NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1822 8.1727 122.0523 56.2915 34.0975 173.9669 2 N 5.1547 8.5696 126.0796 51.4430 39.7693 173.5322 3 F 4.4511 10.0250 127.2244 57.6171 40.4565 174.8098 4 E 4.2888 9.1390 120.9861 55.3382 31.1785 176.4105 5 R 3.3492 9.0489 119.5925 61.1508 29.9439 179.2515 6 C 4.2815 8.0459 115.2781 59.7895 37.6464 175.7494 7 E 3.9116 8.1403 120.6183 59.2841 29.2765 178.5608 8 L 3.6389 8.0753 120.0944 57.7722 42.0574 178.4835 9 A 3.9280 7.8863 120.8353 55.5831 18.2507 179.9753 10 R 3.9188 8.0740 116.2520 59.4709 29.9500 179.4372 11 T 3.8639 7.8121 115.7874 66.6052 68.4459 176.7171 12 L 3.8501 8.2538 121.3649 57.4200 41.6038 179.4046 13 K 3.9094 8.0680 119.6664 59.6840 31.9629 179.1714 14 R 4.0120 8.1184 117.2926 58.6992 30.0226 178.0929 15 L 4.3199 7.3286 116.6827 54.5939 41.8344 177.3034 16 G 3.8816 7.8159 107.2335 46.3259 0.0000 174.7890 17 M 3.9392 7.8370 120.9373 56.4712 32.2736 175.6134 18 D 4.3162 7.9963 117.4674 55.9995 40.6379 175.5210 19 G 3.9365 9.4965 115.4171 45.3753 0.0000 170.9361 20 Y 4.2541 8.2473 121.7893 58.6973 38.9201 176.4686 21 R 3.6145 8.9566 126.9141 57.2918 27.7539 177.2633 22 G 3.8200 8.1962 103.2624 45.7721 0.0000 174.0262 23 I 4.0697 7.5802 122.1133 59.3904 37.9792 175.9830 24 S 4.6514 8.3119 120.7659 57.9558 64.9629 174.8981 25 L 4.2442 8.7149 123.8664 58.3902 41.8225 178.9397 26 A 4.1378 8.1719 120.3164 55.3195 18.3258 179.2180 27 N 4.4227 8.0933 114.7176 56.3915 38.6085 177.7197 28 W 4.2987 7.9368 120.0919 59.9642 29.0167 178.5548 29 M 4.1120 8.5495 119.0186 58.6132 31.4674 177.9646 30 C 3.1622 8.1631 118.8167 59.0158 44.3679 175.3733 31 L 3.9951 8.0640 121.7303 58.2918 41.8013 178.8671 32 A 4.2777 8.3146 122.1004 54.3344 18.2523 179.5040 33 K 3.0510 8.3260 118.3784 59.4219 32.1038 179.1630 34 W 4.3365 7.8400 117.1097 58.9945 29.0562 178.3441 35 E 4.3648 8.3390 118.8285 58.5597 29.3550 177.6252 36 S 4.5270 7.9517 109.6015 56.6087 64.5179 174.8012 37 G 3.3694 8.2774 108.9115 46.7985 0.0000 173.5095 38 Y 3.6781 7.8035 113.9975 58.5149 35.1046 168.1626 39 N 5.2789 7.6249 119.8961 52.0136 39.6142 175.8617 40 T 4.0835 8.8887 117.4643 64.1503 69.0845 175.9321 41 R 4.3730 8.3653 119.4954 55.7988 30.7517 176.2863 42 A 4.3340 7.7352 121.8009 52.6288 19.3276 177.0375 43 T 5.6302 8.2434 110.6440 59.6978 72.4327 172.9552 44 N 4.8950 8.3931 121.5380 52.3458 42.2599 172.1075 45 Y 4.8605 8.7430 127.7701 56.9879 40.9880 173.8271 46 N 4.7853 8.3966 124.6401 51.1954 39.0290 175.3671 47 A 3.6613 8.3155 127.8653 54.7143 19.0135 179.0563 48 G 3.7905 8.1498 104.3770 48.3035 0.0000 173.9907 49 D 4.7748 7.6352 116.8018 51.8921 39.9172 175.9840 50 R 3.8185 7.9994 116.0219 56.9701 28.1871 175.8495 51 S 4.9869 7.2035 108.1199 56.9755 66.6549 172.6616 52 T 5.1390 8.7633 115.5346 61.9830 72.8067 172.8788 53 D 5.3931 9.0407 125.4336 53.2760 43.1037 175.1114 54 Y 5.0508 9.0524 120.9154 57.3932 41.7690 177.5368 55 G 4.5519 8.9003 111.6956 45.7122 0.0000 173.6064 56 I 4.0476 8.0765 116.4510 62.8047 37.8648 177.6943 57 F 4.8763 7.9345 115.5953 56.4158 40.1556 175.0299 58 Q 3.6472 8.0066 119.2238 57.0959 26.4881 174.0506 59 I 4.3903 8.2463 119.0185 61.0180 39.3243 176.9931 60 N 5.3633 9.2010 126.0737 53.4578 39.6950 175.8941 61 S 4.5956 9.1309 120.5088 60.7210 63.4599 175.4443 62 R 3.7540 8.7358 122.0077 58.8030 30.3075 177.9399 63 Y 4.4588 7.7693 113.8674 57.4962 40.6898 177.1864 64 W 4.8273 8.0950 119.0338 57.8459 30.1261 173.7076 65 C 5.5601 7.9014 110.5404 53.5687 45.7364 171.8298 66 N 4.9650 8.9514 119.8001 52.1171 39.5056 174.8005 67 D 4.7658 8.6558 123.4981 52.3095 40.3363 177.3580 68 G 3.9862 8.4191 107.6912 46.0702 0.0000 174.4859 69 K 4.5225 8.1315 116.9861 56.4907 33.0427 175.7069 70 T 4.6206 7.7032 116.8201 61.3417 69.6687 172.1020 71 P 4.2432 0.0000 0.0000 64.0367 31.6394 176.3412 72 G 3.8614 8.8547 109.9338 