NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.9405 8.0544 114.0499 61.6667 32.8967 174.6297 2 H 3.9059 8.4472 120.8472 54.7263 28.9677 172.4538 3 L 4.4827 7.2599 129.0140 53.3933 45.1750 175.8114 4 T 4.5866 7.5328 109.7042 60.5968 71.8121 173.1172 5 P 4.6300 0.0000 0.0000 63.4662 31.5537 177.8481 6 E 4.2220 7.8697 118.8659 58.2106 29.9938 178.2303 7 E 3.8978 7.8855 118.4372 59.2168 29.5843 179.1569 8 K 3.8991 8.1587 119.5707 59.1512 32.1876 178.7779 9 S 4.0866 8.2390 113.5695 60.9825 62.4554 175.8501 10 A 4.0927 7.8141 123.4612 54.5725 18.1521 179.9077 11 V 3.4713 7.7803 117.3090 66.5693 31.6099 178.4732 12 T 4.0302 8.1892 115.4816 66.2130 67.9917 176.4972 13 A 4.0124 7.7751 122.1637 55.4660 18.7812 179.3120 14 L 3.9398 8.0202 117.9467 57.4889 42.1771 178.3827 15 W 4.5063 8.5053 127.4489 59.1590 30.5851 177.9699 16 G 3.7919 8.2162 104.7200 47.1709 0.0000 175.0747 17 K 4.3470 7.7971 119.5582 56.9193 32.5907 177.2689 18 V 3.5716 6.9192 119.8507 61.8707 31.8542 175.8860 19 N 4.3157 8.4185 125.2745 53.4344 38.0817 174.9793 20 V 3.4142 8.1511 126.4681 66.2451 31.7193 176.7637 21 D 4.3618 8.1810 117.6079 58.2383 40.6961 178.2152 22 E 3.8921 8.2203 119.4108 58.5617 29.4706 178.5379 23 V 3.5093 8.0053 117.8220 66.0738 31.7225 178.6035 24 G 3.7403 8.2385 105.3224 47.9432 0.0000 175.7428 25 G 3.6401 7.8970 108.6357 47.2825 0.0000 175.5971 26 E 3.8779 8.0927 120.6556 58.9473 29.4972 179.0612 27 A 3.9261 8.1399 121.1314 55.1426 18.4285 179.3450 28 L 3.9283 7.9599 118.6260 58.2444 42.2116 178.9484 29 G 3.8310 8.0815 105.7524 48.3946 0.0000 175.7356 30 R 3.8924 8.3165 121.2049 58.2922 29.9712 178.4324 31 L 3.9029 8.0203 120.1515 58.8907 41.8751 179.2836 32 L 4.0810 7.9954 119.7006 56.9773 41.2777 179.7971 33 V 3.4934 7.3485 117.9070 65.8784 31.6514 177.9400 34 V 3.5715 7.9302 117.5289 64.5372 32.7138 175.7980 35 Y 3.8631 7.1360 117.8454 54.5851 37.6567 174.2140 36 P 4.7434 0.0000 0.0000 63.5590 31.9425 177.7935 37 W 4.3500 7.6072 116.5605 58.6086 28.4568 177.9225 38 T 4.0933 7.6560 111.6060 64.9093 68.0253 175.6314 39 Q 4.6173 8.3320 119.4195 56.8595 28.3519 178.0633 40 R 3.7804 7.6812 118.3451 58.8598 29.3400 177.9198 41 F 4.2170 7.1533 115.5070 57.2516 39.3847 176.0311 42 F 4.6287 7.8329 118.3635 57.0627 39.5729 176.9103 43 E 4.1982 8.1659 121.5250 58.5484 28.0913 178.3573 44 S 4.4142 8.0681 113.1870 60.1479 63.5341 175.5773 45 F 4.5349 8.3333 119.1490 57.6337 40.1846 175.4576 46 G 4.2035 6.8564 104.4768 44.5288 0.0000 175.3419 47 D 5.0049 8.7743 123.3356 52.2865 43.0128 175.2787 48 L 4.7250 8.5054 123.5111 54.6521 42.4201 177.1751 49 S 4.5604 7.7145 112.0413 58.7972 63.9196 173.5470 50 T 4.4092 7.3425 109.9195 59.6525 70.9479 171.3321 51 P 4.1911 0.0000 0.0000 66.5704 31.1335 178.2797 52 D 4.2906 8.0148 116.5305 57.0014 40.7835 178.0528 53 A 3.9361 7.7747 120.9211 55.5984 18.1143 179.7294 54 V 3.5271 7.9672 115.3468 66.4859 31.6975 177.7929 55 M 4.3263 8.2342 116.7103 56.7175 32.0997 177.7505 56 G 3.9990 7.6401 103.7554 43.2036 0.0000 173.8351 57 N 4.2713 7.4945 120.6980 53.8093 39.9513 173.6217 58 P 4.2959 0.0000 0.0000 65.2482 31.6886 178.8451 59 K 3.6345 8.2973 117.7247 58.9765 31.7368 179.1543 60 V 3.5961 7.8522 118.2808 65.9707 31.4770 177.6410 61 K 3.7885 8.0379 117.6223 59.7321 32.1509 179.0497 62 A 3.9623 8.1164 120.6989 55.5144 18.2495 179.1853 63 H 4.3326 8.4249 116.8367 59.0120 29.9482 177.4403 64 G 3.7204 8.6486 108.1117 47.8622 0.0000 175.4538 65 K 4.0683 8.2642 121.5562 59.0041 32.2181 178.4523 66 K 3.9070 7.8732 119.8380 59.8855 32.0633 178.9489 67 V 3.7741 8.3622 118.6627 65.7485 31.5392 178.0464 68 L 4.3524 8.3174 