NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 V 3.6643 8.0544 120.3730 62.5090 32.5370 174.3405 2 E 4.1686 8.3184 127.7511 54.0992 29.9891 173.4895 3 W 5.0213 8.4278 126.6891 55.4898 32.2942 176.2812 4 T 4.5494 9.2269 113.2031 60.9492 71.4084 175.9243 5 D 4.4476 8.4958 120.8500 57.0875 40.8573 178.9463 6 K 4.0155 8.0475 120.0372 59.5260 32.2750 178.5945 7 E 4.1217 8.2716 118.9598 59.4291 29.5135 179.5555 8 R 3.7428 8.0494 118.2478 59.1726 30.0558 179.0896 9 S 4.1060 8.0018 112.5407 61.1901 62.3659 176.1456 10 I 3.6954 7.7579 122.5292 64.7123 36.9490 178.5837 11 I 3.7940 7.8957 120.4223 64.2100 36.7827 178.5743 12 S 4.1276 7.8724 113.8421 61.0641 62.0566 175.4511 13 D 4.3128 8.2448 120.0930 57.7085 41.3231 177.7502 14 I 3.7209 7.8817 119.9775 65.0389 37.0215 178.2659 15 F 3.9727 8.2856 117.8210 60.5851 38.6076 177.9206 16 S 4.2763 8.1102 112.7636 60.5817 62.9925 175.0969 17 H 4.7993 7.6628 117.3678 54.7608 29.6073 174.4861 18 M 4.1474 7.4424 122.0905 55.0057 32.6079 175.9660 19 D 4.7495 8.5196 122.4406 53.2712 42.4789 176.7679 20 Y 4.2007 8.6857 126.1617 61.1179 37.8008 177.7792 21 D 4.5536 8.0903 118.5400 55.9801 41.2500 177.1148 22 D 4.6608 7.7489 117.8086 56.3156 42.1936 178.1448 23 I 3.9512 7.9321 120.5101 64.1229 37.0945 178.7729 24 G 3.5420 7.9817 106.2076 47.3057 0.0000 174.1777 25 P 4.2637 0.0000 0.0000 65.1651 31.4201 178.9440 26 K 3.9737 7.7516 115.8581 59.2252 32.0485 179.3455 27 A 3.9688 8.2742 121.4534 54.9665 18.2907 179.5488 28 L 3.8751 7.9300 118.7978 58.3605 42.2376 178.8277 29 S 4.0505 7.9869 115.2278 62.0734 62.8671 176.9872 30 R 3.8479 7.9321 120.7952 59.6160 29.7802 178.1326 31 C 4.3562 7.9681 118.2827 62.3274 31.5475 175.5256 32 L 4.0926 7.9449 122.1359 56.6292 40.9116 179.6513 33 V 3.4674 7.4524 117.7404 66.0421 31.7083 178.1367 34 V 3.5785 7.9343 116.7262 64.4218 32.6448 175.4719 35 Y 3.8236 7.3406 116.3544 54.2513 38.2701 173.8859 36 P 5.0241 0.0000 0.0000 63.9892 32.0907 178.3145 37 W 4.3882 7.9612 116.7980 59.3866 28.1909 177.9896 38 T 4.3473 7.6295 110.8598 64.5569 68.3013 176.3674 39 Q 4.3203 8.0968 120.8046 58.8726 28.4107 178.5868 40 R 3.9287 7.8147 118.7747 59.2797 30.0974 177.4434 41 Y 4.3353 7.7625 114.3792 58.2192 38.9675 176.0495 42 F 4.0801 7.5903 119.1854 55.5433 37.7900 173.7135 43 S 4.0213 7.9887 119.4438 58.7180 62.8882 171.0114 44 G 3.8902 10.0009 121.4018 45.7196 0.0000 171.5874 45 F 5.2750 8.8364 121.7540 56.8818 46.8031 175.1765 46 G 3.9591 8.3940 105.3818 44.3481 0.0000 175.1992 47 N 4.6154 8.5228 120.1283 52.8494 37.2457 173.8178 48 L 4.7600 8.1811 123.3710 55.7503 44.1356 177.2619 49 Y 3.5843 7.8622 107.3470 58.5109 38.4076 177.9218 50 N 4.8873 9.5432 132.2777 52.8240 40.5466 175.6971 51 A 4.0595 8.5419 117.1498 54.9260 18.7304 178.7400 52 E 4.4878 8.0404 114.0945 57.5633 30.2841 178.2211 53 G 3.6827 8.0670 107.4581 46.1724 0.0000 175.8654 54 I 3.6140 7.6613 120.8619 64.0492 37.3351 178.1264 55 M 4.1375 7.7562 117.7738 57.3889 32.0411 176.8038 56 S 4.5627 7.6438 110.9445 57.3350 63.8777 173.7607 57 N 4.3163 7.7683 120.1113 53.7151 39.2531 175.4738 58 A 4.0239 8.5276 130.5147 54.9576 18.5838 178.7623 59 N 4.1593 8.4246 115.7439 56.1160 38.3189 177.8046 60 V 3.0413 7.3059 118.2696 65.5071 31.8861 177.4711 61 A 4.0283 7.8386 120.2481 55.0618 18.1421 179.0504 62 A 3.9385 8.0206 119.0994 56.0379 18.3416 179.5160 63 H 4.2943 8.3264 115.9596 58.9079 29.8758 177.7036 64 G 3.6369 8.3352 108.3693 47.7249 0.0000 175.8723 65 I 3.7856 7.7320 121.6892 64.1882 37.2485 178.4818 66 K 4.1127 7.9443 119.3845 59.4176 31.7268 179.5972 67 V 3.6983 7.5789 118.8592 65.9143 31.5498 178.1594 