NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4289 8.3349 116.7941 58.1910 64.2524 173.0560 2 L 4.2229 8.3583 125.7003 52.2774 42.4860 176.0891 3 S 4.4560 9.7365 120.3669 57.7697 66.2310 175.3671 4 S 4.0675 8.4662 117.7174 61.4872 62.4422 176.5719 5 K 3.7985 8.1036 121.8175 59.7724 31.3533 178.1344 6 D 4.5471 7.8654 119.9400 56.9763 40.7759 178.8429 7 K 3.8798 7.9373 118.7941 59.7623 32.0193 179.1676 8 D 4.2832 8.2016 118.7818 57.1949 40.7841 178.6754 9 A 4.0081 8.1805 121.5193 55.0473 18.3556 179.9411 10 V 3.5166 7.9659 116.9171 66.0826 31.5713 178.5146 11 K 3.9220 8.1671 118.1780 59.1372 31.7588 179.2757 12 A 3.9254 8.0258 121.1686 54.9762 18.3742 179.1763 13 L 3.6513 7.8956 118.8672 58.2247 41.9552 179.1084 14 W 3.7715 8.4034 128.2177 60.0960 30.3656 177.9383 15 G 3.7044 8.3459 105.3286 48.0373 0.0000 175.4984 16 K 4.0622 7.9570 120.4557 58.7834 32.1912 179.1630 17 I 3.8599 7.9088 113.0752 63.5642 37.4722 178.7656 18 A 3.7565 7.5770 122.8049 55.3971 18.2329 178.7357 19 D 4.2811 7.6899 115.2114 57.1557 41.8273 178.2965 20 K 4.4429 9.0072 116.9321 56.7636 32.8786 177.7721 21 A 3.8242 7.5339 124.6161 55.9798 18.1522 180.3416 22 E 3.9107 8.1035 116.3188 59.4179 29.4899 179.1424 23 E 3.8710 8.0213 118.7239 59.4148 29.8303 178.5253 24 I 3.7806 8.1583 120.4391 64.4783 37.1815 178.6083 25 G 3.6157 8.5089 106.5182 47.6508 0.0000 175.4230 26 A 3.9876 8.0834 123.3325 55.2483 18.4105 179.5497 27 D 4.3013 8.4925 117.2544 57.3773 40.8770 179.0034 28 A 4.0094 8.2849 121.5645 55.0370 18.3737 179.4843 29 L 4.0575 8.1875 119.1175 58.1150 42.1600 179.4400 30 G 3.6427 8.1913 105.9265 47.6165 0.0000 175.8260 31 R 3.9448 8.3735 120.8230 59.2882 30.1194 178.5363 32 M 4.2813 8.0219 117.7462 59.0317 32.1429 178.1718 33 L 4.0950 8.0327 118.6645 57.6876 41.5376 179.5399 34 A 4.1011 7.6823 119.1921 55.1789 18.7402 179.6221 35 V 3.6601 8.3499 115.5629 64.5423 33.0863 175.8695 36 Y 4.7511 8.3118 116.5746 54.5343 38.3086 173.9415 37 P 4.6893 0.0000 0.0000 64.2808 31.6654 178.0309 38 Q 4.0942 8.2934 117.0667 58.7765 28.6429 177.6481 39 T 4.5830 7.9984 111.1385 62.9891 69.4374 176.6770 40 K 4.0063 8.1749 122.2832 60.0145 31.8314 178.4914 41 T 3.6284 7.9170 111.7681 65.6093 67.0742 175.0262 42 Y 3.9460 7.3960 116.5809 59.4525 38.0350 176.3543 43 F 4.0313 7.6633 117.0427 56.4638 40.0757 176.7827 44 S 4.2670 7.8165 115.9653 60.3856 62.9081 175.0715 45 H 4.3691 7.7382 116.2623 57.8207 28.6780 175.7106 46 W 4.6688 7.4572 119.6681 56.8954 29.3583 175.6172 47 K 4.5886 8.4192 116.6831 55.7780 32.0441 176.5509 48 D 4.4012 8.0862 118.3560 54.1665 41.8649 174.7397 49 L 4.6581 8.5121 126.7150 55.1699 42.6251 177.4948 50 S 4.2069 7.9556 115.8252 57.2711 62.7215 171.8376 51 P 4.3651 0.0000 0.0000 64.0523 31.5749 176.5697 52 G 3.9831 8.9301 108.9618 45.4681 0.0000 174.4479 53 S 4.4419 7.6291 115.3226 57.2994 65.4745 174.6549 54 A 3.8816 8.5625 126.0928 55.2794 17.9564 178.3608 55 P 3.5216 0.0000 0.0000 65.3723 31.2822 178.8817 56 V 3.4771 7.3846 116.3135 66.0247 31.4858 177.3069 57 N 4.2281 8.0325 116.0576 56.5285 38.6278 177.2975 58 K 3.8952 8.3742 120.9476 59.7046 32.2448 178.2887 59 H 4.5855 8.3473 118.8210 58.8080 29.8433 177.2106 60 G 3.7556 8.7094 108.0535 47.8186 0.0000 175.4252 61 K 4.0124 7.9917 120.6334 59.8994 32.1917 179.3762 62 T 3.8678 7.6391 111.7500 64.8997 67.1732 176.3903 63 I 3.7495 7.8119 122.0381 64.8322 37.1455 178.3424 64 M 4.4839 8.2499 119.5841 58.2613 31.6206 178.8158 65 G 3.9406 9.4373 107.1660 48.0967 0.0000 175.9239 66 G 3.6594 