NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 A 4.3264 8.2493 123.5793 50.9759 19.9509 176.6425 2 P 4.2147 0.0000 0.0000 62.2407 31.8626 174.1640 3 D 4.5647 8.0665 119.7188 52.7079 44.8138 176.5586 4 W 4.3004 8.7630 124.1971 58.8947 28.6124 176.7771 5 V 2.7276 6.8842 120.1600 61.3859 31.3719 173.7033 6 P 4.5502 0.0000 0.0000 61.5851 32.3503 175.5593 7 P 4.5953 0.0000 0.0000 65.4292 30.7477 178.7366 8 E 4.0788 8.2222 116.4402 58.9528 29.6462 179.2846 9 V 3.4969 7.5389 120.1063 64.5444 30.9858 178.4631 10 F 3.9728 7.5699 117.8130 60.5221 38.9426 176.8901 11 D 4.5229 8.1783 117.0971 57.1675 40.8708 178.0253 12 L 4.0587 7.5031 117.8751 57.0815 41.8736 178.8053 13 V 4.3501 7.6172 109.7555 61.2336 32.0256 177.6739 14 A 4.0458 7.5409 122.0854 55.2910 18.3067 179.2709 15 E 3.8909 8.1841 117.0221 59.7358 29.8001 178.6661 16 D 4.3825 8.1272 118.4182 56.9533 40.9049 178.4408 17 K 4.0366 8.6221 120.5415 59.5726 32.3091 178.6887 18 A 4.0440 8.0810 121.0123 55.1168 18.2241 179.6505 19 R 3.8273 7.9971 117.0302 59.8587 30.1179 178.1074 20 C 4.4065 8.6707 116.7741 60.3579 36.4364 176.0627 21 M 4.2501 8.7721 121.9280 57.7941 31.0992 178.9846 22 S 4.1209 8.1029 114.3118 61.6711 62.9980 176.4134 23 E 3.8083 8.4225 121.6470 58.3644 29.3681 178.0295 24 H 4.9622 8.0408 113.7091 54.4230 29.6718 175.0728 25 G 3.8746 7.6424 108.4371 46.6801 0.0000 174.0946 26 T 4.2915 7.8569 116.8524 63.1154 69.1898 174.3969 27 T 4.5216 8.6735 116.5372 60.1658 72.2290 175.8744 28 Q 3.8813 8.4551 122.3135 59.1913 29.1041 178.3975 29 A 4.1318 7.9287 121.5820 55.2519 18.4661 179.4650 30 Q 3.9925 8.0525 116.5434 59.0518 28.6549 179.0062 31 I 3.7110 7.4244 120.8708 64.3585 37.1036 178.1134 32 D 4.3776 8.4059 120.1439 57.3389 40.5737 178.3958 33 D 4.3327 8.1707 118.6291 57.4713 41.3182 178.7528 34 V 4.2129 7.9207 121.0167 64.4517 31.1670 177.6412 35 D 4.4643 8.4114 118.2658 56.9832 41.1558 177.6468 36 K 4.4581 7.9617 116.2489 56.7085 32.3244 177.6137 37 G 3.8850 8.4125 108.1028 45.2282 0.0000 172.9377 38 N 4.8451 8.5830 118.1978 51.1627 39.3665 173.9361 39 L 5.0012 8.2950 124.2974 53.3102 45.3541 175.4580 40 V 4.6339 8.2596 117.1114 59.5877 35.6996 175.6078 41 N 3.9180 7.9987 120.5875 52.3683 37.3700 175.0069 42 E 4.5584 7.4477 119.7134 54.0668 32.2911 174.8251 43 P 4.6633 0.0000 0.0000 65.0761 31.2130 178.7389 44 S 4.5172 8.0663 112.9987 60.3048 63.1559 175.3695 45 I 4.2331 7.6635 121.3970 62.9750 38.6471 177.4547 46 T 4.0946 8.2652 111.0762 65.0834 68.6362 176.1447 47 C 4.4155 8.6465 119.7344 59.5102 39.2942 175.4251 48 Y 4.0557 7.9399 121.0492 60.9629 38.4943 177.7764 49 M 3.9462 8.2343 119.6244 58.4321 31.9918 178.0851 50 Y 4.0068 8.1102 119.6897 60.7441 39.0045 177.1772 51 C 4.0759 8.4363 119.6787 59.7003 41.9689 175.4450 52 L 3.7917 7.5599 121.7070 58.0004 41.5689 178.7950 53 L 4.0424 7.6885 119.0058 57.8355 41.5969 179.1803 54 E 3.6535 8.0726 119.3048 59.0223 29.2563 178.7105 55 A 3.8664 7.5659 119.8959 53.8380 18.2907 178.0470 56 F 4.5656 7.0148 113.0092 56.8921 39.4662 175.4662 57 S 3.7618 7.5335 113.9941 59.7375 60.6998 173.3619 58 L 4.3747 8.0482 121.0004 55.8672 42.0471 177.1654 59 V 4.9754 7.2290 110.2531 59.5792 36.0413 174.8511 60 D 4.8916 8.4186 121.9072 52.1918 41.6170 176.4897 61 D 4.7811 8.6740 117.2712 55.3247 39.6560 176.2280 62 E 4.7309 8.4055 117.7715 54.8433 30.3281 175.2788 63 A 4.0345 8.0809 118.9360 53.2374 16.9690 178.0890 64 N 4.5971 8.5731 117.4164 54.3596 39.2967 175.1850 65 V 4.2433 8.2308 123.0773 62.4752 32.5931 175.9009 66 D 