NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1594 8.1727 122.0490 56.2915 34.1440 174.0913 2 V 4.5484 8.1614 126.8131 60.8271 32.2174 174.5414 3 F 4.4641 9.2105 127.6856 57.3109 40.3247 174.7560 4 E 4.2988 8.9598 122.3115 55.5426 31.1505 176.8389 5 R 3.4068 8.9214 124.6104 60.2765 30.0806 179.6618 6 C 4.3597 8.4503 115.3413 59.6123 36.3055 175.6417 7 E 3.8995 8.1924 120.9434 59.1168 29.1747 178.6228 8 L 3.5028 7.9471 120.1525 57.8108 42.0862 178.5891 9 A 3.9374 7.6462 120.2492 55.4899 18.3630 179.9143 10 R 3.9029 8.0575 116.3654 59.5098 30.1340 179.5289 11 T 3.8180 7.7558 115.4919 66.7208 68.5297 176.7100 12 L 3.8586 8.4366 121.2941 57.4560 41.5741 179.4625 13 K 3.8544 8.0247 119.5664 59.7017 31.9607 178.8239 14 R 3.9253 7.6717 117.2460 59.0806 30.0277 177.4757 15 L 4.3448 7.5195 116.0688 54.1887 41.8232 177.0014 16 G 3.8621 7.8642 107.0104 46.8381 0.0000 175.0807 17 M 3.8655 7.8898 121.2115 56.5320 32.2762 175.6548 18 D 4.3944 7.9920 117.5792 56.3499 40.9419 175.6584 19 G 3.9444 9.4410 115.8659 45.3240 0.0000 171.1549 20 Y 4.1632 8.1786 121.5174 58.7940 38.8844 176.3996 21 R 3.6239 8.9777 126.5277 57.2041 27.8923 177.1530 22 G 3.8150 8.2137 103.0313 45.6226 0.0000 173.9319 23 I 4.1815 7.6060 121.7266 58.8039 38.2958 175.8187 24 S 4.6968 8.3886 120.3756 57.8922 63.8087 174.9301 25 L 4.2442 9.2858 123.8228 58.6304 41.6679 179.3914 26 A 4.1440 8.1634 120.1194 55.3063 18.3123 179.2545 27 N 4.4220 8.1412 114.6115 56.3117 38.6536 177.7018 28 W 4.1864 8.0150 119.8921 59.8930 29.1658 178.3701 29 M 4.1755 8.4538 118.7803 58.5926 31.6082 177.8217 30 C 3.1936 8.2720 118.9630 59.2141 43.7669 175.3250 31 L 3.9600 8.1393 121.5190 58.3045 41.7432 178.7535 32 A 4.2320 8.1917 121.9655 54.3467 18.3722 179.3858 33 K 2.8432 8.0225 118.0117 59.3959 32.0289 179.0715 34 W 4.2245 7.6502 116.8010 59.1102 29.0825 178.4056 35 E 4.3131 8.4103 118.7816 58.6534 29.4758 177.7870 36 S 4.5331 8.0533 110.1579 56.4843 64.5021 174.5187 37 G 3.2653 7.8635 108.4276 46.8918 0.0000 173.1086 38 Y 3.6402 7.6528 113.3128 58.7141 35.2756 168.7634 39 N 5.3390 7.6061 118.1514 51.9767 39.7744 175.6509 40 T 3.9768 8.8742 117.6694 63.9320 69.1270 175.9135 41 R 4.4970 8.1245 116.8353 55.6215 30.1350 176.2135 42 A 4.3513 7.6936 122.5393 52.8334 19.3399 177.1049 43 T 5.0600 8.2900 110.5062 60.2603 72.4625 173.0284 44 N 4.8757 8.7939 121.8044 52.4737 42.2330 172.4525 45 Y 4.7417 8.7735 127.9214 57.2343 40.8955 173.9179 46 N 4.7079 8.7641 124.7202 51.1910 38.6319 175.2291 47 A 3.6744 8.3492 127.6376 54.8718 18.8626 179.0719 48 G 3.8200 8.1019 104.0100 48.2167 0.0000 173.7257 49 D 4.6960 7.3919 114.4947 51.8981 40.4001 175.7522 50 R 3.9532 8.2103 116.6278 57.1271 28.0918 175.8573 51 S 4.9228 7.8107 112.9354 57.2120 66.1437 172.8008 52 T 5.0991 8.7551 115.8608 61.9163 72.6916 172.8485 53 D 5.3748 8.9194 125.3087 53.2695 42.9720 175.0059 54 Y 5.0730 9.3902 121.8244 57.5360 41.2647 177.2304 55 G 4.3599 9.3250 111.9651 46.3277 0.0000 173.2612 56 I 3.9960 8.1741 116.3607 62.9820 37.9182 177.8923 57 F 4.8629 7.9597 115.3621 56.4401 39.8847 175.3669 58 Q 3.5134 7.8127 119.0442 57.0924 26.4967 173.7331 59 I 4.4414 8.2183 119.1864 60.8986 39.1603 176.7209 60 N 5.4339 9.1969 126.0535 53.3152 39.8163 175.8353 61 S 4.4677 9.3407 120.7805 60.9743 63.2339 175.6581 62 R 3.7213 8.4191 121.1453 58.7334 30.0875 176.4229 63 Y 4.1299 7.3166 113.6900 58.6938 39.9577 177.7050 