8.6677 108.1526 47.5042 0.0000 175.9659 67 L 4.0078 8.3826 121.8124 57.3484 41.6380 179.8904 68 V 3.2507 8.2409 119.4235 64.6410 31.3345 177.6567 69 D 4.2755 7.8463 118.6869 57.1235 40.7868 178.1151 70 A 3.9135 7.6283 119.4194 55.2720 18.4145 179.3513 71 V 3.3845 8.0335 115.9098 66.0649 31.5741 177.5210 72 A 4.1293 8.2454 119.3819 54.6960 18.6066 179.0356 73 S 4.7225 7.8686 112.6557 58.3847 64.2120 176.4991 74 I 3.8028 7.7863 123.8521 63.7842 38.0454 176.5829 75 D 4.5009 7.9571 118.9797 56.6883 41.1770 176.1976 76 D 4.6450 7.8486 118.2237 51.5946 42.3055 175.1443 77 L 3.9387 8.2278 124.7868 56.9837 41.6784 177.6073 78 N 4.0885 8.1928 115.5480 57.1595 38.7983 176.2209 79 A 4.2047 8.4021 120.8367 54.9931 18.6168 179.5729 80 G 3.7294 8.0678 102.9267 46.4843 0.0000 174.3362 81 L 4.7291 7.5177 120.4102 54.0665 42.8933 178.2791 82 L 3.8486 8.1640 121.6496 58.4241 41.9111 178.5000 83 A 3.9485 7.9164 119.9326 55.3049 18.2943 179.4510 84 L 4.0337 7.8487 116.9330 57.8471 41.6258 179.5650 85 S 4.1635 8.2663 114.8809 60.7411 62.3433 175.8670 86 E 3.9484 8.3611 121.5819 59.4534 29.2205 179.2060 87 L 3.9947 7.9254 120.1225 58.3679 42.1844 178.7143 88 H 4.2000 8.5545 115.9351 58.8405 28.7591 177.6528 89 A 3.7448 8.0436 121.3196 54.9871 18.1213 177.5858 90 F 4.1810 8.3588 119.5100 59.6162 39.8385 177.2235 91 T 4.0577 7.9888 119.9840 67.3245 69.0684 175.7327 92 L 4.1645 8.1472 119.7011 55.3054 42.3898 177.2606 93 R 3.9219 7.5354 116.9515 56.6591 28.1652 177.2656 94 V 3.4084 7.7876 116.8499 62.7173 32.2508 174.9773 95 D 4.3871 8.7494 127.7171 53.9986 41.7186 175.5415 96 P 4.3889 0.0000 0.0000 65.0474 31.2151 178.3928 97 A 4.0410 7.9755 120.6172 55.2079 18.1328 179.2794 98 N 4.2112 7.9649 115.0960 56.1767 38.4884 177.5781 99 F 4.4220 7.5619 119.0339 60.4920 38.9988 177.6740 100 K 4.0034 8.1662 117.6499 59.5303 31.8934 179.2885 101 I 3.3149 7.2545 119.7091 64.0457 36.9585 178.2523 102 L 3.9030 7.8594 121.0536 58.2497 41.9634 178.7516 103 S 3.5722 7.9094 115.2176 61.9762 62.7613 176.3642 104 H 4.1191 8.1290 120.2728 59.7177 29.6186 177.1393 105 C 4.1506 8.1186 118.2639 62.4989 27.8055 176.2884 106 I 3.7042 7.7983 121.7227 64.3845 36.7520 178.3008 107 L 4.1912 7.8218 119.8382 57.9162 41.3161 179.8837 108 V 3.4181 7.8671 118.2006 65.8251 31.2331 177.8356 109 Q 3.9132 7.9042 118.1916 59.2378 29.1453 177.9614 110 L 4.3208 8.2065 119.8502 57.8326 41.2701 179.1219 111 A 3.0462 8.0542 121.0190 55.1685 17.9399 179.8441 112 V 3.3953 7.3425 108.7359 62.9390 31.6719 177.4661 113 K 4.1818 7.2562 117.8356 56.1667 34.9552 176.0764 114 F 5.1371 8.7741 117.6843 55.9221 39.5022 174.9549 115 P 4.5317 0.0000 0.0000 65.7515 31.8252 179.2326 116 K 4.1905 8.1686 117.2445 58.8704 32.1371 177.3825 117 D 4.6428 8.2620 116.9379 55.2567 41.6505 176.7792 118 F 4.5598 7.7929 120.1510 56.8409 38.3732 176.4866 119 T 4.2159 7.3656 112.2612 60.8122 71.2676 172.9352 120 P 4.2728 0.0000 0.0000 66.2748 31.4010 178.8802 121 E 3.9421 8.0582 116.5504 59.1762 29.4176 179.4231 122 V 3.1826 7.3938 118.5417 65.7985 31.4487 177.5837 123 H 3.9922 8.2132 118.3742 59.0268 29.6497 176.8077 124 L 3.9193 7.9175 122.1375 58.4429 41.8098 179.1653 125 S 4.3221 7.5738 115.7091 61.2611 62.6686 176.3126 126 Y 4.4911 7.7612 119.4021 61.3743 37.6923 178.2934 127 D 4.6442 8.8766 119.4001 57.3567 41.3824 178.3312 128 K 4.0314 8.5875 119.5353 59.2736 31.9377 179.0348 129 F 4.1014 8.4480 120.8596 61.5035 39.2943 177.2567 130 F 3.9201 8.3903 117.4406 60.5249 38.5638 177.8895 131 S 4.1433 8.3939 114.6710 