 0.00 0.00 0.00 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.89 0.00 40 F 7.80 3.42 0.00 2.67 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 41 S 8.02 3.74 0.00 3.97 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 42 A 7.67 3.95 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 43 L 7.34 4.46 0.00 1.40 1.58 1.15 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.31 4.31 0.00 2.95 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 45 E 8.47 3.64 0.00 1.91 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 2.26 2.48 0.00 46 G 8.68 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 0.00 0.00 0.00 0.00 47 A 7.22 4.62 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 48 T 8.16 4.31 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 1.23 0.00 0.00 49 P 0.00 4.41 0.00 2.27 2.13 0.00 3.83 0.00 0.00 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.17 0.00 50 Q 8.37 3.97 0.00 2.16 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.73 0.00 0.00 0.00 0.00 0.00 2.39 2.43 0.00 51 D 7.77 4.48 0.00 2.92 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 52 L 8.05 4.02 0.00 2.12 1.79 0.94 0.70 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 53 N 8.65 4.54 0.00 3.07 2.97 0.00 0.00 7.09 6.87 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 54 T 8.51 3.92 4.53 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 1.28 0.00 0.00 55 M 8.15 4.28 0.00 1.97 2.39 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.94 2.63 0.00 56 L 8.04 4.30 0.00 1.93 1.87 0.94 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.00 0.00 0.00 0.00 0.00 0.00 57 N 8.55 4.52 0.00 2.91 3.17 0.00 0.00 7.28 6.74 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 58 T 8.37 4.02 4.64 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 0.00 0.00 1.27 0.00 0.00 59 V 7.57 4.43 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 0.24 0.00 0.00 0.57 0.00 0.00 60 G 7.92 4.07 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 0.00 0.00 0.00 61 G 7.86 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 62 H 7.85 4.84 0.00 3.33 3.35 0.00 5.50 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 Q 9.10 4.01 0.00 2.27 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.89 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 64 A 8.09 3.94 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 65 A 7.73 4.09 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 M 8.20 3.99 0.00 2.07 2.18 0.00 0.00 0.00 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.74 2.76 0.00 67 Q 7.95 3.93 0.00 2.27 2.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.29 6.79 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 68 M 7.45 4.34 0.00 2.22 2.24 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.41 0.00 69 L 8.15 3.92 0.00 1.64 1.79 0.78 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 70 K 8.22 3.95 0.00 2.03 1.97 0.00 1.74 0.00 0.00 1.72 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.46 1.49 7.81 71 E 8.65 3.97 0.00 2.16 2.21 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 2.52 2.36 0.00 72 T 7.70 3.93 4.36 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 1.22 0.00 0.00 73 I 7.80 3.80 2.11 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 0.98 1.31 0.00 0.00 74 N 8.21 4.31 0.00 2.99 2.86 0.00 0.00 7.10 6.99 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 75 E 8.20 3.88 0.00 2.06 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 2.29 2.57 0.00 76 E 8.20 3.50 0.00 1.35 1.12 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 2.32 2.27 0.00 77 A 7.85 3.30 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 78 A 8.07 3.95 1.35 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 0.00 0.00 79 E 8.15 3.80 0.00 2.08 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 2.26 2.35 0.00 80 W 7.93 4.33 0.00 3.68 3.39 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 81 D 8.12 4.61 0.00 2.94 2.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 R 7.77 3.83 0.00 1.77 2.03 0.00 3.22 0.00 0.00 3.25 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 83 L 7.47 4.36 0.00 1.56 1.62 0.64 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 84 H 7.95 4.65 0.00 3.08 3.11 0.00 5.63 0.00 0.00 0.00 0.00 6.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 P 0.00 4.27 0.00 2.17 2.26 0.00 3.76 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 2.14 1.94 0.00 86 V 7.63 3.18 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 0.82 0.00 0.00 1.01 0.00 0.00 87 H 8.10 3.69 0.00 3.31 3.54 0.00 5.80 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 88 A 8.22 3.67 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 89 G 8.20 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 0.00 0.00 0.00 90 P 0.00 4.60 0.00 2.24 2.16 0.00 3.82 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 2.01 1.99 0.00 91 I 7.46 3.40 1.89 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 1.37 0.61 0.93 0.00 0.00 92 A 8.91 3.67 1.41 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 P 0.00 4.54 0.00 2.20 2.10 0.00 3.90 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 1.99 1.97 0.00 94 G 8.33 4.78 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 95 Q 6.95 4.29 0.00 2.35 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.86 6.66 0.00 0.00 0.00 0.00 0.00 2.51 2.33 0.00 96 M 8.72 3.76 0.00 1.97 2.06 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.24 