46.2956 0.0000 173.1996 73 A 4.3215 7.4852 120.2250 51.5544 19.3833 177.6142 74 V 4.3287 8.3840 112.4527 59.3665 35.6389 176.1477 75 N 4.9301 8.0927 117.6177 51.7887 37.7752 174.1637 76 A 4.0641 9.1871 124.2800 54.6032 19.1395 178.4301 77 C 4.4954 8.8332 110.9910 56.4532 40.8967 173.7729 78 H 4.0106 7.6744 115.6302 56.5678 26.3413 174.3326 79 L 4.8187 8.4333 117.8690 52.8368 46.3921 176.7022 80 S 4.6045 8.4000 115.8572 58.0314 63.2617 175.9635 81 C 3.9911 8.6502 124.4702 59.8041 40.2228 176.3623 82 S 3.9015 7.7865 114.3826 61.3684 61.6365 176.0287 83 A 4.0333 7.9094 122.4901 54.4669 18.1705 177.9449 84 L 4.4512 7.8209 116.4259 55.0797 41.7334 177.6254 85 L 5.0565 7.9372 117.2506 54.5057 42.4994 176.7348 86 Q 4.3761 7.8565 117.6840 55.3374 29.5667 175.9744 87 D 4.4210 8.5313 119.9647 57.0694 41.1561 176.7152 88 N 4.5911 8.0344 118.2436 53.1388 39.2422 174.7354 89 I 4.1785 8.4449 118.7690 60.9291 37.9871 176.9208 90 A 3.9296 8.2963 124.4821 56.1040 18.1770 179.9367 91 D 4.2748 8.0981 116.2349 57.4327 40.9229 178.8054 92 A 4.1001 7.9505 120.9237 55.1082 18.4257 179.7251 93 V 3.4940 8.3020 117.1282 65.9437 31.6818 178.1831 94 A 3.8378 8.1579 120.8139 55.1603 18.1181 178.8491 95 C 4.2516 8.4280 116.9168 59.6702 38.3656 175.5904 96 A 3.9121 8.4043 122.8689 55.0316 17.5773 179.8220 97 K 3.8870 7.7078 116.3750 59.4452 32.4360 179.1133 98 R 4.0891 7.7377 118.7338 59.3719 29.8804 178.5186 99 V 2.4619 7.5614 117.9809 65.8680 31.0416 178.0663 100 V 3.8944 7.6894 109.7068 62.7483 31.2884 178.0824 101 R 4.2168 7.6659 117.2712 57.2994 30.5186 176.4042 102 D 4.7205 7.4656 119.3227 52.5616 41.8103 175.2154 103 P 4.2280 0.0000 0.0000 66.4105 30.9841 177.9144 104 Q 4.0073 8.1333 117.2362 56.3180 30.0930 177.1509 105 G 3.6825 7.8550 106.9740 46.8406 0.0000 176.0002 106 I 3.5199 7.7308 120.1668 63.3196 37.9618 177.9510 107 R 4.1653 7.2248 117.6168 57.9226 30.0365 177.3799 108 A 4.0402 7.5952 121.0046 54.4033 18.5688 177.7462 109 W 4.6489 8.0130 116.5143 55.5237 29.7151 177.5619 110 V 3.7485 8.7279 123.7439 66.0043 30.9034 177.6881 111 A 4.0454 8.2776 120.1128 54.6053 18.1308 179.2873 112 W 3.9858 8.4150 127.3550 60.6529 30.5713 178.4889 113 R 3.7902 8.2150 116.5249 59.3517 29.6915 178.3354 114 N 4.4210 8.3231 115.4760 55.4630 38.6340 176.1610 115 R 4.2662 7.7805 115.0510 55.6754 31.7432 175.2480 116 C 4.5246 7.2848 114.4789 57.8333 43.0119 174.3632 117 Q 3.2042 6.6853 120.2049 57.1447 28.7221 175.5158 118 N 4.1727 8.5538 121.4936 54.5389 36.3349 173.9287 119 R 4.5320 7.3143 114.0016 54.0690 33.4402 175.9249 120 D 4.5509 8.4624 119.3484 54.0624 40.2348 176.0674 121 V 4.5235 8.1708 118.8963 61.3703 32.4674 178.4312 122 R 4.0236 8.1463 121.8917 59.4352 29.5727 178.6049 123 Q 3.9991 8.1673 116.7636 59.6251 27.9621 178.5110 124 Y 4.0681 7.8349 117.8045 59.9229 38.3031 176.9130 125 V 4.4065 7.7188 110.7664 60.7218 32.8502 175.3820 126 Q 4.2149 7.5501 120.4629 57.2168 28.7365 177.0471 127 G 3.9502 8.9204 110.4438 46.0191 0.0000 174.4147 128 C 4.4715 8.0634 115.5478 56.4556 40.5303 173.7683 129 G 3.8823 8.0594 107.2973 46.9033 0.0000 174.3103 130 V 4.0107 7.9138 117.9364 61.0840 32.0758 175.9069 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 K 8.17 4.18 0.00 2.05 1.67 0.00 1.29 0.00 0.00 1.08 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.96 1.16 7.81 2 N 8.57 5.15 0.00 2.83 2.73 0.00 0.00 7.13 6.14 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 3 F 10.02 4.45 0.00 2.85 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 4 E 9.14 4.29 0.00 1.96 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 2.31 2.25 0.00 5 R 9.05 3.35 0.00 2.01 1.92 0.00 3.39 0.00 0.00 3.46 7.