4.6097 8.8187 127.0564 53.1326 40.8534 176.5080 67 E 3.9670 8.5170 128.3445 59.2254 29.9076 178.0172 68 D 4.4100 8.1081 118.5486 57.3123 40.7073 178.6928 69 I 3.7197 7.7880 119.5362 64.3653 37.4120 177.6890 70 M 4.1581 8.0822 119.0252 58.9042 31.9557 178.2001 71 L 4.0760 8.4017 119.4771 57.8699 41.5599 179.8606 72 G 3.6618 7.8350 104.3780 47.1790 0.0000 174.5176 73 L 4.3316 7.6135 119.8443 56.0914 42.3697 177.2692 74 L 4.3398 7.2300 118.1422 52.9402 42.6407 174.8558 75 P 4.5823 0.0000 0.0000 62.0473 32.5239 177.0311 76 D 4.3415 8.6580 118.4724 56.4739 39.2129 178.3311 77 Q 4.1592 8.0004 115.4418 57.4012 29.0220 176.7573 78 L 4.4352 7.6341 118.3182 54.5581 42.3346 178.0635 79 Q 3.9154 7.7526 119.2155 59.2027 28.7116 178.5398 80 E 3.9795 8.0223 119.0198 59.1876 29.5834 179.1315 81 R 3.8223 7.9259 118.1611 59.4030 30.1177 178.2997 82 A 4.0021 8.0796 120.5589 55.2792 18.3571 179.6773 83 Q 4.1121 8.1527 116.6300 58.9732 28.7798 178.9511 84 S 4.0530 8.2356 114.3683 61.3789 62.4308 176.3992 85 V 3.6041 8.2181 121.3764 66.3670 31.2744 177.9630 86 M 4.1974 8.6152 118.9544 57.9965 31.5082 178.9020 87 G 3.6292 7.9088 105.6090 47.5967 0.0000 175.3166 88 K 4.1274 7.6527 120.4358 58.8782 32.4846 177.5648 89 C 4.5756 8.2646 114.0587 56.3134 41.0828 173.5363 90 L 4.8683 7.1272 120.6320 51.9456 43.5074 174.6115 91 P 4.5704 0.0000 0.0000 62.1407 32.3273 176.3297 92 T 4.1331 8.1787 110.0375 61.9792 69.4841 173.7223 93 S 4.6136 8.1079 116.3638 56.6240 65.9855 173.4079 94 G 4.0118 7.8295 109.9171 45.8486 0.0000 172.7260 95 S 4.2831 8.4858 113.0363 60.0064 63.6190 173.6197 96 D 4.4050 7.3279 119.7586 51.7278 42.3599 175.9162 97 N 4.1246 8.2027 116.2203 56.6391 38.2197 178.3201 98 C 4.3318 7.9467 117.3917 60.0547 41.0980 175.5464 99 N 4.2606 9.2919 119.0271 56.3600 38.4914 177.0818 100 K 4.3466 8.1960 121.6197 59.1325 32.1899 179.3573 101 I 3.8795 7.8667 119.8254 64.1418 36.9459 177.6261 102 Y 4.1817 8.4043 120.9148 61.1322 38.7540 178.2420 103 N 4.0776 8.5143 117.2710 55.9768 38.5280 177.2530 104 L 3.9015 8.1067 121.5239 58.1217 42.1843 178.7750 105 A 4.1038 8.5287 121.0084 55.2656 18.3725 179.7628 106 K 3.5363 7.8042 116.9412 59.4973 32.0785 178.8732 107 C 4.1424 7.8343 118.3621 59.5599 41.0079 175.8308 108 V 3.5214 7.8564 120.0605 66.0331 30.9170 177.8168 109 Q 3.4398 7.6447 119.5377 58.8790 28.4296 177.8079 110 E 3.9230 7.6123 119.3825 59.0908 29.7319 178.4852 111 S 4.3741 7.7341 113.7974 59.9561 64.6225 174.7617 112 A 4.7752 7.9267 124.6929 50.3105 19.5349 175.2741 113 P 4.5389 0.0000 0.0000 64.6450 32.1076 178.9206 114 D 4.7027 8.1546 116.7225 54.8553 39.6932 176.8620 115 V 4.6452 7.6510 110.9548 60.4924 33.3213 175.7832 116 W 4.5976 7.9012 129.5820 57.8189 31.0155 174.8544 117 F 4.7277 7.4449 117.6814 55.8997 39.6676 173.4470 118 V 3.5399 7.9659 121.3030 60.8816 34.0892 175.3147 119 I 3.9826 7.7684 125.7141 61.1971 37.8200 175.0309 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 A 8.25 4.33 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 2 P 0.00 4.21 0.00 2.30 2.09 0.00 3.78 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 2.01 2.03 0.00 3 D 8.07 4.56 0.00 2.52 2.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 W 8.76 4.30 0.00 3.51 3.17 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 5 V 6.88 2.73 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 0.07 0.00 0.00 -1.41 0.00 0.00 6 P 0.00 4.55 0.00 2.41 2.15 0.00 3.54 0.00 0.00 3.