NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 A 4.4176 8.1233 123.5961 52.3928 20.4594 178.3059 3 S 3.9182 7.6421 111.8035 61.3504 62.5755 174.9228 4 K 4.0229 8.1155 120.8614 59.5599 32.3482 179.0348 5 R 3.8776 7.9140 118.3863 59.5068 30.1234 178.3388 6 I 3.5037 8.4097 120.2457 64.7800 37.1428 177.7035 7 H 4.1617 8.6220 117.1070 59.2389 28.6300 177.4505 8 K 3.9180 8.5241 121.1803 59.7678 31.8653 178.4745 9 E 4.1244 8.4638 118.3221 58.6916 29.7693 178.2395 10 L 4.3417 8.1707 120.9158 58.2586 42.0031 178.4936 11 N 4.3722 8.3029 116.4539 56.3659 37.9838 177.1066 12 D 4.4518 8.2903 120.0440 56.7782 40.5890 178.9219 13 L 4.0954 7.8882 119.9351 57.2793 41.9202 178.3125 14 A 4.3857 7.5102 120.3184 52.5953 18.7551 178.1037 15 R 4.4720 7.8768 119.7768 58.6864 33.3560 175.4432 16 D 4.7247 7.8196 114.2628 51.8666 42.6918 172.7442 17 P 4.2865 0.0000 0.0000 60.9972 31.9550 174.7662 18 P 4.1540 0.0000 0.0000 62.7192 31.1666 175.6383 19 A 3.9846 8.5180 126.0244 54.0605 18.7561 177.3221 20 Q 4.0140 10.3536 119.4106 56.0141 26.5152 172.3633 21 C 5.1747 7.6500 111.3468 57.7165 33.4491 173.9021 22 S 4.5059 8.7884 113.2177 57.7729 65.1086 172.9929 23 A 5.3264 8.4044 129.0850 50.4907 21.8602 175.4699 24 G 3.6715 8.2376 103.2656 44.3538 0.0000 171.3479 25 P 4.6261 0.0000 0.0000 62.4993 31.9054 175.5378 26 V 4.0679 8.1170 122.3268 62.3649 33.0803 176.6642 27 G 3.8796 8.8696 113.7668 45.2132 0.0000 172.5806 28 D 4.7633 8.3196 117.5817 54.0622 42.7561 176.1087 29 D 4.4518 8.0861 119.4443 54.8211 41.5819 175.3932 30 M 4.4958 8.5139 124.4995 55.4748 32.3947 176.1714 31 F 4.9369 9.4225 117.7123 57.4831 41.1985 174.6185 32 H 5.2041 8.4548 116.2601 54.1781 31.9879 172.4884 33 W 5.1818 9.5640 123.9337 54.8292 33.0722 175.0545 34 Q 5.0630 9.0632 118.0293 54.7503 31.3509 174.0538 35 A 5.4590 8.9648 124.1760 50.2568 23.0105 174.7203 36 T 5.3455 8.6295 108.8718 60.2170 72.5248 173.4698 37 I 5.0445 8.8255 123.4657 60.3681 41.6292 173.9871 38 M 4.7331 9.1270 128.2153 54.1608 32.7831 176.1920 39 G 4.7786 8.4862 109.8114 45.5683 0.0000 171.4428 40 P 4.5018 0.0000 0.0000 62.6184 31.8589 175.9167 41 N 4.4994 8.6880 119.0516 54.7845 39.5156 174.2767 42 D 5.0316 8.9378 121.0645 55.3621 38.9558 173.5921 43 S 4.8728 7.2802 111.2747 55.2933 65.5293 173.0778 44 P 4.1855 0.0000 0.0000 66.0429 31.1585 177.2251 45 Y 5.0451 7.1226 113.8676 57.4760 37.6266 175.1135 46 Q 4.3703 7.8480 121.6718 57.5982 29.7793 175.8360 47 G 4.3409 9.1698 115.5934 45.8271 0.0000 174.2715 48 G 3.8270 7.6302 106.3512 45.5152 0.0000 172.0317 49 V 4.8051 7.5868 117.6094 61.0890 35.4724 174.1813 50 F 4.6633 9.1636 124.2237 55.7053 42.7059 174.1559 51 F 5.5505 9.1462 122.1997 56.6226 41.3689 174.8143 52 L 5.1797 9.4304 120.7282 53.6688 47.2720 175.4259 53 T 4.8662 8.9636 116.5383 62.2281 71.3942 173.9790 54 I 4.0297 8.4809 129.4260 60.0992 38.5124 174.5886 55 H 5.2057 8.7776 129.1319 54.4142 31.3301 173.4825 56 F 4.5965 8.9942 126.4629 55.9149 39.6389 174.5855 57 P 4.5241 0.0000 0.0000 61.8297 32.3683 177.2361 58 T 3.6035 8.1896 109.1646 64.2545 68.6913 174.6251 59 D 4.7760 8.0026 120.8373 54.6106 41.4393 175.4918 60 Y 4.6097 8.0598 122.0293 57.4511 38.8839 173.6321 61 P 4.1144 0.0000 0.0000 62.4489 31.5850 177.3661 62 F 4.4601 7.9986 119.9398 59.5256 39.1406 175.8463 63 K 4.7976 7.8990 119.1581 53.3406 34.6358 174.2090 64 P 2.9700 0.0000 0.0000 61.2875 31.7830 174.2282 65 P 4.1817 0.0000 0.0000 62.4513 32.6526 175.5992 66 K 4.2133 8.2991 121.1841 55.3318 33.3601 175.7946 67 V 4.7917 8.2087 124.9484 60.9348 33.7790 174.4709 68 A 4.9963 8.5070 127.8102 50.1870 23.1807 175.1758 69 F 4.2149 10.0073 120.0972 58.0387 39.9005 176.2531 70 T 4.3568 8.7617 118.3718 65.5233 70.3922 175.5863 