118.7688 56.8893 41.5249 179.2428 69 G 3.8367 8.4998 106.3152 48.0521 0.0000 175.6032 70 A 4.1458 7.9803 121.9866 54.6736 18.7283 179.0768 71 F 4.3981 8.8289 119.5081 62.2340 39.4700 176.6358 72 S 4.1420 9.5135 113.0619 62.4165 62.6082 177.6269 73 D 4.3851 8.7594 120.7679 56.8127 40.8294 179.3899 74 G 3.7206 8.0589 105.2413 46.0997 0.0000 175.6796 75 L 3.7129 7.1616 120.6295 57.5434 41.5858 178.8137 76 A 4.0365 7.1849 114.8819 52.5750 19.4495 177.3422 77 H 4.5280 8.5757 111.3391 58.1619 32.3455 175.8432 78 L 3.6779 7.0468 123.2116 57.6234 42.2509 179.1099 79 D 4.9634 7.4838 115.0811 53.5569 41.4272 176.6537 80 N 4.6305 7.8595 116.0950 52.2173 41.0079 174.8728 81 L 4.0804 8.0861 124.1236 57.1821 41.9627 178.3918 82 K 4.0013 8.1506 116.9840 59.4289 31.8120 178.7044 83 G 3.8328 7.6078 104.2101 46.0845 0.0000 176.0991 84 T 3.6427 7.4847 117.8229 66.5878 68.7945 176.0653 85 F 4.4129 8.3865 117.4996 58.0556 39.1852 177.5530 86 A 3.8636 7.7373 121.4517 55.3640 18.0571 180.0294 87 T 3.8306 7.8134 113.7383 66.9631 68.6271 176.8723 88 L 4.0764 8.0125 120.2706 57.6136 41.6429 178.8664 89 S 4.3649 8.9305 115.6468 60.8755 62.1545 175.6274 90 E 3.8142 8.3502 121.4268 59.5120 29.2318 178.8498 91 L 3.9131 8.1946 120.0874 58.4299 42.2252 178.1154 92 H 4.3826 8.6159 114.5949 57.2752 28.5031 176.8577 93 C 3.6014 7.8424 121.8869 62.2419 31.1322 175.0092 94 D 4.2789 8.2446 120.8320 56.5503 40.6625 178.5908 95 K 4.1545 7.6963 117.3608 58.7243 32.8402 178.3767 96 L 4.1761 7.8231 117.3753 54.9076 42.1487 176.7095 97 H 4.2106 7.4232 113.6595 56.7940 26.1049 174.8054 98 V 3.6328 7.7674 119.4157 61.1502 32.1197 175.0723 99 D 4.3079 8.7482 127.2081 53.7516 41.7085 174.8871 100 P 3.1299 0.0000 0.0000 65.9800 30.7283 177.9268 101 E 3.9040 8.3199 118.4587 59.0238 29.3166 178.5093 102 N 4.3722 8.0701 116.6153 55.7540 38.4611 177.2907 103 F 4.5740 7.5211 119.6451 60.7157 38.9958 177.8468 104 R 3.9228 7.9462 117.0136 59.2844 29.9592 178.8068 105 L 3.8318 7.7623 118.7496 57.8903 41.5987 179.5334 106 L 4.0870 8.3181 120.3848 57.7605 41.9831 179.0338 107 G 3.7287 8.1141 105.9664 48.1367 0.0000 175.4430 108 N 4.4861 8.1881 119.1501 55.7747 38.5816 177.8168 109 V 3.5923 8.1352 119.9587 65.7187 31.5738 177.5055 110 L 3.8481 8.4965 120.5483 58.4051 41.8293 179.1024 111 V 3.5191 7.8453 117.7432 66.2464 31.3595 177.3593 112 C 3.8977 8.1908 116.5166 63.2297 27.9785 176.6696 113 V 3.5133 7.6051 119.2847 65.6974 31.0022 177.9563 114 L 3.8002 7.7876 118.5728 57.6388 41.4427 179.1180 115 A 3.8375 7.1770 120.3761 55.5374 18.1044 179.0433 116 H 4.0829 7.9969 115.1286 59.7005 29.9492 176.7064 117 H 3.7712 7.9939 118.6497 59.1560 30.1471 176.8647 118 F 4.4645 8.5331 119.0651 57.9836 39.4112 177.0089 119 G 3.9789 8.7704 107.6413 46.6690 0.0000 174.8960 120 K 4.4535 8.7413 124.9923 56.9411 32.5590 177.5078 121 E 4.1872 8.0629 121.5041 58.3428 29.9311 176.9693 122 F 4.4545 8.2181 122.9193 57.1398 37.7583 175.2847 123 T 4.2615 7.4297 116.9496 59.5317 71.5424 173.4745 124 P 4.1622 0.0000 0.0000 65.6311 31.3336 177.1197 125 P 4.2383 0.0000 0.0000 65.3796 31.1484 178.9163 126 V 3.5170 7.3411 116.0436 65.7835 31.4486 177.4555 127 Q 3.7605 7.7000 119.6288 59.5220 28.7386 178.7471 128 A 4.0744 7.9939 121.0339 55.2055 18.3879 179.5679 129 A 3.8128 7.8123 118.7280 55.7226 18.5074 179.5282 130 Y 3.7663 8.2679 115.2495 61.2347 37.8520 179.0338 131 Q 4.1236 8.8693 119.5020 59.0012 28.8031 179.0018 132 K 4.0565 7.8733 119.1639 59.0386 31.9588 179.7814 133 V 3.4371 7.5095 118.1770 66.2185 31.5174 178.7175 134 V 3.8045 8.3066 112.1231 64.0373 31.3074 178.6235 135 A 4.0743 7.9888 120.7912 54.9225 18.2141 