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.15 2.00 0.00 7 P 0.00 4.60 0.00 2.21 2.16 0.00 3.60 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 2.11 2.13 0.00 8 E 8.22 4.08 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 2.32 2.30 0.00 9 V 7.54 3.50 1.80 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 -0.13 0.00 0.00 0.60 0.00 0.00 10 F 7.57 3.97 0.00 3.01 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 11 D 8.18 4.52 0.00 2.79 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 12 L 7.50 4.06 0.00 1.89 1.65 0.95 0.87 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 13 V 7.62 4.35 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 0.36 0.00 0.00 0.94 0.00 0.00 14 A 7.54 4.05 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 15 E 8.18 3.89 0.00 2.08 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 2.38 2.42 0.00 16 D 8.13 4.38 0.00 2.86 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 17 K 8.62 4.04 0.00 1.95 2.13 0.00 1.75 0.00 0.00 1.74 0.00 0.00 3.13 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.57 1.73 7.81 18 A 8.08 4.04 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 19 R 8.00 3.83 0.00 1.94 2.08 0.00 3.21 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.67 0.00 20 C 8.67 4.41 0.00 3.13 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 21 M 8.77 4.25 0.00 2.07 2.17 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 2.98 2.15 0.00 22 S 8.10 4.12 0.00 4.09 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 23 E 8.42 3.81 0.00 1.91 1.75 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 2.30 2.49 0.00 24 H 8.04 4.96 0.00 3.31 3.36 0.00 5.70 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 25 G 7.64 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 0.00 0.00 0.00 26 T 7.86 4.29 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 0.85 0.00 0.00 27 T 8.67 4.52 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 28 Q 8.46 3.88 0.00 2.15 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.94 0.00 0.00 0.00 0.00 0.00 2.41 2.59 0.00 29 A 7.93 4.13 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 30 Q 8.05 3.99 0.00 2.23 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.76 0.00 0.00 0.00 0.00 0.00 2.38 2.38 0.00 31 I 7.42 3.71 1.93 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 1.10 0.54 0.89 0.00 0.00 32 D 8.41 4.38 0.00 2.83 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 33 D 8.17 4.33 0.00 3.04 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 34 V 7.92 4.21 2.24 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 1.32 0.00 0.00 1.30 0.00 0.00 35 D 8.41 4.46 0.00 2.85 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 36 K 7.96 4.46 0.00 2.02 1.90 0.00 1.77 0.00 0.00 1.75 0.00 0.00 3.08 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.53 1.73 7.81 37 G 8.41 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 38 N 8.58 4.85 0.00 3.04 2.79 0.00 0.00 6.38 7.22 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 39 L 8.29 5.00 0.00 1.62 1.51 1.13 1.02 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 40 V 8.26 4.63 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 0.81 0.00 0.00 0.95 0.00 0.00 41 N 8.00 3.92 0.00 1.44 2.30 0.00 0.00 6.89 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 42 E 7.45 4.56 0.00 2.00 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 0.00 2.27 2.30 0.00 43 P 0.00 4.66 0.00 2.16 2.12 0.00 3.86 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 2.10 1.99 0.00 44 S 8.07 4.52 0.00 4.17 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 45 I 7.66 4.23 1.91 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 1.78 1.40 1.06 0.00 0.00 46 T 8.27 4.09 4.58 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 1.39 0.00 0.00 47 C 8.65 4.42 0.00 3.