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.89 0.00 6 C 8.05 4.28 0.00 3.01 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 7 E 8.14 3.91 0.00 2.06 2.25 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 2.62 2.42 0.00 8 L 8.08 3.64 0.00 1.41 1.39 -0.14 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 0.00 0.00 0.00 0.00 0.00 0.00 9 A 7.89 3.93 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 10 R 8.07 3.92 0.00 1.89 1.99 0.00 3.14 0.00 0.00 3.29 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.00 11 T 7.81 3.86 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 1.22 0.00 0.00 12 L 8.25 3.85 0.00 1.72 1.57 0.90 0.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 13 K 8.07 3.91 0.00 1.94 1.92 0.00 1.65 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.21 0.00 0.00 0.00 0.00 1.44 1.50 7.81 14 R 8.12 4.01 0.00 1.92 1.97 0.00 3.20 0.00 0.00 3.22 7.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.87 0.00 15 L 7.33 4.32 0.00 1.55 1.56 0.86 0.93 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 G 7.82 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 17 M 7.84 3.94 0.00 1.32 1.96 0.00 0.00 0.00 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 2.21 0.00 18 D 8.00 4.32 0.00 2.69 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 19 G 9.50 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 20 Y 8.25 4.25 0.00 3.40 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 21 R 8.96 3.61 0.00 1.82 1.81 0.00 3.33 0.00 0.00 2.96 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.33 0.00 22 G 8.20 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 23 I 7.58 4.07 1.72 0.00 0.00 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.88 0.64 -0.20 0.00 0.00 24 S 8.31 4.65 0.00 4.11 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 0.00 25 L 8.71 4.24 0.00 2.06 1.81 0.99 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.17 4.14 1.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 27 N 8.09 4.42 0.00 2.78 2.75 0.00 0.00 7.01 8.98 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 28 W 7.94 4.30 0.00 3.51 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 29 M 8.55 4.11 0.00 2.12 2.33 0.00 0.00 0.00 0.00 0.00 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.71 2.93 0.00 30 C 8.16 3.16 0.00 2.59 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 31 L 8.06 4.00 0.00 1.87 1.90 0.62 -0.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.31 4.28 1.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 K 8.33 3.05 0.00 1.77 1.65 0.00 0.61 0.00 0.00 0.69 0.00 0.00 2.75 0.00 0.00 2.39 0.00 0.00 0.00 0.00 1.23 0.49 7.81 34 W 7.84 4.34 0.00 3.46 3.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 35 E 8.34 4.36 0.00 2.05 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.58 2.54 0.00 36 S 7.95 4.53 0.00 4.10 4.16 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 37 G 8.28 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 0.00 0.00 0.00 38 Y 7.80 3.68 0.00 3.25 3.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 39 N 7.62 5.28 0.00 2.95 2.86 0.00 0.00 7.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 40 T 8.89 4.08 4.45 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 1.48 0.00 0.00 41 R 8.37 4.37 0.00 2.01 2.03 0.00 3.19 0.00 0.00 3.24 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.59 0.00 42 A 7.74 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 43 T 8.24 5.63 4.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 44 N 8.39 4.90 0.00 2.83 2.86 0.00 0.00 6.72 7.56 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 45 Y 8.74 4.86 0.00 2.97 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 46 N 8.40 4.79 0.00 2.61 2.59 0.00 0.00 6.61 7.54 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 47 A 8.32 3.66 1.