61.6205 62.6665 176.6389 132 A 3.9082 8.0153 123.4226 54.7317 17.9787 179.8783 133 V 3.1645 7.6630 117.1382 65.9154 31.6384 178.1292 134 A 3.4747 8.0969 120.8040 55.1487 18.0199 179.8242 135 R 3.8595 7.9747 115.4615 59.2921 30.5102 178.8810 136 A 4.0344 7.9030 120.5619 55.1187 18.0463 179.7362 137 L 3.7290 7.8789 117.2475 57.2128 41.6495 178.9150 138 A 3.9084 7.5503 119.4098 53.0877 18.3775 178.8958 139 E 3.9659 7.4319 116.8544 59.2372 29.6321 178.2531 140 K 4.5427 7.6619 115.1716 56.7294 32.5637 177.7383 141 Y 4.4896 8.1256 119.9830 60.8541 38.0074 176.4878 142 R 4.2700 7.8857 118.9384 56.6704 29.1085 174.4333 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 S 8.33 4.43 0.00 3.87 3.87 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 2 L 8.36 4.22 0.00 1.72 1.61 0.99 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 3 S 9.74 4.46 0.00 4.03 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 4 S 8.47 4.07 0.00 3.87 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 5 K 8.10 3.80 0.00 1.79 1.80 0.00 1.69 0.00 0.00 1.78 0.00 0.00 2.89 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.47 1.52 7.81 6 D 7.87 4.55 0.00 2.91 2.70 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 7 K 7.94 3.88 0.00 1.93 1.81 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.93 0.00 0.00 3.16 0.00 0.00 0.00 0.00 1.43 1.62 7.81 8 D 8.20 4.28 0.00 2.93 2.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.18 4.01 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 10 V 7.97 3.52 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 -0.12 0.00 0.00 0.88 0.00 0.00 11 K 8.17 3.92 0.00 1.78 1.80 0.00 1.67 0.00 0.00 1.59 0.00 0.00 2.87 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.33 1.53 7.81 12 A 8.03 3.93 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 13 L 7.90 3.65 0.00 1.64 1.75 0.47 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 0.00 0.00 0.00 0.00 14 W 8.40 3.77 0.00 3.50 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 15 G 8.35 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 16 K 7.96 4.06 0.00 1.45 1.51 0.00 1.56 0.00 0.00 1.72 0.00 0.00 3.07 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.54 7.81 17 I 7.91 3.86 1.58 0.00 0.00 -0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 0.29 0.36 0.00 0.00 18 A 7.58 3.76 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 19 D 7.69 4.28 0.00 2.63 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 20 K 9.01 4.44 0.00 1.93 1.98 0.00 1.41 0.00 0.00 1.70 0.00 0.00 3.14 0.00 0.00 3.36 0.00 0.00 0.00 0.00 1.63 1.64 7.81 21 A 7.53 3.82 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 22 E 8.10 3.91 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 2.39 2.31 0.00 23 E 8.02 3.87 0.00 2.06 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 0.00 2.35 2.44 0.00 24 I 8.16 3.78 1.95 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 1.48 0.50 0.91 0.00 0.00 25 G 8.51 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 26 A 8.08 3.99 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 27 D 8.49 4.30 0.00 2.67 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 28 A 8.28 4.01 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 29 L 8.19 4.06 0.00 1.80 1.83 0.60 1.05 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 30 G 8.19 3.64 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 0.00 0.00 0.00 0.00 31 R 8.37 3.94 0.00 2.07 2.06 0.00 3.29 0.00 0.00 3.09 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.88 0.00 32 M 8.02 4.28 0.00 2.31 2.14 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 2.66 2.73 0.00 33 L 8.03 4.10 0.00 1.79 1.76 0.94 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 34 A 7.68 4.10 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 35 V 8.35 3.66 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 0.36 0.00 0.00 0.93 0.00 0.00 36 Y 8.31 4.75 0.00 3.09 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 37 P 0.00 4.69 0.00 2.28 2.33 0.00 3.89 0.00 0.00 3.