71 T 4.2439 8.0228 116.9627 62.8437 69.1324 175.4774 72 R 4.0360 8.4451 124.9640 56.7625 30.7167 175.9286 73 I 4.6148 8.1077 117.8906 60.5705 40.6442 173.8872 74 Y 3.8306 8.7121 129.1041 56.2225 37.8541 173.6518 75 H 5.0037 7.6268 124.8578 53.3600 33.6069 172.5436 76 P 4.2324 0.0000 0.0000 64.9298 31.5845 177.7438 77 N 4.8825 8.4305 113.3240 52.5751 39.0118 173.5772 78 I 5.2794 7.3840 117.9175 58.3626 40.1352 175.2561 79 N 4.7650 8.3434 123.6960 51.2336 39.4550 175.5016 80 S 4.2627 8.5507 111.7588 60.7888 62.9492 174.5591 81 N 4.5064 8.9688 118.0237 53.5139 38.9209 176.0461 82 G 4.4903 8.5173 106.7833 46.8713 0.0000 173.3650 83 S 4.4310 8.0639 115.6025 58.1149 63.5060 172.9672 84 I 4.6708 8.1503 124.7761 59.7012 39.1036 175.6944 85 S 4.4779 8.6559 123.5458 57.0636 62.0410 172.2044 86 L 4.7939 8.0198 127.7368 52.7371 44.8964 176.4480 87 D 4.4350 9.0996 126.1377 56.4728 39.4237 178.4574 88 I 3.8636 7.7146 111.3029 62.6050 37.9170 176.7735 89 L 4.1390 7.7774 120.6321 56.2559 41.8106 176.7070 90 R 4.4237 7.3535 113.5228 57.0557 33.0411 176.9384 91 S 4.3109 8.7166 118.2276 62.0077 63.7519 175.6664 92 Q 4.5987 8.1553 117.2475 55.3904 28.7699 175.6304 93 W 4.5868 8.1482 127.6810 57.2299 31.6931 175.2066 94 S 4.2818 6.9583 118.0032 55.1830 64.7066 173.0022 95 P 4.0253 0.0000 0.0000 64.2410 31.0669 177.0974 96 A 4.0380 7.1373 121.0865 53.7748 18.9124 178.0367 97 L 4.0413 6.9341 116.0958 54.5704 42.3658 176.6689 98 K 5.1362 8.2892 120.3791 54.7836 35.5776 176.7973 99 I 3.7757 9.8689 123.8002 65.1337 37.0069 178.7191 100 S 4.1713 8.3907 114.0591 61.4507 62.5143 176.2083 101 K 4.1652 8.6923 123.3117 58.9465 31.8248 178.8677 102 V 3.7902 7.7228 117.3324 65.3539 31.7859 177.8064 103 L 4.1615 8.2591 119.3633 57.8507 41.6404 179.2119 104 L 4.0561 7.5817 117.4589 58.0488 41.4969 179.7262 105 S 4.2164 8.1167 114.8803 61.8026 62.6104 176.9188 106 I 3.9026 7.8077 122.5011 64.3943 36.7532 178.2000 107 C 4.3052 8.0210 117.2117 62.6108 27.8663 176.2403 108 S 4.1392 8.2095 116.9819 61.6567 62.3825 176.3800 109 L 3.9469 7.7782 122.4739 57.9146 41.3918 178.7887 110 L 4.1633 7.4849 119.8804 58.3149 42.2389 178.3341 111 C 4.5139 7.9571 113.5711 60.0621 31.0642 173.7320 112 D 4.8612 7.9645 121.8427 50.6185 39.8080 173.6279 113 P 4.4971 0.0000 0.0000 61.8964 32.4149 176.3716 114 N 4.8652 8.4325 116.7579 50.8158 38.2151 172.8775 115 P 4.2766 0.0000 0.0000 64.0317 31.7860 177.5406 116 D 4.7375 7.8431 117.4191 54.7726 42.3058 175.7414 117 D 4.8796 7.5395 118.5808 52.4599 41.4122 173.3646 118 P 4.4480 0.0000 0.0000 62.7521 32.5647 176.1263 119 L 4.4704 8.2922 119.2284 55.0794 44.4021 176.2214 120 V 4.2030 7.6191 119.0004 59.1567 31.6057 173.5124 121 P 4.1978 0.0000 0.0000 65.8897 30.9128 177.5716 122 E 3.9367 8.2653 118.3791 59.1064 29.3244 179.5547 123 I 3.6693 7.6227 118.3563 64.3160 37.1774 177.7789 124 A 3.8957 7.6726 121.2697 55.5001 18.0959 179.3401 125 R 3.8409 8.1045 116.4855 60.0135 29.6712 178.6374 126 I 3.8861 7.9093 119.2995 64.6689 36.8543 177.6549 127 Y 4.0262 8.2312 119.9225 59.9076 38.6430 177.4833 128 K 4.1087 8.0950 119.3343 59.6710 32.4497 179.1107 129 T 4.0698 8.1811 109.2353 63.5222 70.7034 175.1558 130 D 4.6678 7.5434 123.1007 51.5851 40.2150 176.5110 131 R 3.6872 7.8562 124.1542 59.5149 30.6156 177.3041 132 E 3.9906 8.0901 117.6623 58.9451 29.4430 179.0000 133 K 3.8349 8.0271 119.3853 59.6819 32.2303 177.5471 134 Y 4.0470 7.7633 119.2638 61.1728 38.6728 178.0064 135 N 4.2452 8.3958 116.9678 56.3857 38.4165 176.9765 136 R 3.8073 7.6434 118.8052 59.8507 30.4300 178.1453 137 I 3.5149 7.6482 118.8188 64.1767 37.0473 177.9605 138 A 3.7929 7.4449 121.4628 55.6116 17.9185 179.6884 139 R 4.1680 7.5903 116.8271 59.0206 30.4247 