179.5283 136 G 3.6257 7.9704 104.3523 48.3758 0.0000 176.1032 137 V 3.3678 8.1145 121.2484 64.6923 31.4319 178.0739 138 A 3.8070 8.1007 121.1178 55.0525 18.0499 179.1272 139 N 4.2295 7.8962 114.0088 56.7190 38.8221 176.6032 140 A 4.1114 8.2371 122.6067 55.2589 18.3331 179.6779 141 L 3.7992 7.6433 117.2128 57.5201 41.4337 178.9617 142 A 4.3274 8.1373 119.1805 53.4096 18.2322 178.6133 143 H 4.1562 7.7880 116.1630 59.3831 30.0859 176.5767 144 K 4.1492 8.2639 118.3587 58.8783 32.2237 177.4120 145 Y 4.1433 7.8224 117.6435 58.4695 38.2201 175.9874 146 H 4.4004 8.5718 118.9278 56.0686 28.2478 173.2314 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 V 8.05 3.94 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 0.87 0.00 0.00 0.84 0.00 0.00 2 H 8.45 3.91 0.00 3.84 3.18 0.00 5.71 0.00 0.00 0.00 0.00 6.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 L 7.26 4.48 0.00 1.51 1.47 0.74 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 4 T 7.53 4.59 4.54 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 1.19 0.00 0.00 5 P 0.00 4.63 0.00 2.16 2.09 0.00 3.57 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.15 0.00 6 E 7.87 4.22 0.00 1.94 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 2.32 2.31 0.00 7 E 7.89 3.90 0.00 2.16 1.87 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 2.27 2.26 0.00 8 K 8.16 3.90 0.00 1.73 1.74 0.00 1.54 0.00 0.00 1.51 0.00 0.00 2.83 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.37 1.34 7.81 9 S 8.24 4.09 0.00 3.93 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 10 A 7.81 4.09 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 11 V 7.78 3.47 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 0.58 0.00 0.00 0.34 0.00 0.00 12 T 8.19 4.03 4.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 13 A 7.78 4.01 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 14 L 8.02 3.94 0.00 1.86 1.99 0.43 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 15 W 8.51 4.51 0.00 3.90 3.29 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 16 G 8.22 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 0.00 0.00 0.00 17 K 7.80 4.35 0.00 1.93 2.11 0.00 1.86 0.00 0.00 1.75 0.00 0.00 2.99 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.50 1.59 7.81 18 V 6.92 3.57 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 -0.18 0.00 0.00 0.67 0.00 0.00 19 N 8.42 4.32 0.00 2.69 2.60 0.00 0.00 6.80 7.71 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 20 V 8.15 3.41 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 1.14 0.00 0.00 0.87 0.00 0.00 21 D 8.18 4.36 0.00 2.84 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 22 E 8.22 3.89 0.00 1.92 1.88 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 2.32 2.20 0.00 23 V 8.01 3.51 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 0.88 0.00 0.00 0.62 0.00 0.00 24 G 8.24 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 0.00 0.00 0.00 25 G 7.90 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 26 E 8.09 3.88 0.00 2.09 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.42 0.00 27 A 8.14 3.93 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 28 L 7.96 3.93 0.00 1.77 1.63 0.91 0.98 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 29 G 8.08 3.83 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 0.00 0.00 0.00 30 R 8.32 3.89 0.00 1.87 1.92 0.00 3.10 0.00 0.00 3.01 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 31 L 8.02 3.90 0.00 1.88 1.90 0.98 0.58 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 32 L 8.00 4.08 0.00 1.83 1.66 0.68 0.77 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 33 V 7.35 3.49 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 0.70 0.00 0.00 0.92 0.00 0.00 34 V 7.93 3.57 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 0.06 0.00 0.00 0.72 0.00 0.00 35 Y 7.14 3.86 0.00 2.65 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 36 P 0.00 4.74 0.00 2.29 2.26 0.00 3.74 0.00 0.00 3.