NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 N 4.2961 8.4093 119.1838 53.7949 40.0275 172.8290 4 Y 4.4967 6.7218 119.4132 55.0582 40.4097 170.6108 5 T 4.8047 8.5668 110.1187 60.1748 73.2663 173.2541 6 Y 5.1125 8.8010 118.6327 56.9252 39.6983 175.2539 7 I 4.8144 8.8267 122.7678 59.1649 41.2794 175.4313 8 K 4.6657 9.4211 128.3123 55.3055 33.2194 176.3661 9 P 4.5743 0.0000 0.0000 66.1135 31.2133 178.5708 10 E 4.4346 8.4194 118.0889 59.0676 29.4063 179.3715 11 E 3.9822 8.1902 117.7325 59.1436 29.6348 178.9667 12 L 3.9018 8.1400 120.4327 58.2002 42.2483 178.9792 13 V 3.5423 8.2563 118.5857 66.1285 31.0917 177.4069 14 E 3.9160 8.1587 118.8162 59.2444 29.1675 178.8392 15 L 3.9892 7.6949 117.8002 57.9963 41.8711 179.1726 16 L 4.0867 7.7477 117.2554 57.9678 41.5717 179.0278 17 D 4.6850 8.0161 117.8113 55.0974 41.1164 175.9040 18 N 4.6587 7.6220 119.1884 51.5307 38.7589 173.7818 19 P 4.3345 0.0000 0.0000 65.5648 31.5095 177.6996 20 D 4.3744 8.1089 118.5221 57.3243 41.2284 177.8919 21 S 4.1212 8.0259 115.1824 61.8846 63.0218 176.3961 22 L 3.9157 8.2543 122.8841 58.6497 41.5206 179.5590 23 V 3.7352 7.4382 110.8291 63.5031 31.7199 177.6902 24 K 4.2596 8.0053 116.5957 55.7373 32.3374 175.5799 25 A 5.2694 7.1853 120.8594 49.9556 21.6201 176.0130 26 A 4.6116 8.6823 121.6906 49.9859 22.8767 175.3018 27 V 4.4300 8.1877 121.2718 61.3471 33.7624 174.6536 28 I 4.3715 8.3654 130.6954 59.7848 38.2928 174.6232 29 D 4.5424 8.8130 129.3262 53.2863 42.1829 175.9830 30 C 5.4278 8.9705 123.4932 59.0642 29.5030 174.4901 31 R 4.6451 8.2370 119.4966 55.5598 31.3447 175.0397 32 D 4.6415 8.7214 116.5043 54.0088 40.7871 177.3757 33 S 4.3768 8.7859 118.1060 59.0395 64.2403 175.2412 34 D 4.7895 7.8795 120.1556 52.8768 39.4956 178.1100 35 R 3.8441 7.6067 117.6199 59.7394 29.3118 177.8404 36 D 4.9289 7.9287 114.9340 54.5698 40.9467 176.8130 37 C 4.1760 7.7715 117.9243 60.5973 28.3126 174.2454 38 G 4.2811 6.0907 110.2392 46.0011 0.0000 171.6929 39 F 4.4214 6.8303 116.2133 55.2123 42.3274 172.9398 40 I 4.8225 8.4421 120.2286 60.2493 38.2908 176.5090 41 V 3.6246 8.3883 126.3329 62.8752 31.6487 175.7129 42 N 4.1653 8.7711 117.8047 53.7493 36.1684 174.5854 43 S 4.3781 7.8322 113.1065 58.7740 63.8906 173.6152 44 I 4.2877 8.6478 123.0284 59.7387 39.1278 174.0443 45 N 4.9822 8.5078 125.6899 52.8630 40.4335 175.0053 46 M 4.7627 8.9370 125.5595 52.2849 34.1000 170.6391 47 P 4.7476 0.0000 0.0000 63.0335 31.8358 177.7736 48 T 4.0384 8.6945 122.2178 66.6295 68.6750 176.4145 49 I 3.9611 7.7838 120.2112 63.0225 38.1671 176.0359 50 S 4.6973 7.4483 111.4374 57.4368 64.1409 174.1255 51 C 4.2556 8.2006 119.5438 60.0652 28.5269 172.5536 52 T 4.7901 7.8982 111.4945 59.1164 71.8738 174.4839 53 E 4.1082 8.9338 120.8078 59.7571 29.3786 178.2560 54 E 4.0544 8.2515 118.4755 59.4110 29.6347 178.5074 55 M 4.0216 8.0175 119.1107 58.4296 31.8507 178.2635 56 Y 4.2524 7.8329 116.5424 61.0187 38.2615 177.9483 57 E 4.0732 8.3829 119.5823 59.4258 29.4763 179.5937 58 K 4.1049 8.5070 118.9040 59.1867 32.0202 179.2217 59 L 4.0006 8.3328 120.6494 58.0366 42.0702 178.7927 60 A 4.3099 8.6544 121.0730 55.2049 18.3142 179.5752 61 K 3.7482 8.0975 117.6705 59.8711 32.2777 179.0178 62 T 3.8798 8.2344 116.3207 66.9257 68.3546 176.6349 63 L 3.9957 8.3005 120.9184 57.4052 41.6093 179.2755 64 F 3.9225 8.2474 120.7247 61.4665 39.1530 177.1904 65 E 4.1203 8.4877 116.6722 58.7557 29.2929 178.2543 66 E 4.1975 7.9629 116.5594 55.5356 29.9053 176.3244 67 K 3.7006 8.0648 117.7731 57.1851 29.8890 176.4049 68 K 4.2062 8.1198 117.9629 56.7182 32.7623 177.0034 69 E 4.7030 9.0914 121.0026 56.5875 32.2900 175.8736 70 L 5.6152 