178.3463 140 E 4.1603 8.6191 118.9075 59.1741 29.4937 179.2451 141 W 4.1833 8.3744 118.5508 60.0797 29.0936 178.5754 142 T 4.0830 8.3290 115.8932 66.6450 67.6604 176.6842 143 Q 4.1160 7.8008 118.6133 57.7341 28.7509 177.8577 144 K 3.9092 7.5002 119.4312 58.4700 32.8188 177.1524 145 Y 4.6217 7.4784 113.3668 58.1386 39.0735 176.6157 146 A 4.0285 7.6549 121.5667 52.8080 19.7374 177.2502 147 M 4.1260 7.7534 118.9581 55.6063 32.1999 176.0125 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 2 A 8.12 4.42 1.62 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 3 S 7.64 3.92 0.00 3.93 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 4 K 8.12 4.02 0.00 1.80 1.88 0.00 1.68 0.00 0.00 1.76 0.00 0.00 2.92 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.54 1.51 7.81 5 R 7.91 3.88 0.00 1.91 2.07 0.00 3.27 0.00 0.00 3.29 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 2.01 0.00 6 I 8.41 3.50 1.81 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.45 0.86 0.00 0.00 7 H 8.62 4.16 0.00 3.16 3.35 0.00 5.65 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 8 K 8.52 3.92 0.00 1.93 1.88 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.63 1.48 7.81 9 E 8.46 4.12 0.00 2.23 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 0.00 2.50 2.45 0.00 10 L 8.17 4.34 0.00 2.17 1.92 0.24 0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.30 4.37 0.00 2.81 2.85 0.00 0.00 7.06 7.41 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 12 D 8.29 4.45 0.00 2.94 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 13 L 7.89 4.10 0.00 2.00 1.76 1.21 0.92 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 14 A 7.51 4.39 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 15 R 7.88 4.47 0.00 1.88 1.91 0.00 3.30 0.00 0.00 3.42 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 16 D 7.82 4.72 0.00 2.73 2.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 P 0.00 4.29 0.00 2.05 2.09 0.00 3.77 0.00 0.00 2.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 2.24 0.00 18 P 0.00 4.15 0.00 2.27 2.30 0.00 3.77 0.00 0.00 3.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.07 0.00 19 A 8.52 3.98 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 20 Q 10.35 4.01 0.00 2.36 2.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.63 0.00 0.00 0.00 0.00 0.00 2.37 2.34 0.00 21 C 7.65 5.17 0.00 3.10 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 22 S 8.79 4.51 0.00 3.91 3.75 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 A 8.40 5.33 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 0.00 0.00 24 G 8.24 3.67 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 0.00 0.00 0.00 25 P 0.00 4.63 0.00 1.81 1.21 0.00 2.90 0.00 0.00 2.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.32 0.00 26 V 8.12 4.07 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 0.73 0.00 0.00 0.93 0.00 0.00 27 G 8.87 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 28 D 8.32 4.76 0.00 2.65 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 29 D 8.09 4.45 0.00 2.73 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 30 M 8.51 4.50 0.00 1.69 1.68 0.00 0.00 0.00 0.00 0.00 2.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.56 2.43 0.00 31 F 9.42 4.94 0.00 3.02 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 32 H 8.45 5.20 0.00 3.15 3.24 0.00 5.57 0.00 0.00 0.00 0.00 6.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 33 W 9.56 5.18 0.00 3.38 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 34 Q 9.06 5.06 0.00 2.17 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 6.67 0.00 0.00 0.00 0.00 0.00 2.20 2.27 0.00 35 A 8.96 5.46 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 36 T 8.63 5.35 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 1.42 0.00 0.00 37 I 8.83 5.04 2.01 0.00 0.00 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 1.27 0.68 1.03 0.00 0.00 38 M 9.13 4.73 0.00 2.01 2.11 0.00 0.00 0.00 0.00 0.00 2.