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.18 1.87 0.00 37 W 7.61 4.35 0.00 3.52 3.44 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 38 T 7.66 4.09 4.39 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 1.16 0.00 0.00 39 Q 8.33 4.62 0.00 2.32 2.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.81 0.00 0.00 0.00 0.00 0.00 2.42 2.48 0.00 40 R 7.68 3.78 0.00 1.67 1.93 0.00 3.07 0.00 0.00 2.92 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.80 0.50 0.00 41 F 7.15 4.22 0.00 1.57 2.39 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 42 F 7.83 4.63 0.00 2.81 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 0.00 0.00 0.00 0.00 43 E 8.17 4.20 0.00 1.99 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 0.00 2.29 2.25 0.00 44 S 8.07 4.41 0.00 4.13 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 45 F 8.33 4.53 0.00 3.19 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 46 G 6.86 4.20 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 0.00 47 D 8.77 5.00 0.00 2.63 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 48 L 8.51 4.72 0.00 1.67 1.65 1.03 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 0.00 0.00 0.00 0.00 49 S 7.71 4.56 0.00 4.02 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 50 T 7.34 4.41 4.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 51 P 0.00 4.19 0.00 2.14 2.13 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.16 0.00 52 D 8.01 4.29 0.00 2.67 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 53 A 7.77 3.94 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 54 V 7.97 3.53 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 0.83 0.00 0.00 0.94 0.00 0.00 55 M 8.23 4.33 0.00 1.99 2.12 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.74 0.00 56 G 7.64 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 N 7.49 4.27 0.00 2.85 2.85 0.00 0.00 7.16 8.29 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 58 P 0.00 4.30 0.00 2.08 2.02 0.00 2.75 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 2.05 2.04 0.00 59 K 8.30 3.63 0.00 1.30 0.74 0.00 1.49 0.00 0.00 1.13 0.00 0.00 2.87 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.11 1.21 7.81 60 V 7.85 3.60 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 0.90 0.00 0.00 1.05 0.00 0.00 61 K 8.04 3.79 0.00 1.93 1.84 0.00 1.79 0.00 0.00 1.61 0.00 0.00 2.92 0.00 0.00 3.15 0.00 0.00 0.00 0.00 1.43 1.60 7.81 62 A 8.12 3.96 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 63 H 8.42 4.33 0.00 3.46 3.27 0.00 5.81 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 64 G 8.65 3.72 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 0.00 0.00 0.00 65 K 8.26 4.07 0.00 1.85 1.91 0.00 1.78 0.00 0.00 1.58 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.46 1.85 7.81 66 K 7.87 3.91 0.00 1.93 1.96 0.00 1.76 0.00 0.00 1.69 0.00 0.00 2.96 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.49 1.53 7.81 67 V 8.36 3.77 2.13 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 1.11 0.00 0.00 0.93 0.00 0.00 68 L 8.32 4.35 0.00 1.96 1.89 0.92 0.78 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 69 G 8.50 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 0.00 0.00 0.00 70 A 7.98 4.15 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 F 8.83 4.40 0.00 