64 W 4.6209 7.7522 119.5998 58.3957 29.7613 173.7306 65 C 5.3910 7.9291 109.8086 53.5118 45.8496 172.1393 66 N 4.9293 8.9187 119.2854 52.0497 39.7711 174.6728 67 D 4.8319 8.4815 122.7282 52.1874 40.6103 177.8044 68 G 4.1251 8.4831 112.8894 46.4657 0.0000 175.1124 69 K 4.2380 8.2708 116.4839 57.4218 33.2735 176.7198 70 T 4.3452 7.5838 117.9765 61.7050 69.0980 172.9335 71 P 4.1428 0.0000 0.0000 63.2854 31.8957 175.4356 72 G 3.7072 8.6834 110.4031 45.9873 0.0000 172.5196 73 A 4.2033 7.6878 127.8632 51.3512 21.8184 175.6115 74 V 3.9315 8.2180 118.2259 61.5658 32.4416 176.3904 74A T 4.4094 8.2337 118.0683 65.5791 70.7867 173.7078 74B G 4.1126 9.4004 117.4527 43.6003 0.0000 174.6954 74C R 4.3167 8.9615 117.0703 56.3403 32.7811 170.8006 74D G 3.0042 8.7696 110.1491 45.8625 0.0000 173.0011 74E D 4.5124 8.4054 129.8206 54.7636 37.3706 176.1578 74F S 4.1556 8.0389 114.7879 57.6395 61.8163 171.4626 74G P 4.4662 0.0000 0.0000 61.9930 30.7679 175.2861 74H A 4.0557 8.4033 122.5613 52.7718 22.3428 175.4366 75 N 4.1763 8.5549 119.4365 54.5346 37.3032 175.2085 76 A 3.9702 8.2652 121.8468 55.3969 19.0737 178.5072 77 C 4.4795 8.4794 111.3260 57.3761 40.8832 173.0458 78 H 4.0994 7.9017 115.9468 56.5831 26.2315 174.4219 79 L 4.8168 7.2709 113.9079 52.8775 46.3248 176.5410 80 S 4.6117 8.3719 115.3917 58.0368 63.3256 175.9419 81 C 3.9945 8.6541 124.0874 59.9052 39.3251 176.3083 82 S 3.9466 7.7764 114.2396 61.5627 61.6047 176.1462 83 A 4.0156 7.8703 122.1777 54.6699 18.2101 178.0163 84 L 4.4137 7.9063 115.8957 55.2431 41.7908 177.6867 85 L 5.0634 7.9586 117.6923 54.5087 42.3459 176.7308 86 Q 4.3529 7.7689 117.8026 55.4610 29.4714 175.9844 87 D 4.4183 8.4898 119.5884 56.9481 41.1899 176.7722 88 N 4.5788 8.0492 118.2711 53.1988 39.3362 174.6685 89 I 4.2760 8.4541 118.6685 60.9845 38.0615 176.9693 90 A 3.9531 8.5905 125.2949 56.0207 18.1380 180.1521 91 D 4.2873 8.0707 116.3924 57.4292 40.9533 178.6217 92 A 4.1084 8.0228 120.8579 55.1005 18.3949 179.7340 93 V 3.3734 8.2121 116.8395 66.1309 31.7686 178.1298 94 A 3.8501 7.9146 120.5178 55.2130 18.1452 178.8620 95 C 4.2219 8.2364 116.7887 59.7415 39.1980 175.5693 96 A 3.9430 8.1261 122.5606 55.1126 17.6137 179.7432 97 K 3.6718 7.5827 116.0566 59.4583 32.3901 179.2107 98 R 4.0773 7.7921 118.5231 59.2380 29.9619 178.5794 99 V 2.4907 7.5536 118.0196 65.8702 31.3342 178.2336 100 V 3.8381 7.7216 110.3904 63.0602 31.2393 178.0941 101 R 4.1586 7.6642 116.9544 57.1527 30.3814 176.3696 102 D 4.7835 7.3158 119.0256 52.4326 42.2144 175.4492 103 P 4.2204 0.0000 0.0000 66.1232 31.6859 178.2893 104 Q 3.9943 8.1930 116.3864 56.7696 29.8361 177.5435 105 G 3.7984 7.9493 107.1949 46.6969 0.0000 175.3634 106 I 3.6298 7.7897 119.5430 63.3347 37.9622 178.1454 107 R 4.1436 7.3639 117.4331 58.1501 30.0274 177.5101 108 A 4.0578 7.6828 120.8838 54.0370 18.5289 177.5379 109 W 4.8065 7.9803 117.1759 55.1680 30.4046 177.7671 110 V 3.7677 8.7166 124.2191 64.8798 30.7736 178.1874 111 A 4.0312 8.2818 120.9322 54.6187 18.1220 179.2217 112 W 3.9730 8.2588 126.7970 60.6002 30.5690 178.4328 113 R 3.7089 8.1198 116.3448 59.4859 29.7296 178.4248 114 N 4.3570 7.9485 114.7496 55.3622 38.6259 176.7891 115 R 4.0616 7.7760 116.8082 55.9461 31.6872 176.1522 116 C 4.5574 7.7621 115.0261 57.4756 42.8745 174.4143 117 Q 3.3284 6.5918 119.7848 57.0205 28.7331 175.2377 118 N 4.2071 8.6716 120.8193 54.2872 36.1015 173.8473 119 R 4.5059 7.3185 