7.9460 118.2607 52.7747 46.3242 175.4722 71 A 5.0009 9.5228 124.2649 50.2919 22.2161 174.9758 72 V 4.8201 8.8575 123.9187 61.7422 33.5405 174.5055 73 F 5.0325 9.7216 128.2390 56.5057 40.7457 174.9408 74 H 5.4837 9.1251 118.2151 53.6246 32.4473 171.9091 75 C 4.8604 8.6064 116.1454 58.2657 32.5545 175.8825 76 A 4.3324 9.1778 115.9774 54.4611 18.7259 178.9940 77 Q 4.6351 8.3251 110.2690 55.0709 30.3503 175.8010 78 S 3.8900 8.0787 113.2706 59.8771 60.4976 173.7895 79 L 4.4828 8.2484 120.1191 55.2975 43.6404 176.8957 80 V 4.2667 7.5394 114.5637 64.4680 33.8611 177.5707 81 R 4.0435 7.9104 117.8257 58.7406 30.0756 178.8492 82 A 4.0567 7.9239 120.4018 54.7264 18.5141 177.8049 83 P 3.5388 0.0000 0.0000 65.5676 31.1977 178.6495 84 K 3.9717 8.2492 118.4852 59.2764 31.9112 179.2870 85 G 3.6851 8.3546 105.9664 47.9489 0.0000 175.5636 86 A 2.5800 7.7612 123.2907 54.1290 18.2311 179.4727 87 N 4.2328 8.1918 115.3034 56.6603 38.5947 177.7530 88 R 3.6571 7.8432 119.5399 59.0344 29.9795 179.0056 89 F 4.2083 8.1332 120.4352 61.2139 39.4177 177.0619 90 A 3.8480 8.1116 120.6286 55.1787 18.1733 179.6784 91 L 3.8459 7.8492 117.2796 57.5286 41.6870 179.3208 92 A 3.9689 8.0963 121.0934 55.4025 18.2327 179.6462 93 Q 3.9059 8.1326 116.6343 58.9696 28.7771 179.1210 94 K 3.8060 8.0197 120.5474 59.2437 32.0119 178.4407 95 K 3.7545 7.7383 118.6997 59.7600 32.1782 178.2565 96 L 4.0454 7.6919 116.5047 55.1928 41.6796 177.5171 97 G 3.5776 7.4921 106.2591 46.2677 0.0000 172.8362 98 Y 4.8218 7.5534 116.0988 56.1375 39.9969 176.4249 99 V 4.5119 8.4493 112.6799 60.6536 33.8307 175.6613 100 L 5.0061 7.8841 119.3162 51.7595 44.8235 174.4483 101 P 4.8120 0.0000 0.0000 62.7308 32.2692 175.9049 102 A 4.3580 8.9836 122.9334 52.0631 19.6349 176.4625 103 V 4.8992 8.0462 119.1843 61.4541 34.1416 174.2039 104 Y 4.9783 9.7083 124.8195 56.2132 42.4388 174.3839 105 V 4.6678 8.2649 121.4013 60.7760 34.0210 174.2678 106 L 4.5262 8.9742 130.4513 55.1323 42.6912 175.9777 107 R 4.2298 9.0157 127.5263 58.3771 30.4433 176.8091 108 G 3.9409 9.1376 113.7515 44.4532 0.0000 174.0719 109 G 4.2196 8.0682 108.3337 44.7024 0.0000 173.4373 110 W 4.3116 8.9752 127.1104 60.7106 30.4676 178.5715 111 E 3.9372 8.5692 118.1747 59.4857 28.9000 179.2294 112 A 4.0082 8.1343 120.7722 54.8984 18.4164 179.3851 113 F 3.9718 8.2262 119.2112 61.7699 39.4980 176.8655 114 Y 3.3581 7.9027 119.4149 60.3356 38.2076 177.1340 115 H 3.9940 7.9848 118.5994 59.5524 30.0668 176.6182 116 M 3.7608 7.8304 118.6169 57.8069 32.2802 176.1535 117 Y 4.3155 7.3303 113.7377 57.0609 40.1624 177.6309 118 G 2.5027 7.7195 109.6347 47.6384 0.0000 174.2752 119 D 4.5330 7.5077 116.6218 53.4538 40.2811 177.1330 120 V 4.2194 7.4901 111.0632 61.5323 34.1053 175.8512 121 R 4.7402 8.1496 119.1177 54.2583 30.4691 174.2190 122 P 4.4908 0.0000 0.0000 64.1107 32.1396 178.6116 123 D 4.3654 7.8873 118.3702 55.6280 39.7325 177.1419 124 L 4.4241 7.7728 118.5921 55.9664 42.3467 176.1354 125 M 5.1695 7.9296 119.8124 53.9332 34.2549 174.6289 126 Y 4.8608 8.8575 121.4071 56.2333 41.4787 175.2410 127 V 4.4521 8.3492 113.9654 59.7565 36.8208 174.2437 128 K 5.0229 8.6218 120.1669 55.0028 34.8450 175.7481 129 L 4.5373 9.0136 124.1452 54.9633 46.2496 175.7484 130 G 4.3247 8.9733 110.0432 44.0049 0.0000 172.6091 131 P 4.3974 0.0000 0.0000 65.1195 31.2507 177.0743 132 E 4.3256 8.1908 115.8381 55.2633 30.3089 175.6181 133 Q 3.4041 8.0206 117.7053 56.8912 26.7282 173.6361 134 K 4.4807 8.1975 117.9420 55.0903 34.4732 178.1885 135 L 4.7607 8.5835 125.5333 55.9852 42.9668 176.0689 136 I 4.3657 8.1652 122.1112 60.3292 42.0571 173.9570 137 S 3.7680 7.9523 123.3733 57.4548 