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 48 G 8.15 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 49 D 7.64 4.77 0.00 2.74 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 50 R 8.00 3.82 0.00 2.04 2.17 0.00 3.11 0.00 0.00 3.20 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.52 0.00 51 S 7.20 4.99 0.00 3.88 3.91 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 52 T 8.76 5.14 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 0.69 0.00 0.00 53 D 9.04 5.39 0.00 2.68 2.81 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 54 Y 9.05 5.05 0.00 2.93 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 55 G 8.90 4.55 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 0.00 56 I 8.08 4.05 1.65 0.00 0.00 0.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 2.05 0.05 0.00 0.00 57 F 7.93 4.88 0.00 3.22 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 58 Q 8.01 3.65 0.00 2.54 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.95 6.83 0.00 0.00 0.00 0.00 0.00 2.52 2.71 0.00 59 I 8.25 4.39 2.13 0.00 0.00 1.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.18 1.10 0.00 0.00 60 N 9.20 5.36 0.00 3.10 3.05 0.00 0.00 6.97 7.18 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 61 S 9.13 4.60 0.00 4.07 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 0.00 62 R 8.74 3.75 0.00 1.59 1.35 0.00 2.64 0.00 0.00 2.82 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.96 0.00 63 Y 7.77 4.46 0.00 1.51 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 0.00 0.00 0.00 64 W 8.09 4.83 0.00 3.69 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 65 C 7.90 5.56 0.00 3.17 3.20 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 66 N 8.95 4.96 0.00 2.77 2.70 0.00 0.00 7.09 9.25 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 67 D 8.66 4.77 0.00 2.84 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 68 G 8.42 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 0.00 0.00 0.00 69 K 8.13 4.52 0.00 1.86 1.87 0.00 1.58 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.53 1.45 7.81 70 T 7.70 4.62 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 1.21 0.00 0.00 71 P 0.00 4.24 0.00 2.01 2.01 0.00 3.83 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.04 2.11 0.00 72 G 8.85 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 73 A 7.49 4.32 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 74 V 8.38 4.33 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 0.62 0.00 0.00 0.85 0.00 0.00 75 N 8.09 4.93 0.00 2.75 2.56 0.00 0.00 6.77 8.34 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 76 A 9.19 4.06 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 77 C 8.83 4.50 0.00 3.24 3.25 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 0.00 78 H 7.67 4.01 0.00 3.31 3.37 0.00 5.80 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 79 L 8.43 4.82 0.00 1.66 1.50 1.00 1.08 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 80 S 8.40 4.60 0.00 3.83 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 81 C 8.65 3.99 0.00 2.28 1.23 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 82 S 7.79 3.90 0.00 3.88 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 83 A 7.91 4.03 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 84 L 7.82 4.45 0.00 1.93 1.82 1.07 0.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.94 5.06 0.00 1.76 1.71 1.12 1.32 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 86 Q 7.86 4.38 0.00 2.23 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.54 7.10 0.00 0.00 0.00 0.00 0.00 2.37 2.51 0.00 87 D 8.53 4.42 0.00 2.63 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 88 N 8.03 4.59 0.00 2.70 2.75 0.00 0.00 6.96 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 89 I 8.44 4.18 1.71 0.00 0.00 0.