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 1.88 0.00 38 Q 8.29 4.09 0.00 2.27 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.24 6.97 0.00 0.00 0.00 0.00 0.00 2.45 2.53 0.00 39 T 8.00 4.58 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 1.36 0.00 0.00 40 K 8.17 4.01 0.00 1.98 1.94 0.00 1.71 0.00 0.00 1.60 0.00 0.00 2.92 0.00 0.00 3.37 0.00 0.00 0.00 0.00 1.53 1.53 7.81 41 T 7.92 3.63 4.05 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 0.65 0.00 0.00 42 Y 7.40 3.95 0.00 2.21 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 0.00 0.00 0.00 0.00 43 F 7.66 4.03 0.00 2.35 1.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 44 S 7.82 4.27 0.00 3.93 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 45 H 7.74 4.37 0.00 3.32 3.48 0.00 5.72 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 46 W 7.46 4.67 0.00 3.41 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 47 K 8.42 4.59 0.00 1.78 1.83 0.00 1.85 0.00 0.00 1.67 0.00 0.00 2.95 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.40 1.38 7.81 48 D 8.09 4.40 0.00 2.64 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 49 L 8.51 4.66 0.00 1.75 1.78 0.98 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 50 S 7.96 4.21 0.00 3.94 3.79 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 51 P 0.00 4.37 0.00 2.23 2.06 0.00 3.82 0.00 0.00 3.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.00 1.98 0.00 52 G 8.93 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 53 S 7.63 4.44 0.00 3.99 4.08 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 54 A 8.56 3.88 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 55 P 0.00 3.52 0.00 1.79 0.96 0.00 3.42 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 1.90 0.00 56 V 7.38 3.48 2.20 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 1.10 0.00 0.00 1.16 0.00 0.00 57 N 8.03 4.23 0.00 2.86 2.81 0.00 0.00 6.72 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 K 8.37 3.90 0.00 1.87 1.65 0.00 1.44 0.00 0.00 1.53 0.00 0.00 2.96 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.46 7.81 59 H 8.35 4.59 0.00 3.23 3.33 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 60 G 8.71 3.76 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 0.00 0.00 0.00 61 K 7.99 4.01 0.00 2.05 1.90 0.00 1.66 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.68 7.81 62 T 7.64 3.87 4.31 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 1.40 0.00 0.00 63 I 7.81 3.75 2.09 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.64 1.03 0.00 0.00 64 M 8.25 4.48 0.00 2.20 2.31 0.00 0.00 0.00 0.00 0.00 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.98 2.93 0.00 65 G 9.44 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 66 G 8.67 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 67 L 8.38 4.01 0.00 2.17 1.38 1.56 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 0.00 0.00 0.00 0.00 0.00 0.00 68 V 8.24 3.25 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 1.17 0.00 0.00 1.03 