63.9733 174.9932 138 E 4.0042 8.9475 121.4255 58.7879 29.0409 179.3666 139 E 3.8518 7.9506 119.4830 59.4919 29.7418 178.2260 140 D 4.3728 8.3012 119.2189 57.3854 40.8017 179.0559 141 L 3.9568 7.6767 119.1831 57.7995 41.5836 179.0280 142 N 4.2809 8.2433 116.5061 56.5626 38.4537 177.5109 143 S 4.0390 8.0352 115.9443 61.6034 62.7594 176.5244 144 A 4.0534 8.0426 122.2397 55.2726 18.1681 179.5760 145 V 3.6673 7.7344 115.4157 66.1795 31.7074 177.3557 146 D 4.5178 7.9697 117.5344 58.0187 40.8540 177.1374 147 H 4.4935 8.2283 119.4968 56.1903 28.8448 175.2428 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 3 N 8.41 4.30 0.00 2.39 2.62 0.00 0.00 6.87 6.66 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 4 Y 6.72 4.50 0.00 2.78 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 5 T 8.57 4.80 4.38 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 1.18 0.00 0.00 6 Y 8.80 5.11 0.00 3.02 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 7 I 8.83 4.81 1.84 0.00 0.00 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 1.26 1.82 1.04 0.00 0.00 8 K 9.42 4.67 0.00 1.92 1.99 0.00 1.79 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.52 1.49 7.81 9 P 0.00 4.57 0.00 2.39 2.46 0.00 3.73 0.00 0.00 3.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.21 2.37 0.00 10 E 8.42 4.43 0.00 2.13 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.47 2.49 0.00 11 E 8.19 3.98 0.00 2.20 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 2.42 2.41 0.00 12 L 8.14 3.90 0.00 1.79 1.97 0.86 0.45 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 13 V 8.26 3.54 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 0.62 0.00 0.00 0.09 0.00 0.00 14 E 8.16 3.92 0.00 2.08 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.29 2.35 0.00 15 L 7.69 3.99 0.00 1.77 1.67 0.81 0.82 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 16 L 7.75 4.09 0.00 1.63 1.76 0.97 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 17 D 8.02 4.68 0.00 2.73 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 18 N 7.62 4.66 0.00 2.77 2.69 0.00 0.00 6.82 7.52 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 19 P 0.00 4.33 0.00 2.25 2.17 0.00 3.81 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 2.01 0.00 20 D 8.11 4.37 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 21 S 8.03 4.12 0.00 4.16 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 22 L 8.25 3.92 0.00 1.80 1.80 0.90 0.89 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 23 V 7.44 3.74 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 0.83 0.00 0.00 1.02 0.00 0.00 24 K 8.01 4.26 0.00 1.96 1.83 0.00 1.61 0.00 0.00 1.94 0.00 0.00 2.93 0.00 0.00 3.22 0.00 0.00 0.00 0.00 1.41 1.57 7.81 25 A 7.19 5.27 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 26 A 8.68 4.61 1.09 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 27 V 8.19 4.43 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 0.84 0.00 0.00 0.85 0.00 0.00 28 I 8.37 4.37 0.56 0.00 0.00 0.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.20 -0.16 0.55 0.00 0.00 29 D 8.81 4.54 0.00 2.58 2.38 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 30 C 8.97 5.43 0.00 2.91 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 31 R 8.24 4.65 0.00 1.88 1.96 0.00 3.11 0.00 0.00 3.36 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.51 0.00 32 D 8.72 4.64 0.00 2.79 2.61 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 33 S 8.79 4.38 0.00 3.99 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 34 D 7.88 4.79 0.00 2.86 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 35 R 7.61 3.84 0.00 1.90 2.14 0.00 