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.97 0.89 0.00 0.00 90 A 8.30 3.93 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 91 D 8.10 4.27 0.00 2.75 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 92 A 7.95 4.10 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 93 V 8.30 3.49 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 0.68 0.00 0.00 0.88 0.00 0.00 94 A 8.16 3.84 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 95 C 8.43 4.25 0.00 3.16 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 96 A 8.40 3.91 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.71 3.89 0.00 1.65 1.50 0.00 1.29 0.00 0.00 0.80 0.00 0.00 2.24 0.00 0.00 2.50 0.00 0.00 0.00 0.00 0.30 0.92 7.81 98 R 7.74 4.09 0.00 2.02 2.18 0.00 3.30 0.00 0.00 3.23 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 2.03 0.00 99 V 7.56 2.46 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 -0.37 0.00 0.00 -0.35 0.00 0.00 100 V 7.69 3.89 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 1.20 0.00 0.00 1.44 0.00 0.00 101 R 7.67 4.22 0.00 2.06 2.05 0.00 3.24 0.00 0.00 3.40 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.12 0.00 102 D 7.47 4.72 0.00 2.97 2.63 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 0.00 103 P 0.00 4.23 0.00 2.15 2.20 0.00 3.77 0.00 0.00 3.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 2.00 0.00 104 Q 8.13 4.01 0.00 2.05 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.83 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.85 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 0.00 106 I 7.73 3.52 0.98 0.00 0.00 -0.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 -0.36 -0.85 0.00 0.00 107 R 7.22 4.17 0.00 2.00 2.02 0.00 3.21 0.00 0.00 3.27 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 1.49 0.00 108 A 7.60 4.04 0.79 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 0.00 109 W 8.01 4.65 0.00 3.57 3.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 110 V 8.73 3.75 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 1.19 0.00 0.00 1.00 0.00 0.00 111 A 8.28 4.05 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 0.00 112 W 8.41 3.99 0.00 3.47 3.48 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 0.00 113 R 8.21 3.79 0.00 2.04 2.01 0.00 3.35 0.00 0.00 3.32 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 2.00 0.00 114 N 8.32 4.42 0.00 2.65 2.72 0.00 0.00 6.87 7.47 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 0.00 115 R 7.78 4.27 0.00 0.97 0.79 0.00 2.21 0.00 0.00 2.25 7.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 1.20 0.00 116 C 7.28 4.52 0.00 1.61 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 0.00 117 Q 6.69 3.20 0.00 0.93 1.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.52 6.76 0.00 0.00 0.00 0.00 0.00 2.19 2.19 0.00 118 N 8.55 4.17 0.00 2.78 2.80 0.00 0.00 6.86 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 0.00 119 R 7.31 4.53 0.00 1.76 1.78 0.00 3.24 0.00 0.00 3.05 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.54 0.00 120 D 8.46 4.55 0.00 2.64 2.63 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 0.00 121 V 8.17 4.52 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 0.84 0.00 0.00 1.04 0.00 0.00 122 R 8.15 4.02 0.00 2.02 2.17 0.00 3.16 0.00 0.00 3.24 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.69 0.00 123 Q 8.17 4.00 0.00 2.09 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.34 6.90 0.00 0.00 0.00 0.00 0.00 2.13 1.66 0.00 124 Y 7.83 4.07 0.00 3.25 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 0.00 125 V 7.72 4.41 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 1.03 0.00 0.00 1.04 0.00 0.00 126 Q 7.55 4.21 0.00 2.12 2.06 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.71 0.00 0.00 0.00 0.00 0.00 2.53 2.45 0.00 127 G 8.92 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 0.00 0.00 0.00 128 C 8.06 4.47 0.00 3.03 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 0.00 129 G 8.06 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 0.00 130 V 7.91 4.01 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 0.80 0.00 0.00 0.96 0.00 0.00