68 L 4.0872 7.8126 118.4652 57.9389 41.3048 179.1308 69 H 4.6681 8.4817 116.3557 58.5808 28.4057 177.8411 70 G 3.7340 7.9830 106.5501 46.9963 0.0000 175.2201 71 L 4.5970 7.5726 121.1463 56.4477 41.8264 178.3685 72 D 4.0787 8.1018 117.8257 57.4463 40.9077 178.4622 73 R 3.9506 7.5797 117.8037 59.1180 30.2059 178.3233 74 G 3.8646 8.1835 105.3661 47.3515 0.0000 175.5529 75 M 3.7882 7.8930 119.4610 58.2109 32.3105 177.6697 76 K 4.1329 7.4869 116.7840 57.3075 33.9439 176.5137 77 N 5.0014 7.6862 117.6929 52.6215 38.8308 175.1263 78 M 4.3067 7.7823 118.0896 57.9277 32.7580 177.8104 79 D 4.8637 8.0329 116.6499 55.2584 41.9472 175.6766 80 N 5.1349 8.0435 118.5563 52.8545 39.8627 176.4783 81 I 3.8040 8.3922 119.0951 64.4605 38.0331 178.3367 82 A 4.0526 8.3689 122.6994 55.4573 18.0413 178.9875 83 D 4.5786 7.5299 111.3508 55.7807 41.3240 177.6684 84 A 4.0549 7.6686 120.2451 53.6904 18.2284 177.4467 85 Y 4.7831 7.3519 112.2698 58.0326 38.8537 178.2592 86 T 4.0024 8.0074 120.0995 66.6288 68.5683 175.7848 87 D 4.3819 8.1599 120.5860 56.8737 39.1097 178.6479 88 L 4.0178 7.8954 120.4521 57.1316 41.9365 179.3541 89 S 4.3572 8.5257 114.6461 60.7233 61.8926 176.0376 90 T 4.1429 7.4645 114.4550 64.4203 67.6079 176.0267 91 L 4.0875 7.8619 122.2593 58.6941 42.2498 178.7994 92 H 4.3500 8.7419 116.4633 57.6961 28.5553 176.7881 93 S 5.2304 7.5489 116.0773 57.8908 63.3731 173.6498 94 E 4.5114 7.6471 120.8753 56.1293 33.1348 175.4834 95 K 4.4665 8.2279 117.1537 56.2499 34.0665 176.1342 96 L 4.5314 7.7059 115.8797 54.1367 43.8432 176.0695 97 H 4.0912 8.2377 113.2160 56.4251 26.0897 174.8065 98 V 2.9632 7.3954 119.1348 62.3165 31.6727 175.2411 99 D 4.3388 8.3828 128.2202 53.4343 41.9251 174.9248 100 P 3.9114 0.0000 0.0000 66.5641 30.3455 178.1341 101 D 4.3705 8.4276 117.9584 57.0505 40.6279 178.3575 102 N 4.3682 8.2199 117.3992 55.7969 38.4489 177.4198 103 F 4.3489 7.3761 119.2273 60.2515 38.9036 177.4841 104 K 3.9714 8.0467 119.0025 59.3004 32.0384 178.7868 105 L 3.7719 7.4207 118.5966 57.6439 41.5352 179.1841 106 L 4.0009 7.8323 120.2670 58.2724 42.0760 178.8449 107 S 4.1994 8.2941 113.1043 61.5886 62.2530 175.9497 108 D 4.4662 8.1480 121.6519 57.5539 40.5685 178.5397 109 C 4.2638 8.2609 117.3615 62.6732 28.1062 176.1237 110 I 3.7395 8.3226 121.9538 64.7215 36.7513 178.4558 111 T 3.9696 8.0082 116.4070 66.8639 68.2543 176.7134 112 I 3.7088 7.8237 121.5940 64.3467 37.2423 178.7610 113 V 3.5230 7.8358 119.1275 65.8369 31.3907 177.8892 114 L 3.6995 8.2902 120.3033 57.8659 41.9274 178.8092 115 A 3.3943 8.0412 120.8919 54.6239 18.0022 179.2970 116 A 4.0177 7.4618 118.1557 54.3423 18.5553 179.5940 117 K 3.9758 7.4718 117.4444 59.9961 32.8787 178.7801 118 M 4.1886 8.1165 118.4462 55.5529 32.3325 177.7897 119 G 3.8294 8.5120 107.6439 46.8111 0.0000 177.2283 120 H 4.2727 9.0780 121.0126 57.9175 28.6014 176.1902 121 A 4.1269 7.7812 121.2282 54.2056 18.7363 178.0561 122 F 4.5609 7.7937 120.6051 57.1507 37.7841 175.0963 123 T 4.1117 7.2894 115.8835 60.5060 71.4693 175.2815 124 A 3.9195 8.2885 122.3511 55.2961 18.3067 179.4420 125 E 3.8216 7.9912 117.1447 59.6413 29.8388 178.6703 126 T 3.7820 7.5189 115.3087 66.9176 68.5149 176.1517 127 Q 3.7625 8.3976 122.3794 59.0274 29.0447 178.6278 128 G 3.6203 8.5383 106.9275 47.5602 0.0000 175.6651 129 A 4.1733 8.1255 123.1173 55.1511 18.5502 179.3974 130 F 4.3656 8.4527 119.2665 61.6772 39.3133 177.1635 131 Q 3.9888 8.6153 119.2674 58.9849 29.0409 177.8863 132 K 3.9024 8.1437 120.5156 59.5314 32.1891 178.1308 133 F 4.7639 8.8357 120.9729 61.8943 39.3157 177.1259 134 L 3.5227 8.0447 118.0488 57.5896 41.3865 179.5184 135 