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.84 2.59 0.00 39 G 8.49 4.78 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 40 P 0.00 4.50 0.00 2.17 2.12 0.00 3.92 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.32 2.22 0.00 41 N 8.69 4.50 0.00 2.81 2.72 0.00 0.00 7.15 8.49 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 42 D 8.94 5.03 0.00 2.85 2.72 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 43 S 7.28 4.87 0.00 3.76 3.97 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 44 P 0.00 4.19 0.00 1.93 2.37 0.00 3.48 0.00 0.00 3.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 2.01 0.00 45 Y 7.12 5.05 0.00 3.30 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 46 Q 7.85 4.37 0.00 2.35 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.66 0.00 0.00 0.00 0.00 0.00 2.43 2.38 0.00 47 G 9.17 4.34 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 0.00 48 G 7.63 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 49 V 7.59 4.81 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.96 0.00 0.00 50 F 9.16 4.66 0.00 3.18 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 51 F 9.15 5.55 0.00 2.99 2.85 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 52 L 9.43 5.18 0.00 1.39 1.39 0.81 -0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.45 0.00 0.00 0.00 0.00 0.00 0.00 53 T 8.96 4.87 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 1.23 0.00 0.00 54 I 8.48 4.03 1.82 0.00 0.00 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.71 -0.03 0.00 0.00 55 H 8.78 5.21 0.00 3.19 3.18 0.00 5.59 0.00 0.00 0.00 0.00 6.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 56 F 8.99 4.60 0.00 2.94 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 57 P 0.00 4.52 0.00 2.19 2.06 0.00 3.71 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.04 0.00 58 T 8.19 3.60 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 0.94 0.00 0.00 59 D 8.00 4.78 0.00 2.84 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 60 Y 8.06 4.61 0.00 3.10 3.05 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 0.00 0.00 0.00 0.00 61 P 0.00 4.11 0.00 1.75 1.16 0.00 3.02 0.00 0.00 3.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 1.48 0.00 62 F 8.00 4.46 0.00 3.22 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 63 K 7.90 4.80 0.00 1.77 1.68 0.00 1.84 0.00 0.00 1.81 0.00 0.00 3.04 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.46 1.39 7.81 64 P 0.00 2.97 0.00 1.65 1.18 0.00 3.68 0.00 0.00 3.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.83 0.00 65 P 0.00 4.18 0.00 1.27 1.22 0.00 2.20 0.00 0.00 2.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 1.51 0.00 66 K 8.30 4.21 0.00 1.58 1.66 0.00 1.50 0.00 0.00 1.48 0.00 0.00 2.66 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.22 1.17 7.81 67 V 8.21 4.79 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 0.69 0.00 0.00 0.69 0.00 0.00 68 A 8.51 5.00 1.25 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 0.00 0.00 69 F 10.01 4.21 0.00 2.89 3.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 70 T 8.76 4.36 4.48 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 1.39 0.00 0.00 71 T 8.02 4.24 4.50 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 1.08 0.00 0.00 72 R 8.45 4.04 0.00 0.78 1.26 0.00 3.23 0.00 0.00 2.88 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.50 0.00 73 I 8.11 4.61 1.82 0.00 0.00 -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 0.78 0.16 0.46 0.00 0.00 74 Y 8.71 3.83 0.00 1.43 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 0.00 0.00 0.00 0.00 75 H 7.63 5.00 0.00 2.94 2.77 0.00 5.73 0.00 0.00 0.00 0.00 6.