2.57 0.00 0.00 3.02 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.48 0.00 36 D 7.93 4.93 0.00 2.70 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 37 C 7.77 4.18 0.00 2.91 3.02 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 38 G 6.09 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 39 F 6.83 4.42 0.00 3.11 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 40 I 8.44 4.82 1.91 0.00 0.00 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.18 0.90 0.00 0.00 41 V 8.39 3.62 0.67 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 0.51 0.00 0.00 0.49 0.00 0.00 42 N 8.77 4.17 0.00 2.81 2.89 0.00 0.00 6.99 7.57 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 43 S 7.83 4.38 0.00 3.81 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 44 I 8.65 4.29 1.67 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.63 0.78 0.00 0.00 45 N 8.51 4.98 0.00 2.53 2.57 0.00 0.00 6.92 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 46 M 8.94 4.76 0.00 1.84 1.92 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.42 2.46 0.00 47 P 0.00 4.75 0.00 2.10 2.32 0.00 3.64 0.00 0.00 3.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 1.95 0.00 48 T 8.69 4.04 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 1.31 0.00 0.00 49 I 7.78 3.96 1.89 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 1.49 0.76 0.92 0.00 0.00 50 S 7.45 4.70 0.00 4.10 3.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 C 8.20 4.26 0.00 3.08 2.44 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 52 T 7.90 4.79 4.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.23 0.00 0.00 53 E 8.93 4.11 0.00 2.12 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 2.63 2.44 0.00 54 E 8.25 4.05 0.00 2.10 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 2.40 2.43 0.00 55 M 8.02 4.02 0.00 1.89 1.99 0.00 0.00 0.00 0.00 0.00 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.50 0.00 56 Y 7.83 4.25 0.00 3.32 3.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 E 8.38 4.07 0.00 2.24 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 2.38 2.59 0.00 58 K 8.51 4.10 0.00 1.97 1.88 0.00 1.67 0.00 0.00 1.57 0.00 0.00 2.91 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.62 7.81 59 L 8.33 4.00 0.00 2.03 2.18 0.75 0.83 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 60 A 8.65 4.31 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 61 K 8.10 3.75 0.00 2.05 1.91 0.00 1.78 0.00 0.00 1.73 0.00 0.00 3.05 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.65 7.81 62 T 8.23 3.88 4.42 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 1.22 0.00 0.00 63 L 8.30 4.00 0.00 1.84 1.77 0.79 1.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 64 F 8.25 3.92 0.00 2.61 2.84 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 65 E 8.49 4.12 0.00 2.05 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 2.54 2.65 0.00 66 E 7.96 4.20 0.00 1.99 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 2.28 2.30 0.00 67 K 8.06 3.70 0.00 1.76 1.83 0.00 1.62 0.00 0.00 1.62 0.00 0.00 2.91 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.13 1.36 7.81 68 K 8.12 4.21 0.00 1.85 1.76 0.00 1.68 0.00 0.00 1.79 0.00 0.00 2.87 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.55 1.53 7.81 69 E 9.09 4.70 0.00 1.93 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 2.26 2.26 0.00 70 L 7.95 5.62 0.00 1.60 1.52 0.92 0.39 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 71 A 9.52 5.00 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 72 V 8.86 4.82 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 0.89 0.00 0.00 0.91 0.00 0.00 73 F 9.72 5.03 0.00 3.03 2.