115.4074 54.0385 33.0504 175.6767 120 D 4.5475 8.4473 119.1022 54.1026 40.5231 176.0513 121 V 4.5317 8.2285 119.3684 61.4709 32.4139 178.4444 122 R 4.0595 7.9901 120.7242 59.2745 29.8905 178.4553 123 Q 3.9520 8.2168 117.0398 59.9564 27.9302 178.7796 124 Y 4.3480 7.7714 116.7122 59.8369 38.2937 177.1755 125 V 4.3795 7.8710 111.1778 60.5256 32.9910 175.4774 126 Q 4.1700 7.6226 118.8959 57.4150 28.5917 176.6745 127 G 3.9084 8.8326 109.4825 46.5785 0.0000 174.6861 128 C 4.4484 8.1112 115.7220 56.3937 40.6656 173.8127 129 G 3.7820 8.0595 107.1867 47.0832 0.0000 174.1564 130 V 4.0065 7.8783 117.5695 61.1007 32.0652 176.0371 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 4.16 0.00 1.99 1.62 0.00 1.25 0.00 0.00 1.02 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.82 1.11 7.81 2 V 8.16 4.55 2.09 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 0.90 0.00 0.00 0.95 0.00 0.00 3 F 9.21 4.46 0.00 2.83 2.82 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 4 E 8.96 4.30 0.00 2.06 1.81 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 2.29 2.40 0.00 5 R 8.92 3.41 0.00 1.98 1.93 0.00 3.48 0.00 0.00 3.46 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 1.81 0.00 6 C 8.45 4.36 0.00 3.13 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 7 E 8.19 3.90 0.00 2.05 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 0.00 2.54 2.38 0.00 8 L 7.95 3.50 0.00 1.31 1.34 -0.15 0.55 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 9 A 7.65 3.94 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 10 R 8.06 3.90 0.00 1.88 1.99 0.00 3.14 0.00 0.00 3.31 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.82 0.00 11 T 7.76 3.82 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 1.20 0.00 0.00 12 L 8.44 3.86 0.00 1.57 1.59 0.96 0.78 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 13 K 8.02 3.85 0.00 1.91 1.98 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.44 1.47 7.81 14 R 7.67 3.93 0.00 2.04 2.01 0.00 3.30 0.00 0.00 3.22 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.67 0.00 15 L 7.52 4.34 0.00 1.57 1.56 0.86 0.90 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 16 G 7.86 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 17 M 7.89 3.87 0.00 1.20 1.94 0.00 0.00 0.00 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.22 0.00 18 D 7.99 4.39 0.00 2.67 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 19 G 9.44 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 8.18 4.16 0.00 3.37 3.22 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 21 R 8.98 3.62 0.00 1.90 1.86 0.00 3.29 0.00 0.00 3.08 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.83 1.40 0.00 22 G 8.21 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 0.00 0.00 0.00 23 I 7.61 4.18 1.74 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.95 0.84 -0.22 0.00 0.00 24 S 8.39 4.70 0.00 4.07 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 25 L 9.29 4.24 0.00 2.02 1.82 0.97 1.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 26 A 8.16 4.14 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 27 N 8.14 4.42 0.00 2.76 2.84 0.00 0.00 6.98 8.47 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 28 W 8.02 4.19 0.00 3.58 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 29 M 8.45 4.18 0.00 2.18 2.39 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.70 2.93 0.00 30 C 8.27 3.19 0.00 2.53 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 31 L 8.14 3.96 0.00 1.76 1.77 0.51 -0.