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 76 P 0.00 4.23 0.00 1.98 1.88 0.00 3.04 0.00 0.00 3.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 2.02 0.00 77 N 8.43 4.88 0.00 2.67 2.71 0.00 0.00 6.92 7.48 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 78 I 7.38 5.28 1.49 0.00 0.00 -0.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 0.46 0.57 0.00 0.00 79 N 8.34 4.76 0.00 2.92 2.94 0.00 0.00 5.99 7.64 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 80 S 8.55 4.26 0.00 4.00 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 0.00 81 N 8.97 4.51 0.00 2.91 2.91 0.00 0.00 7.10 7.64 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 82 G 8.52 4.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 83 S 8.06 4.43 0.00 3.89 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 84 I 8.15 4.67 1.89 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.82 0.93 0.00 0.00 85 S 8.66 4.48 0.00 3.86 3.77 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 0.00 0.00 0.00 0.00 86 L 8.02 4.79 0.00 1.75 1.44 0.93 1.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 87 D 9.10 4.44 0.00 2.89 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 I 7.71 3.86 2.08 0.00 0.00 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.71 0.98 0.00 0.00 89 L 7.78 4.14 0.00 1.87 1.68 0.89 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 90 R 7.35 4.42 0.00 1.76 1.72 0.00 3.20 0.00 0.00 3.21 7.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.57 0.00 91 S 8.72 4.31 0.00 3.89 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 92 Q 8.16 4.60 0.00 2.07 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.87 0.00 0.00 0.00 0.00 0.00 2.35 2.44 0.00 93 W 8.15 4.59 0.00 3.59 2.99 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 94 S 6.96 4.28 0.00 3.59 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 95 P 0.00 4.03 0.00 1.96 2.04 0.00 3.14 0.00 0.00 3.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.79 1.84 0.00 96 A 7.14 4.04 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 97 L 6.93 4.04 0.00 0.85 1.58 0.93 0.61 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 98 K 8.29 5.14 0.00 2.04 1.95 0.00 1.54 0.00 0.00 1.84 0.00 0.00 2.93 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.42 1.47 7.81 99 I 9.87 3.78 2.05 0.00 0.00 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.97 1.06 0.00 0.00 100 S 8.39 4.17 0.00 4.11 4.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 101 K 8.69 4.17 0.00 1.85 2.14 0.00 1.65 0.00 0.00 1.59 0.00 0.00 2.93 0.00 0.00 3.11 0.00 0.00 0.00 0.00 1.48 1.48 7.81 102 V 7.72 3.79 2.23 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 0.96 0.00 0.00 1.17 0.00 0.00 103 L 8.26 4.16 0.00 1.79 1.75 1.02 0.89 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 0.00 104 L 7.58 4.06 0.00 1.78 1.77 0.96 0.94 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 0.00 105 S 8.12 4.22 0.00 4.12 3.97 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 0.00 106 I 7.81 3.90 2.11 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 1.57 1.83 1.08 0.00 0.00 107 C 8.02 4.31 0.00 3.15 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 0.00 108 S 8.21 4.14 0.00 4.11 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 0.00 109 L 7.78 3.95 0.00 1.75 1.87 0.97 0.94 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 0.00 110 L 7.48 4.16 0.00 1.94 1.87 0.52 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.00 0.00 0.00 0.00 0.00 0.00 111 C 7.96 4.51 0.00 3.18 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 0.00 112 D 7.96 4.86 0.00 2.68 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 0.00 113 P 0.00 4.50 0.00 1.12 1.49 0.00 3.71 0.00 0.00 4.45 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 2.12 0.00 114 N 8.43 4.87 0.00 2.65 2.58 0.00 0.00 7.38 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 0.00 115 P 0.00 4.28 0.00 2.25 1.94 0.00 3.75 0.00 0.00 3.