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 H 9.13 5.48 0.00 3.29 3.39 0.00 5.40 0.00 0.00 0.00 0.00 6.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 75 C 8.61 4.86 0.00 3.01 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 76 A 9.18 4.33 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 77 Q 8.33 4.64 0.00 2.10 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.62 6.85 0.00 0.00 0.00 0.00 0.00 2.47 2.42 0.00 78 S 8.08 3.89 0.00 4.25 4.06 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 79 L 8.25 4.48 0.00 1.66 1.74 1.02 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 80 V 7.54 4.27 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 1.07 0.00 0.00 0.97 0.00 0.00 81 R 7.91 4.04 0.00 1.94 1.99 0.00 3.26 0.00 0.00 3.42 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.72 0.00 82 A 7.92 4.06 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 83 P 0.00 3.54 0.00 2.22 1.96 0.00 3.71 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 2.22 2.15 0.00 84 K 8.25 3.97 0.00 1.90 1.88 0.00 1.70 0.00 0.00 1.66 0.00 0.00 2.96 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.56 7.81 85 G 8.35 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 0.00 0.00 0.00 86 A 7.76 2.58 0.77 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 0.00 0.00 87 N 8.19 4.23 0.00 2.87 2.83 0.00 0.00 6.99 8.51 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 88 R 7.84 3.66 0.00 0.88 0.91 0.00 2.97 0.00 0.00 3.00 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.59 0.00 89 F 8.13 4.21 0.00 3.33 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 90 A 8.11 3.85 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 91 L 7.85 3.85 0.00 1.92 1.64 0.85 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 92 A 8.10 3.97 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 Q 8.13 3.91 0.00 2.00 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.75 0.00 0.00 0.00 0.00 0.00 2.15 1.49 0.00 94 K 8.02 3.81 0.00 1.85 1.72 0.00 1.59 0.00 0.00 1.51 0.00 0.00 2.85 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.37 1.37 7.81 95 K 7.74 3.75 0.00 1.84 1.97 0.00 1.82 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.41 1.45 7.81 96 L 7.69 4.05 0.00 1.42 1.25 1.12 0.78 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 97 G 7.49 3.58 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 Y 7.55 4.82 0.00 2.87 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 99 V 8.45 4.51 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 0.76 0.00 0.00 1.00 0.00 0.00 100 L 7.88 5.01 0.00 1.84 1.70 1.02 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 101 P 0.00 4.81 0.00 2.26 2.19 0.00 3.99 0.00 0.00 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.19 0.00 102 A 8.98 4.36 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 0.00 103 V 8.05 4.90 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 1.02 0.00 0.00 1.23 0.00 0.00 104 Y 9.71 4.98 0.00 2.94 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 0.00 105 V 8.26 4.67 1.25 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 1.03 0.00 0.00 0.01 0.00 0.00 106 L 8.97 4.53 0.00 1.89 1.71 1.07 0.