A 4.0086 8.3530 120.7741 54.7805 18.1610 179.6624 136 A 3.8624 7.7256 119.1635 55.2755 18.6024 180.0190 137 V 3.0993 7.4770 116.8386 65.9141 31.1179 178.4207 138 V 3.2643 8.0948 118.3022 65.8156 31.2421 177.8325 139 S 4.0618 8.0436 112.6699 61.4627 62.0297 176.0990 140 A 4.0393 7.8211 121.7971 54.5561 18.2322 179.0748 141 L 3.8788 7.4461 117.5355 56.5906 41.7008 178.8869 142 G 3.8916 7.6414 103.6805 46.0177 0.0000 176.5130 143 K 4.1855 7.4796 121.4325 59.4113 32.1619 176.6035 144 Q 3.5428 7.0765 116.7496 57.5592 29.0740 175.5754 145 Y 4.7428 7.4723 117.1147 56.5847 41.1298 175.8430 146 H 4.5939 8.8230 118.8243 56.0676 29.2526 174.2887 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 3.66 1.69 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 -0.43 0.00 0.00 0.72 0.00 0.00 2 E 8.32 4.17 0.00 1.95 1.73 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 2.21 2.38 0.00 3 W 8.43 5.02 0.00 3.34 3.09 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 4 T 9.23 4.55 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 1.32 0.00 0.00 5 D 8.50 4.45 0.00 2.82 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 6 K 8.05 4.02 0.00 1.85 1.85 0.00 1.74 0.00 0.00 1.84 0.00 0.00 2.94 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.55 7.81 7 E 8.27 4.12 0.00 2.54 2.35 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 2.52 2.49 0.00 8 R 8.05 3.74 0.00 2.03 1.90 0.00 3.15 0.00 0.00 3.07 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.73 0.00 9 S 8.00 4.11 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 I 7.76 3.70 2.06 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.54 0.96 0.00 0.00 11 I 7.90 3.79 1.77 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 1.38 1.18 0.52 0.00 0.00 12 S 7.87 4.13 0.00 3.89 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 13 D 8.24 4.31 0.00 2.87 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 14 I 7.88 3.72 2.03 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.92 0.44 0.00 0.00 15 F 8.29 3.97 0.00 3.10 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 16 S 8.11 4.28 0.00 4.00 4.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 H 7.66 4.80 0.00 3.18 3.32 0.00 5.65 0.00 0.00 0.00 0.00 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 18 M 7.44 4.15 0.00 2.13 2.33 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.33 0.00 19 D 8.52 4.75 0.00 2.80 2.58 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 20 Y 8.69 4.20 0.00 2.98 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 21 D 8.09 4.55 0.00 2.82 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 22 D 7.75 4.66 0.00 2.94 2.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.93 3.95 1.81 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.72 0.83 0.00 0.00 24 G 7.98 3.54 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 0.00 0.00 0.00 25 P 0.00 4.26 0.00 2.15 2.08 0.00 3.60 0.00 0.00 3.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.17 0.00 26 K 7.75 3.97 0.00 1.83 1.82 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.92 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.43 1.65 7.81 27 A 8.27 3.97 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 28 L 7.93 3.88 0.00 1.90 1.65 0.91 1.16 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 29 S 7.99 4.05 0.00 4.13 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 30 R 7.93 3.85 0.00 2.04 2.05 0.00 3.08 0.00 0.00 3.07 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.59 0.00 31 C 7.97 4.36 0.00 3.22 3.09 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 32 L 7.94 4.09 0.00 1.83 1.65 