0.00 0.00 69 D 7.85 4.28 0.00 2.88 2.94 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 70 A 7.63 3.91 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 71 V 8.03 3.38 1.77 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 0.58 0.00 0.00 -0.21 0.00 0.00 72 A 8.25 4.13 1.34 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 73 S 7.87 4.72 0.00 3.83 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 74 I 7.79 3.80 2.00 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.86 0.85 0.00 0.00 75 D 7.96 4.50 0.00 2.68 2.69 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 76 D 7.85 4.65 0.00 2.66 2.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 L 8.23 3.94 0.00 1.63 1.57 0.72 0.48 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 78 N 8.19 4.09 0.00 2.66 3.05 0.00 0.00 6.93 7.96 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 79 A 8.40 4.20 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 80 G 8.07 3.73 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 0.00 0.00 0.00 81 L 7.52 4.73 0.00 1.66 1.51 0.74 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 0.00 0.00 0.00 0.00 0.00 0.00 82 L 8.16 3.85 0.00 1.82 1.63 0.89 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 0.00 0.00 0.00 0.00 0.00 0.00 83 A 7.92 3.95 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 84 L 7.85 4.03 0.00 1.81 1.72 0.92 0.92 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 85 S 8.27 4.16 0.00 3.90 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 86 E 8.36 3.95 0.00 2.11 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 2.23 2.35 0.00 87 L 7.93 3.99 0.00 1.80 1.95 0.92 1.19 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 88 H 8.55 4.20 0.00 3.40 3.59 0.00 5.86 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 89 A 8.04 3.74 0.43 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 90 F 8.36 4.18 0.00 3.17 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 91 T 7.99 4.06 4.50 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 1.28 0.00 0.00 92 L 8.15 4.16 0.00 1.90 1.75 0.97 1.03 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 93 R 7.54 3.92 0.00 1.94 1.99 0.00 3.38 0.00 0.00 3.55 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.66 0.00 94 V 7.79 3.41 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 -0.11 0.00 0.00 0.68 0.00 0.00 95 D 8.75 4.39 0.00 2.79 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 96 P 0.00 4.39 0.00 2.42 2.52 0.00 3.83 0.00 0.00 3.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.72 0.00 97 A 7.98 4.04 1.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 N 7.96 4.21 0.00 2.46 2.60 0.00 0.00 6.87 7.60 0.00 0.00 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 F 7.56 4.42 0.00 3.20 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 0.00 100 K 8.17 4.00 0.00 1.88 1.87 0.00 1.68 0.00 0.00 1.84 0.00 0.00 3.01 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.60 1.77 7.81 101 I 7.25 3.31 1.78 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 0.42 0.54 0.21 0.00 0.00 102 L 7.86 3.90 0.00 1.81 1.72 0.97 1.00 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 0.00 103 S 7.91 3.57 0.00 4.11 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 104 H 8.13 4.12 0.00 3.30 3.41 0.00 5.78 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 0.00 105 C 8.12 4.15 0.00 3.16 3.