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.00 0.00 0.00 0.00 0.00 0.00 32 A 8.19 4.23 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 33 K 8.02 2.84 0.00 1.73 1.47 0.00 0.62 0.00 0.00 0.61 0.00 0.00 2.40 0.00 0.00 2.63 0.00 0.00 0.00 0.00 0.55 1.38 7.81 34 W 7.65 4.22 0.00 3.35 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 35 E 8.41 4.31 0.00 2.03 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.54 2.40 0.00 36 S 8.05 4.53 0.00 4.07 4.15 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 0.00 0.00 0.00 0.00 37 G 7.86 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 0.00 0.00 0.00 38 Y 7.65 3.64 0.00 3.23 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.61 5.34 0.00 2.89 2.79 0.00 0.00 7.01 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 8.87 3.98 4.43 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 1.45 0.00 0.00 41 R 8.12 4.50 0.00 1.99 2.09 0.00 3.08 0.00 0.00 3.24 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 1.58 0.00 42 A 7.69 4.35 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 43 T 8.29 5.06 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 1.23 0.00 0.00 44 N 8.79 4.88 0.00 2.85 2.80 0.00 0.00 6.91 6.99 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 45 Y 8.77 4.74 0.00 3.07 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 8.76 4.71 0.00 2.67 2.61 0.00 0.00 6.62 8.02 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 47 A 8.35 3.67 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 8.10 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 49 D 7.39 4.70 0.00 2.70 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 50 R 8.21 3.95 0.00 2.04 2.20 0.00 3.13 0.00 0.00 3.19 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.54 0.00 51 S 7.81 4.92 0.00 4.00 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 52 T 8.76 5.10 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 0.53 0.00 0.00 53 D 8.92 5.37 0.00 2.70 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 54 Y 9.39 5.07 0.00 3.01 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 55 G 9.32 4.36 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 0.00 56 I 8.17 4.00 1.68 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.85 2.20 0.13 0.00 0.00 57 F 7.96 4.86 0.00 3.22 2.92 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 0.00 58 Q 7.81 3.51 0.00 2.51 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.81 6.81 0.00 0.00 0.00 0.00 0.00 2.56 2.73 0.00 59 I 8.22 4.44 2.15 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 1.46 1.04 1.12 0.00 0.00 60 N 9.20 5.43 0.00 3.12 3.07 0.00 0.00 6.97 7.84 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 61 S 9.34 4.47 0.00 4.13 4.40 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 62 R 8.42 3.72 0.00 1.49 0.92 0.00 2.90 0.00 0.00 3.01 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.17 0.00 63 Y 7.32 4.13 0.00 1.43 1.72 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 64 W 7.75 4.62 0.00 3.62 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 7.93 5.39 0.00 3.12 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 66 N 8.92 4.93 0.00 2.78 2.69 0.00 0.00 7.12 9.15 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 67 D 8.48 4.83 0.00 2.89 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 