0.80 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00 33 V 7.45 3.47 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 0.72 0.00 0.00 0.97 0.00 0.00 34 V 7.93 3.58 1.59 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 0.06 0.00 0.00 0.76 0.00 0.00 35 Y 7.34 3.82 0.00 2.57 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 5.02 0.00 2.38 2.27 0.00 3.61 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 2.12 2.11 0.00 37 W 7.96 4.39 0.00 3.60 3.54 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 38 T 7.63 4.35 4.47 0.00 0.00 0.00 0.00 0.00 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 39 Q 8.10 4.32 0.00 2.38 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.09 6.82 0.00 0.00 0.00 0.00 0.00 2.43 2.40 0.00 40 R 7.81 3.93 0.00 1.85 1.68 0.00 2.98 0.00 0.00 2.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.54 0.00 41 Y 7.76 4.34 0.00 2.56 2.52 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 0.00 42 F 7.59 4.08 0.00 2.84 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 43 S 7.99 4.02 0.00 3.80 3.81 0.00 0.00 0.00 0.00 0.00 0.00 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 G 10.00 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 0.00 0.00 0.00 45 F 8.84 5.27 0.00 2.93 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 46 G 8.39 3.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 N 8.52 4.62 0.00 2.63 2.63 0.00 0.00 6.55 7.85 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 48 L 8.18 4.76 0.00 1.81 1.71 0.98 1.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 49 Y 7.86 3.58 0.00 2.90 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 50 N 9.54 4.89 0.00 2.91 3.05 0.00 0.00 5.82 7.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 A 8.54 4.06 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 52 E 8.04 4.49 0.00 1.95 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.27 2.30 0.00 53 G 8.07 3.68 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 0.00 0.00 0.00 54 I 7.66 3.61 1.86 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 1.40 0.89 0.86 0.00 0.00 55 M 7.76 4.14 0.00 1.91 2.28 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.56 0.00 56 S 7.64 4.56 0.00 3.95 3.85 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 57 N 7.77 4.32 0.00 2.85 2.71 0.00 0.00 7.09 8.24 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 58 A 8.53 4.02 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 59 N 8.42 4.16 0.00 2.50 2.32 0.00 0.00 6.48 8.09 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 60 V 7.31 3.04 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 0.72 0.00 0.00 0.62 0.00 0.00 61 A 7.84 4.03 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 62 A 8.02 3.94 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 63 H 8.33 4.29 0.00 3.66 3.51 0.00 5.79 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 8.34 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 65 I 7.73 3.79 2.14 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.86 0.94 1.05 0.00 0.00 66 K 7.94 4.11 0.00 1.80 1.88 0.00 1.64 0.00 0.00 1.62 0.00 0.00 2.96 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.52 1.64 7.81 67 V 7.58 3.70 2.29 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 1.08 0.00 0.00 1.12 0.00 0.00 68 L 7.81 4.09 0.00 1.56 0.98 0.87 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 0.00 0.00 0.00 0.00 0.00 0.00 69 H 8.48 4.67 0.00 3.54 3.45 0.00 5.63 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 70 G 7.98 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 71 L 7.57 4.60 0.00 2.27 2.26 1.16 