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 Y 7.94 4.06 0.00 3.22 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 49 M 8.23 3.95 0.00 2.21 2.37 0.00 0.00 0.00 0.00 0.00 2.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3.03 2.69 0.00 50 Y 8.11 4.01 0.00 3.13 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 51 C 8.44 4.08 0.00 3.22 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 52 L 7.56 3.79 0.00 1.51 1.41 0.90 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 53 L 7.69 4.04 0.00 1.69 1.60 0.97 0.80 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 54 E 8.07 3.65 0.00 1.25 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 0.00 2.14 2.33 0.00 55 A 7.57 3.87 1.07 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 56 F 7.01 4.57 0.00 3.07 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 S 7.53 3.76 0.00 4.03 3.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 58 L 8.05 4.37 0.00 1.84 1.70 0.93 0.92 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 59 V 7.23 4.98 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 0.79 0.00 0.00 0.64 0.00 0.00 60 D 8.42 4.89 0.00 2.94 2.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 61 D 8.67 4.78 0.00 2.86 2.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 E 8.41 4.73 0.00 1.95 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 2.19 2.23 0.00 63 A 8.08 4.03 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 N 8.57 4.60 0.00 3.13 2.78 0.00 0.00 6.70 8.45 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 65 V 8.23 4.24 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 0.78 0.00 0.00 0.97 0.00 0.00 66 D 8.82 4.61 0.00 2.74 2.57 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 67 E 8.52 3.97 0.00 2.08 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 2.40 0.00 68 D 8.11 4.41 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 69 I 7.79 3.72 2.01 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 0.58 0.93 0.00 0.00 70 M 8.08 4.16 0.00 2.29 2.07 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 2.59 2.64 0.00 71 L 8.40 4.08 0.00 1.81 1.87 0.91 0.81 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 72 G 7.83 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 73 L 7.61 4.33 0.00 1.84 1.76 0.92 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 74 L 7.23 4.34 0.00 1.61 1.37 0.78 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 75 P 0.00 4.58 0.00 2.23 2.26 0.00 3.41 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 1.93 2.11 0.00 76 D 8.66 4.34 0.00 2.86 2.96 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 77 Q 8.00 4.16 0.00 2.16 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.88 0.00 0.00 0.00 0.00 0.00 2.27 2.32 0.00 78 L 7.63 4.44 0.00 1.56 1.40 -0.43 0.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.00 0.00 0.00 0.00 0.00 0.00 79 Q 7.75 3.92 0.00 2.03 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.80 6.82 0.00 0.00 0.00 0.00 0.00 2.61 2.52 0.00 80 E 8.02 3.98 0.00 1.95 1.