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.01 2.22 0.00 116 D 7.84 4.74 0.00 2.66 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 0.00 117 D 7.54 4.88 0.00 2.52 2.55 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 0.00 118 P 0.00 4.45 0.00 2.12 2.00 0.00 3.68 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 1.96 1.92 0.00 119 L 8.29 4.47 0.00 1.51 1.61 0.89 0.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.62 4.20 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 0.86 0.00 0.00 0.88 0.00 0.00 121 P 0.00 4.20 0.00 2.28 2.30 0.00 3.75 0.00 0.00 3.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.07 2.08 0.00 122 E 8.27 3.94 0.00 2.00 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 0.00 2.43 2.44 0.00 123 I 7.62 3.67 1.76 0.00 0.00 -0.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.54 0.25 0.82 0.00 0.00 124 A 7.67 3.90 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 0.00 125 R 8.10 3.84 0.00 1.91 2.15 0.00 3.13 0.00 0.00 3.18 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.71 0.00 126 I 7.91 3.89 2.17 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 1.52 0.88 1.14 0.00 0.00 127 Y 8.23 4.03 0.00 2.75 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 0.00 128 K 8.10 4.11 0.00 1.94 1.86 0.00 1.93 0.00 0.00 1.78 0.00 0.00 3.09 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.57 1.78 7.81 129 T 8.18 4.07 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 1.25 0.00 0.00 130 D 7.54 4.67 0.00 2.74 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 0.00 131 R 7.86 3.69 0.00 1.65 1.77 0.00 2.97 0.00 0.00 2.97 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.66 0.00 132 E 8.09 3.99 0.00 2.03 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 2.36 2.32 0.00 133 K 8.03 3.83 0.00 2.03 2.10 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.53 1.54 7.81 134 Y 7.76 4.05 0.00 3.14 3.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 135 N 8.40 4.25 0.00 2.96 2.85 0.00 0.00 6.74 7.82 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 0.00 136 R 7.64 3.81 0.00 1.77 2.14 0.00 3.25 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.60 0.00 137 I 7.65 3.51 1.09 0.00 0.00 0.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.10 -0.68 0.00 0.00 138 A 7.44 3.79 1.06 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 0.00 0.00 139 R 7.59 4.17 0.00 1.95 2.19 0.00 3.09 0.00 0.00 3.07 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.55 0.00 140 E 8.62 4.16 0.00 2.26 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 2.33 2.49 0.00 141 W 8.37 4.18 0.00 3.61 3.60 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 0.00 142 T 8.33 4.08 4.49 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 1.41 0.00 0.00 143 Q 7.80 4.12 0.00 2.21 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.05 6.84 0.00 0.00 0.00 0.00 0.00 2.67 2.50 0.00 144 K 7.50 3.91 0.00 1.28 0.90 0.00 1.40 0.00 0.00 1.06 0.00 0.00 2.84 0.00 0.00 2.86 0.00 0.00 0.00 0.00 0.30 1.04 7.81 145 Y 7.48 4.62 0.00 2.96 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 0.00 146 A 7.65 4.03 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 0.00 147 M 7.75 4.13 0.00 1.98 1.93 0.00 0.00 0.00 0.00 0.00 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.76 2.48 0.00