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 0.00 0.00 0.00 0.00 0.00 0.00 72 D 8.10 4.08 0.00 3.11 3.03 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 0.00 0.00 0.00 0.00 73 R 7.58 3.95 0.00 1.93 2.07 0.00 2.53 0.00 0.00 2.99 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 1.49 0.00 74 G 8.18 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 0.00 0.00 0.00 75 M 7.89 3.79 0.00 1.49 0.79 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 2.09 0.00 76 K 7.49 4.13 0.00 1.63 1.77 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.95 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.38 1.49 7.81 77 N 7.69 5.00 0.00 2.67 2.58 0.00 0.00 7.06 8.77 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 78 M 7.78 4.31 0.00 1.50 1.84 0.00 0.00 0.00 0.00 0.00 -0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.66 2.15 0.00 79 D 8.03 4.86 0.00 2.71 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 80 N 8.04 5.13 0.00 2.79 2.82 0.00 0.00 7.06 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 8.39 3.80 2.03 0.00 0.00 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 1.57 1.13 1.12 0.00 0.00 82 A 8.37 4.05 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 83 D 7.53 4.58 0.00 2.72 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 84 A 7.67 4.05 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 85 Y 7.35 4.78 0.00 3.05 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 86 T 8.01 4.00 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.20 0.00 0.00 87 D 8.16 4.38 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 88 L 7.90 4.02 0.00 1.90 1.85 1.15 0.86 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 89 S 8.53 4.36 0.00 4.06 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 90 T 7.46 4.14 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 1.33 0.00 0.00 91 L 7.86 4.09 0.00 1.82 1.80 0.90 1.01 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 92 H 8.74 4.35 0.00 3.43 3.65 0.00 5.81 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 93 S 7.55 5.23 0.00 4.19 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 94 E 7.65 4.51 0.00 1.78 2.16 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 1.65 2.11 0.00 95 K 8.23 4.47 0.00 1.70 1.87 0.00 1.78 0.00 0.00 1.67 0.00 0.00 2.80 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.30 1.49 7.81 96 L 7.71 4.53 0.00 1.80 1.59 0.85 0.94 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 H 8.24 4.09 0.00 3.37 3.41 0.00 5.71 0.00 0.00 0.00 0.00 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 98 V 7.40 2.96 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 -0.03 0.00 0.00 0.35 0.00 0.00 99 D 8.38 4.34 0.00 2.70 2.49 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 0.00 100 P 0.00 3.91 0.00 2.30 2.40 0.00 3.69 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.11 0.00 101 D 8.43 4.37 0.00 2.81 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 0.00 102 N 8.22 4.37 0.00 2.35 2.71 0.00 0.00 6.87 7.94 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 0.00 103 F 7.38 4.35 0.00 3.04 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 0.00 104 K 8.05 3.97 0.00 1.79 1.91 0.00 1.73 0.00 0.00 1.88 0.00 0.00 2.95 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.51 1.48 7.81 105 L 7.42 3.77 0.00 1.67 1.15 0.47 0.