3.22 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 72 S 9.51 4.14 0.00 4.19 4.67 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 73 D 8.76 4.39 0.00 2.76 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 74 G 8.06 3.72 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 0.00 0.00 0.00 75 L 7.16 3.71 0.00 1.51 1.41 0.29 -0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 76 A 7.18 4.04 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 H 8.58 4.53 0.00 3.02 3.08 0.00 5.85 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 78 L 7.05 3.68 0.00 1.53 1.58 0.73 0.92 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 79 D 7.48 4.96 0.00 2.60 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 80 N 7.86 4.63 0.00 2.70 2.60 0.00 0.00 7.25 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 81 L 8.09 4.08 0.00 1.74 1.77 0.86 1.05 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 82 K 8.15 4.00 0.00 1.66 1.80 0.00 1.56 0.00 0.00 0.95 0.00 0.00 2.95 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.30 1.43 7.81 83 G 7.61 3.83 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 0.00 0.00 0.00 84 T 7.48 3.64 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 0.38 0.00 0.00 85 F 8.39 4.41 0.00 3.32 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 86 A 7.74 3.86 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 87 T 7.81 3.83 4.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 88 L 8.01 4.08 0.00 1.90 1.89 1.11 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 89 S 8.93 4.36 0.00 4.03 4.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 E 8.35 3.81 0.00 2.07 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 2.33 2.29 0.00 91 L 8.19 3.91 0.00 1.88 1.98 0.90 1.27 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 92 H 8.62 4.38 0.00 3.57 3.80 0.00 5.86 0.00 0.00 0.00 0.00 6.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 C 7.84 3.60 0.00 1.23 2.36 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 94 D 8.24 4.28 0.00 2.74 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 95 K 7.70 4.15 0.00 1.74 1.81 0.00 1.74 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.36 1.44 7.81 96 L 7.82 4.18 0.00 1.67 1.61 0.68 1.37 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 97 H 7.42 4.21 0.00 3.20 3.55 0.00 5.64 0.00 0.00 0.00 0.00 7.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.77 3.63 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.03 0.00 0.00 0.41 0.00 0.00 99 D 8.75 4.31 0.00 2.79 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 0.00 100 P 0.00 3.13 0.00 2.07 1.79 0.00 3.47 0.00 0.00 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.87 0.00 101 E 8.32 3.90 0.00 2.05 1.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.38 0.00 102 N 8.07 4.37 0.00 2.47 2.70 0.00 0.00 6.84 8.39 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 0.00 103 F 7.52 4.57 0.00 3.15 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 0.00 104 R 7.95 3.92 0.00 1.98 1.98 0.00 3.22 0.00 0.00 3.34 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.75 0.00 105 L 7.76 3.83 0.00 1.78 1.51 0.68 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.14 0.00 0.00 0.00 0.00 0.00 0.00 106 L 8.32 4.09 0.00 1.82 1.86 0.93 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 107 G 8.11 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 0.00 108 N 8.19 4.49 0.00 2.84 2.95 0.00 0.00 6.72 7.68 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 0.00 109 V 8.14 3.59 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 1.05 0.00 0.00 1.14 0.00 0.00 110 L 8.50 3.85 