2.49 0.00 97 R 7.43 4.18 0.00 2.38 2.24 0.00 3.24 0.00 0.00 3.26 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.81 0.00 98 E 8.68 4.26 0.00 2.03 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 2.48 0.00 99 P 0.00 3.76 0.00 1.36 0.49 0.00 3.81 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 1.93 1.51 0.00 100 R 8.15 4.73 0.00 1.95 2.14 0.00 3.26 0.00 0.00 3.38 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 2.02 0.00 101 G 9.28 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 0.00 0.00 0.00 102 S 8.07 4.16 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 0.00 103 D 7.71 4.25 0.00 2.77 2.54 0.00 0.00 0.00 0.00 0.00 0.00 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 I 7.55 3.17 1.21 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 0.65 -0.14 -0.01 0.00 0.00 105 A 7.59 2.58 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 0.00 106 G 7.73 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 0.00 107 T 7.74 4.03 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 1.22 0.00 0.00 108 T 7.91 4.70 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 1.23 0.00 0.00 109 S 7.92 4.99 0.00 4.36 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 0.00 110 T 8.49 4.29 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 1.19 0.00 0.00 111 L 8.47 3.90 0.00 1.68 1.70 0.85 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 0.00 0.00 0.00 0.00 0.00 0.00 112 Q 7.93 3.89 0.00 1.99 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.37 6.65 0.00 0.00 0.00 0.00 0.00 2.39 2.33 0.00 113 E 7.65 3.37 0.00 2.03 1.12 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 2.01 2.19 0.00 114 Q 8.06 4.48 0.00 2.29 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.42 6.81 0.00 0.00 0.00 0.00 0.00 2.59 2.73 0.00 115 I 7.33 3.74 1.95 0.00 0.00 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.58 0.84 0.00 0.00 116 G 7.94 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 0.00 0.00 0.00 117 W 7.83 4.37 0.00 3.64 3.25 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 0.00 118 M 7.91 4.58 0.00 2.04 2.31 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.81 2.57 0.00 119 T 7.52 4.73 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 1.29 0.00 0.00 120 H 7.64 4.72 0.00 3.36 3.24 0.00 5.72 0.00 0.00 0.00 0.00 6.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 N 8.16 4.61 0.00 2.84 2.80 0.00 0.00 6.06 7.75 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 0.00 122 P 0.00 4.57 0.00 2.11 2.05 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 2.02 2.08 0.00 123 P 0.00 4.36 0.00 2.21 2.14 0.00 3.79 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 2.02 2.02 0.00 124 I 8.20 4.13 1.99 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.92 0.75 0.00 0.00 125 P 0.00 4.60 0.00 2.20 2.22 0.00 3.76 0.00 0.00 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.05 0.00 126 V 7.65 3.26 1.79 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 0.19 0.00 0.00 1.02 0.00 0.00 127 G 7.85 3.61 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 E 7.95 3.84 0.00 2.02 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 2.33 2.40 0.00 129 I 7.85 3.43 1.35 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.46 -0.08 0.00 0.00 130 Y 7.45 3.50 0.00 2.69 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 0.00 131 K 8.18 3.89 0.00 1.90 1.84 0.00 1.53 0.00 0.00 1.34 0.00 0.00 2.80 0.00 0.00 2.79 0.00 0.00 0.00 0.00 1.35 1.24 7.81 132 R 7.78 3.97 0.00 2.09 2.05 0.00 3.24 0.00 0.00 3.18 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.88 0.00 133 W 8.06 4.46 0.00 3.50 3.16 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 0.00 134 I 7.72 3.58 1.74 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 1.16 0.10 0.47 0.00 0.00 135 I 7.42 3.65 2.08 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 1.71 0.97 0.94 0.00 0.00 136 L 8.09 4.18 0.00 2.04 1.73 1.04 1.01 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 0.00 137 G 7.95 3.57 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 0.00 138 L 8.08 3.72 0.00 1.67 1.54 0.40 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 139 N 8.49 4.36 0.00 2.90 3.05 0.00 0.00 7.10 6.04 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 0.00 140 K 7.66 4.07 0.00 1.96 1.87 0.00 1.67 0.00 0.00 1.64 0.00 0.00 2.93 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.75 1.60 7.81 141 I 7.31 3.71 1.78 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 1.37 0.61 0.90 0.00 0.00 142 V 7.84 3.82 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 1.20 0.00 0.00 0.92 0.00 0.00 143 R 7.53 3.97 0.00 1.93 2.09 0.00 3.31 0.00 0.00 3.23 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.69 0.00 144 M 8.12 4.79 0.00 2.10 2.11 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.63 2.55 0.00 145 Y 6.81 5.69 0.00 3.02 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 0.00 146 S 7.70 4.37 0.00 3.75 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 0.00 147 P 0.00 4.66 0.00 2.23 2.08 0.00 3.83 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 148 T 7.64 4.21 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 1.23 0.00 0.00 149 S 7.36 4.51 0.00 3.84 3.82 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 0.00 150 I 8.15 4.12 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 1.42 0.53 0.92 0.00 0.00 151 L 7.66 4.27 0.00 1.65 1.61 0.93 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00