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 106 L 7.83 4.00 0.00 1.84 1.87 0.98 1.02 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 0.00 107 S 8.29 4.20 0.00 3.90 4.04 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 0.00 0.00 0.00 108 D 8.15 4.47 0.00 3.00 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 0.00 109 C 8.26 4.26 0.00 3.19 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 0.00 110 I 8.32 3.74 2.13 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 0.75 1.07 0.00 0.00 111 T 8.01 3.97 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 1.49 0.00 0.00 112 I 7.82 3.71 2.01 0.00 0.00 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.39 0.90 0.00 0.00 113 V 7.84 3.52 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 0.93 0.00 0.00 0.98 0.00 0.00 114 L 8.29 3.70 0.00 1.48 1.32 0.59 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.73 0.00 0.00 0.00 0.00 0.00 0.00 115 A 8.04 3.39 1.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 116 A 7.46 4.02 1.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 K 7.47 3.98 0.00 1.81 1.71 0.00 1.72 0.00 0.00 1.64 0.00 0.00 3.00 0.00 0.00 3.14 0.00 0.00 0.00 0.00 1.39 1.42 7.81 118 M 8.12 4.19 0.00 2.17 2.12 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.48 0.00 119 G 8.51 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 0.00 120 H 9.08 4.27 0.00 3.13 3.42 0.00 5.90 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 121 A 7.78 4.13 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 0.00 122 F 7.79 4.56 0.00 2.88 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 0.00 123 T 7.29 4.11 4.17 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 1.22 0.00 0.00 124 A 8.29 3.92 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 0.00 125 E 7.99 3.82 0.00 2.03 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 2.37 2.41 0.00 126 T 7.52 3.78 4.03 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 0.00 0.00 0.00 1.20 0.00 0.00 127 Q 8.40 3.76 0.00 1.28 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.80 0.00 0.00 0.00 0.00 0.00 2.41 2.55 0.00 128 G 8.54 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 0.00 129 A 8.13 4.17 1.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 130 F 8.45 4.37 0.00 3.38 3.34 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 0.00 131 Q 8.62 3.99 0.00 2.47 2.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.15 6.56 0.00 0.00 0.00 0.00 0.00 2.42 2.45 0.00 132 K 8.14 3.90 0.00 2.13 2.25 0.00 1.66 0.00 0.00 1.60 0.00 0.00 2.13 0.00 0.00 2.51 0.00 0.00 0.00 0.00 1.13 1.32 7.81 133 F 8.84 4.76 0.00 3.24 3.30 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 0.00 134 L 8.04 3.52 0.00 1.70 1.53 0.58 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 135 A 8.35 4.01 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 0.00 136 A 7.73 3.86 1.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.48 3.10 1.73 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 0.31 0.00 0.00 0.14 0.00 0.00 138 V 8.09 3.26 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 0.97 0.00 0.00 0.92 0.00 0.00 139 S 8.04 4.06 0.00 4.14 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 0.00 140 A 7.82 4.04 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 0.00 141 L 7.45 3.88 0.00 0.87 0.17 0.12 0.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 142 G 7.64 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 0.00 0.00 0.00 143 K 7.48 4.19 0.00 1.81 1.75 0.00 1.79 0.00 0.00 1.68 0.00 0.00 3.00 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.39 1.41 7.81 144 Q 7.08 3.54 0.00 2.01 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.40 0.00 0.00 0.00 0.00 0.00 2.30 2.45 0.00 145 Y 7.47 4.74 0.00 2.97 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 0.00 146 H 8.82 4.59 0.00 3.15 3.18 0.00 5.73 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