0.00 1.76 1.90 0.88 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.00 0.00 0.00 0.00 0.00 0.00 111 V 7.85 3.52 2.33 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 1.26 0.00 0.00 1.17 0.00 0.00 112 C 8.19 3.90 0.00 3.15 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 0.00 113 V 7.61 3.51 2.13 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 1.00 0.00 0.00 0.92 0.00 0.00 114 L 7.79 3.80 0.00 0.96 1.05 0.58 0.65 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 0.00 115 A 7.18 3.84 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 0.00 116 H 8.00 4.08 0.00 3.08 3.42 0.00 5.78 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 H 7.99 3.77 0.00 2.98 3.08 0.00 5.99 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 F 8.53 4.46 0.00 3.38 2.97 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 0.00 0.00 0.00 119 G 8.77 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 0.00 120 K 8.74 4.45 0.00 1.91 1.95 0.00 1.60 0.00 0.00 1.65 0.00 0.00 2.84 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.44 1.47 7.81 121 E 8.06 4.19 0.00 2.05 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 2.32 2.28 0.00 122 F 8.22 4.45 0.00 3.08 3.08 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 0.00 123 T 7.43 4.26 4.20 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 1.29 0.00 0.00 124 P 0.00 4.16 0.00 2.15 2.15 0.00 3.57 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 2.20 0.00 125 P 0.00 4.24 0.00 2.11 2.06 0.00 3.54 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 2.08 2.11 0.00 126 V 7.34 3.52 1.89 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 1.10 0.00 0.00 0.88 0.00 0.00 127 Q 7.70 3.76 0.00 1.74 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.52 0.00 0.00 0.00 0.00 0.00 2.47 2.69 0.00 128 A 7.99 4.07 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 0.00 129 A 7.81 3.81 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 0.00 130 Y 8.27 3.77 0.00 3.53 3.38 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 0.00 131 Q 8.87 4.12 0.00 2.20 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.81 0.00 0.00 0.00 0.00 0.00 2.76 2.63 0.00 132 K 7.87 4.06 0.00 1.91 1.80 0.00 1.59 0.00 0.00 1.53 0.00 0.00 2.88 0.00 0.00 3.25 0.00 0.00 0.00 0.00 1.44 1.56 7.81 133 V 7.51 3.44 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 0.95 0.00 0.00 0.70 0.00 0.00 134 V 8.31 3.80 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 0.99 0.00 0.00 1.12 0.00 0.00 135 A 7.99 4.07 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 0.00 136 G 7.97 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 0.00 137 V 8.11 3.37 1.71 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 0.51 0.00 0.00 0.59 0.00 0.00 138 A 8.10 3.81 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 0.00 139 N 7.90 4.23 0.00 3.02 2.83 0.00 0.00 7.26 7.79 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 0.00 140 A 8.24 4.11 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 0.00 141 L 7.64 3.80 0.00 0.96 0.60 -0.31 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 142 A 8.14 4.33 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 0.00 143 H 7.79 4.16 0.00 3.38 3.64 0.00 5.76 0.00 0.00 0.00 0.00 7.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 144 K 8.26 4.15 0.00 1.82 1.85 0.00 1.80 0.00 0.00 1.72 0.00 0.00 3.05 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.57 1.62 7.81 145 Y 7.82 4.14 0.00 3.00 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 0.00 146 H 8.57 4.40 0.00 3.10 3.30 0.00 5.75 0.00 0.00 0.00 0.00 6.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00