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.29 0.00 81 R 7.93 3.82 0.00 1.82 1.97 0.00 3.14 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.68 0.00 82 A 8.08 4.00 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 83 Q 8.15 4.11 0.00 2.26 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.76 0.00 0.00 0.00 0.00 0.00 2.36 2.50 0.00 84 S 8.24 4.05 0.00 3.87 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 85 V 8.22 3.60 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 1.07 0.00 0.00 0.99 0.00 0.00 86 M 8.62 4.20 0.00 2.08 2.19 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.72 2.57 0.00 87 G 7.91 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 88 K 7.65 4.13 0.00 1.77 1.99 0.00 1.78 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.43 1.46 7.81 89 C 8.26 4.58 0.00 3.04 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 90 L 7.13 4.87 0.00 1.73 1.57 0.93 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.00 0.00 0.00 0.00 0.00 0.00 91 P 0.00 4.57 0.00 2.19 2.05 0.00 3.77 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 1.99 1.95 0.00 92 T 8.18 4.13 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 1.25 0.00 0.00 93 S 8.11 4.61 0.00 3.97 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 94 G 7.83 4.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 S 8.49 4.28 0.00 3.98 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 96 D 7.33 4.41 0.00 2.84 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 97 N 8.20 4.12 0.00 2.19 1.76 0.00 0.00 6.84 7.66 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 98 C 7.95 4.33 0.00 3.05 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 99 N 9.29 4.26 0.00 2.83 2.82 0.00 0.00 7.24 7.69 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 0.00 100 K 8.20 4.35 0.00 2.05 1.89 0.00 1.77 0.00 0.00 1.76 0.00 0.00 2.94 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.55 1.52 7.81 101 I 7.87 3.88 2.14 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.85 1.18 1.05 0.00 0.00 102 Y 8.40 4.18 0.00 3.08 3.24 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 0.00 103 N 8.51 4.08 0.00 3.05 2.84 0.00 0.00 6.75 7.02 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 0.00 104 L 8.11 3.90 0.00 1.87 1.87 0.95 0.95 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 0.00 105 A 8.53 4.10 1.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 K 7.80 3.54 0.00 1.57 1.59 0.00 1.37 0.00 0.00 1.25 0.00 0.00 2.83 0.00 0.00 2.88 0.00 0.00 0.00 0.00 0.60 0.75 7.81 107 C 7.83 4.14 0.00 3.04 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 0.00 108 V 7.86 3.52 2.28 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 1.25 0.00 0.00 1.02 0.00 0.00 109 Q 7.64 3.44 0.00 0.93 1.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.58 0.00 0.00 0.00 0.00 0.00 1.34 1.38 0.00 110 E 7.61 3.92 0.00 2.00 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 2.25 2.42 0.00 111 S 7.73 4.37 0.00 3.93 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 0.00 112 A 7.93 4.78 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 113 P 0.00 4.54 0.00 2.27 2.49 0.00 3.88 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 2.10 1.92 0.00 114 D 8.15 4.70 0.00 2.88 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 0.00 115 V 7.65 4.65 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 0.76 0.00 0.00 1.04 0.00 0.00 116 W 7.90 4.60 0.00 3.60 3.28 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 0.00 117 F 7.44 4.73 0.00 3.16 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 0.00 118 V 7.97 3.54 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 0.79 0.00 0.00 0.51 0.00 0.00 119 I 7.77 3.98 1.53 0.00 0.00 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 1.24 1.08 0.72 0.00 0.00