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 7.80 3.70 1.71 0.00 0.00 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.75 1.08 0.00 0.00 107 L 7.82 4.19 0.00 1.89 1.91 1.24 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 108 V 7.87 3.42 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 0.93 0.00 0.00 0.78 0.00 0.00 109 Q 7.90 3.91 0.00 2.13 2.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.30 6.73 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 110 L 8.21 4.32 0.00 2.22 2.16 1.05 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 111 A 8.05 3.05 0.69 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 0.00 0.00 112 V 7.34 3.40 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 0.69 0.00 0.00 0.96 0.00 0.00 113 K 7.26 4.18 0.00 1.30 1.58 0.00 1.47 0.00 0.00 1.44 0.00 0.00 2.91 0.00 0.00 2.67 0.00 0.00 0.00 0.00 0.30 0.88 7.81 114 F 8.77 5.14 0.00 3.42 3.05 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 0.00 115 P 0.00 4.53 0.00 2.27 2.33 0.00 3.81 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 2.13 2.00 0.00 116 K 8.17 4.19 0.00 1.89 2.00 0.00 1.80 0.00 0.00 1.76 0.00 0.00 3.00 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.50 1.53 7.81 117 D 8.26 4.64 0.00 3.05 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 0.00 118 F 7.79 4.56 0.00 3.31 3.18 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 0.00 119 T 7.37 4.22 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 P 0.00 4.27 0.00 2.18 2.18 0.00 3.62 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 2.14 2.24 0.00 121 E 8.06 3.94 0.00 1.96 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 2.37 2.34 0.00 122 V 7.39 3.18 1.76 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 0.49 0.00 0.00 0.81 0.00 0.00 123 H 8.21 3.99 0.00 3.39 3.50 0.00 5.67 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 124 L 7.92 3.92 0.00 1.76 1.85 0.92 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 125 S 7.57 4.32 0.00 3.81 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 0.00 126 Y 7.76 4.49 0.00 3.33 3.26 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 0.00 127 D 8.88 4.64 0.00 3.07 2.90 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 0.00 128 K 8.59 4.03 0.00 2.01 1.88 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.49 1.67 7.81 129 F 8.45 4.10 0.00 2.95 3.06 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 0.00 0.00 0.00 130 F 8.39 3.92 0.00 3.23 3.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 S 8.39 4.14 0.00 4.07 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 0.00 132 A 8.02 3.91 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 0.00 133 V 7.66 3.16 1.78 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 0.83 0.00 0.00 -0.17 0.00 0.00 134 A 8.10 3.47 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 0.00 135 R 7.97 3.86 0.00 1.72 1.97 0.00 3.17 0.00 0.00 3.23 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.75 0.00 136 A 7.90 4.03 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 137 L 7.88 3.73 0.00 0.85 0.90 0.41 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 138 A 7.55 3.91 1.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 139 E 7.43 3.97 0.00 2.11 2.02 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 2.31 2.48 0.00 140 K 7.66 4.54 0.00 1.91 1.89 0.00 1.72 0.00 0.00 1.67 0.00 0.00 2.98 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.40 1.57 7.81 141 Y 8.13 4.49 0.00 3.18 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 0.00 142 R 7.89 4.27 0.00 1.92 1.90 0.00 3.08 0.00 0.00 3.25 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.69 0.00