68 G 8.48 4.13 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 0.00 0.00 0.00 69 K 8.27 4.24 0.00 1.89 1.97 0.00 1.65 0.00 0.00 1.73 0.00 0.00 3.16 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.61 1.50 7.81 70 T 7.58 4.35 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 1.20 0.00 0.00 71 P 0.00 4.14 0.00 2.16 2.06 0.00 3.76 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.98 1.98 0.00 72 G 8.68 3.71 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 0.00 0.00 0.00 73 A 7.69 4.20 1.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74 V 8.22 3.93 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 0.75 0.00 0.00 0.92 0.00 0.00 74A T 8.23 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 1.20 0.00 0.00 74B G 9.40 4.11 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 0.00 0.00 0.00 74C R 8.96 4.32 0.00 1.78 1.80 0.00 3.23 0.00 0.00 3.23 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 1.39 0.00 74D G 8.77 3.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 74E D 8.41 4.51 0.00 2.84 2.92 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 0.00 74F S 8.04 4.16 0.00 3.96 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 74G P 0.00 4.47 0.00 2.15 2.09 0.00 3.77 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 1.91 1.92 0.00 74H A 8.40 4.06 1.15 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 0.00 0.00 0.00 0.00 0.00 0.00 75 N 8.55 4.18 0.00 2.85 2.77 0.00 0.00 7.08 7.75 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 76 A 8.27 3.97 1.27 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 0.00 0.00 77 C 8.48 4.48 0.00 3.28 3.22 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 78 H 7.90 4.10 0.00 3.38 3.40 0.00 5.63 0.00 0.00 0.00 0.00 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 79 L 7.27 4.82 0.00 1.66 1.49 1.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 80 S 8.37 4.61 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 2.19 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 82 S 7.78 3.95 0.00 3.87 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 83 A 7.87 4.02 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 7.91 4.41 0.00 1.94 1.82 1.13 0.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.00 0.00 0.00 0.00 0.00 0.00 85 L 7.96 5.06 0.00 1.74 1.72 1.12 1.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.00 0.00 0.00 0.00 0.00 0.00 86 Q 7.77 4.35 0.00 2.23 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.61 7.11 0.00 0.00 0.00 0.00 0.00 2.37 2.55 0.00 87 D 8.49 4.42 0.00 2.62 2.66 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 88 N 8.05 4.58 0.00 2.70 2.75 0.00 0.00 6.94 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 8.45 4.28 1.81 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 0.96 0.98 0.00 0.00 90 A 8.59 3.95 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 91 D 8.07 4.29 0.00 2.72 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 8.02 4.11 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 93 V 8.21 3.37 2.22 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 0.75 0.00 0.00 0.89 0.00 0.00 94 A 7.91 3.85 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 95 C 8.24 4.22 0.00 3.16 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 96 A 8.13 3.94 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.58 3.67 0.00 1.57 1.27 0.00 1.31 0.00 0.00 0.95 