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.00 0.00 0.00 0.00 0.00 0.00 107 R 9.02 4.23 0.00 2.03 1.99 0.00 3.30 0.00 0.00 3.13 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.58 0.00 108 G 9.14 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 0.00 109 G 8.07 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 0.00 0.00 0.00 110 W 8.98 4.31 0.00 3.59 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 0.00 111 E 8.57 3.94 0.00 2.16 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 2.50 2.66 0.00 112 A 8.13 4.01 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 0.00 113 F 8.23 3.97 0.00 3.27 3.02 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 0.00 114 Y 7.90 3.36 0.00 1.97 2.60 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 0.00 0.00 0.00 0.00 115 H 7.98 3.99 0.00 3.24 3.42 0.00 6.01 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 0.00 116 M 7.83 3.76 0.00 1.41 1.77 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 2.09 1.10 0.00 117 Y 7.33 4.32 0.00 2.60 2.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 G 7.72 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 0.00 0.00 0.00 119 D 7.51 4.53 0.00 2.67 2.67 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 0.00 120 V 7.49 4.22 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 0.67 0.00 0.00 0.89 0.00 0.00 121 R 8.15 4.74 0.00 1.80 1.72 0.00 3.27 0.00 0.00 3.20 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.59 0.00 122 P 0.00 4.49 0.00 2.17 2.26 0.00 3.65 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 2.03 1.91 0.00 123 D 7.89 4.37 0.00 2.84 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 0.00 124 L 7.77 4.42 0.00 1.91 2.05 0.77 0.95 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 0.00 125 M 7.93 5.17 0.00 2.41 2.17 0.00 0.00 0.00 0.00 0.00 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.86 0.00 126 Y 8.86 4.86 0.00 2.63 2.44 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 0.00 127 V 8.35 4.45 2.04 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 0.72 0.00 0.00 0.92 0.00 0.00 128 K 8.62 5.02 0.00 1.71 1.76 0.00 1.96 0.00 0.00 1.67 0.00 0.00 2.68 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.49 1.80 7.81 129 L 9.01 4.54 0.00 1.75 1.46 0.93 0.93 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 G 8.97 4.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 131 P 0.00 4.40 0.00 2.19 2.20 0.00 3.76 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 1.99 1.99 0.00 132 E 8.19 4.33 0.00 1.98 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 2.24 2.31 0.00 133 Q 8.02 3.40 0.00 2.13 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.74 6.81 0.00 0.00 0.00 0.00 0.00 2.32 2.46 0.00 134 K 8.20 4.48 0.00 1.74 1.76 0.00 1.69 0.00 0.00 1.60 0.00 0.00 2.90 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.45 1.40 7.81 135 L 8.58 4.76 0.00 1.76 1.71 1.30 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 136 I 8.17 4.37 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 1.22 0.90 0.90 0.00 0.00 137 S 7.95 3.77 0.00 3.45 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 0.00 138 E 8.95 4.00 0.00 2.12 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 2.34 2.51 0.00 139 E 7.95 3.85 0.00 1.97 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 2.35 2.38 0.00 140 D 8.30 4.37 0.00 2.85 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 0.00 141 L 7.68 3.96 0.00 1.82 1.70 0.91 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 142 N 8.24 4.28 0.00 2.91 2.86 0.00 0.00 7.08 7.21 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 0.00 143 S 8.04 4.04 0.00 4.09 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 0.00 144 A 8.04 4.05 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 0.00 145 V 7.73 3.67 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 0.86 0.00 0.00 0.96 0.00 0.00 146 D 7.97 4.52 0.00 2.71 2.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 147 H 8.23 4.49 0.00 3.23 3.20 0.00 5.69 0.00 0.00 0.00 0.00 6.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00