0.00 0.00 2.30 0.00 0.00 2.54 0.00 0.00 0.00 0.00 0.30 0.89 7.81 98 R 7.79 4.08 0.00 2.00 2.14 0.00 3.27 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.84 1.91 0.00 99 V 7.55 2.49 0.82 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 -0.30 0.00 0.00 -0.37 0.00 0.00 100 V 7.72 3.84 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 0.94 0.00 0.00 1.43 0.00 0.00 101 R 7.66 4.16 0.00 2.06 2.05 0.00 3.23 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 2.13 0.00 102 D 7.32 4.78 0.00 3.02 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 0.00 103 P 0.00 4.22 0.00 2.01 2.12 0.00 3.68 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 2.02 2.13 0.00 104 Q 8.19 3.99 0.00 2.02 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.88 0.00 0.00 0.00 0.00 0.00 2.41 2.31 0.00 105 G 7.95 3.80 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 0.00 0.00 0.00 106 I 7.79 3.63 1.07 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 -0.08 -0.50 0.00 0.00 107 R 7.36 4.14 0.00 2.06 2.02 0.00 3.23 0.00 0.00 3.28 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.91 1.57 0.00 108 A 7.68 4.06 0.80 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 0.00 0.00 109 W 7.98 4.81 0.00 3.50 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 0.00 110 V 8.72 3.77 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 0.91 0.00 0.00 0.97 0.00 0.00 111 A 8.28 4.03 1.50 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 W 8.26 3.97 0.00 3.42 3.49 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 0.00 113 R 8.12 3.71 0.00 2.10 1.97 0.00 3.34 0.00 0.00 3.30 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 2.04 0.00 114 N 7.95 4.36 0.00 2.53 2.70 0.00 0.00 6.98 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 0.00 115 R 7.78 4.06 0.00 1.18 0.66 0.00 2.21 0.00 0.00 2.34 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.03 0.00 116 C 7.76 4.56 0.00 1.69 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 0.00 117 Q 6.59 3.33 0.00 0.93 1.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.51 6.83 0.00 0.00 0.00 0.00 0.00 2.13 2.23 0.00 118 N 8.67 4.21 0.00 2.80 2.83 0.00 0.00 6.90 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 7.32 4.51 0.00 1.77 1.80 0.00 3.25 0.00 0.00 3.07 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.48 0.00 120 D 8.45 4.55 0.00 2.62 2.62 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 0.00 121 V 8.23 4.53 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 0.92 0.00 0.00 1.04 0.00 0.00 122 R 7.99 4.06 0.00 1.92 2.02 0.00 3.17 0.00 0.00 3.25 7.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.80 0.00 123 Q 8.22 3.95 0.00 2.05 2.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.90 0.00 0.00 0.00 0.00 0.00 2.00 1.38 0.00 124 Y 7.77 4.35 0.00 3.09 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 7.87 4.38 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 0.98 0.00 0.00 1.07 0.00 0.00 126 Q 7.62 4.17 0.00 2.28 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.37 0.00 0.00 0.00 0.00 0.00 2.51 2.31 0.00 127 G 8.83 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 0.00 0.00 0.00 128 C 8.11 4.45 0.00 3.09 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 3.78 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 0.00 0.00 0.00 130 V 7.88 4.01 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 0.76 0.00 0.00 0.96 0.00 0.00