NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 S 4.4764 8.1933 116.7957 58.2081 64.2039 174.0614 2 N 4.1076 8.5245 117.2918 55.0294 37.1425 175.4697 3 I 4.3183 7.5879 118.0902 61.4661 39.8227 176.3708 4 I 4.2375 7.3619 113.1394 60.8062 37.5466 176.7502 5 K 4.3465 7.6676 122.9174 58.5972 32.9314 178.1458 6 Q 3.9514 7.6126 116.6004 59.3564 28.3369 178.2760 7 L 3.9286 7.1108 120.7798 57.5089 42.3839 178.3527 8 E 4.0345 7.6058 119.5231 59.5010 29.5558 178.4902 9 Q 3.9945 8.3445 118.4764 59.2262 28.5757 178.7638 10 E 4.0530 8.0694 118.7966 58.3055 29.6835 177.0642 11 Q 4.5070 7.8364 114.2634 55.6096 30.8320 175.1261 12 M 4.2304 7.5991 119.4197 54.8797 32.1609 176.1704 13 K 4.3814 8.4215 120.2097 57.3987 35.0271 174.8455 14 Q 4.4959 8.1912 118.6464 54.9360 30.1868 174.7847 15 D 4.8209 8.4343 119.8381 52.7822 43.4061 175.5318 16 V 4.5997 8.0428 115.9881 59.1014 36.1119 173.2990 17 P 4.5883 0.0000 0.0000 61.8174 33.1377 174.9389 18 S 4.8127 8.2390 112.9699 57.0805 64.1822 173.9909 19 F 4.6874 9.0509 125.6713 55.7697 40.7755 174.6179 20 R 4.4599 8.6574 126.7444 53.5426 30.5551 173.5362 21 P 4.4382 0.0000 0.0000 63.3869 31.6128 176.4819 22 G 3.9494 8.5763 107.6362 45.9570 0.0000 172.6381 23 D 5.0245 8.0841 118.7536 53.3204 42.5773 177.4900 24 T 4.0915 8.6722 119.7004 64.1901 69.8386 175.0900 25 V 4.1395 7.5719 117.2486 60.0287 31.6860 171.4075 26 E 4.5672 7.9769 121.0664 54.9482 31.8626 173.8332 27 V 3.7736 8.4780 127.9994 62.1447 31.9049 174.8470 28 K 4.8694 8.5389 126.8052 54.8853 34.5640 175.3996 29 V 4.9014 8.2509 118.5220 57.7744 35.2439 175.3919 30 W 4.7929 8.8667 124.8821 57.5979 28.7628 176.5527 31 V 3.6727 8.5845 126.1057 65.2661 31.5929 176.9514 32 V 3.6886 7.6021 114.9649 62.5300 29.1801 171.9269 33 E 4.0443 8.1649 121.9080 59.1613 29.9512 179.4101 34 G 4.1539 7.5929 106.7728 44.4803 0.0000 172.6789 35 S 4.3187 8.5157 110.5430 58.3657 60.3943 169.3151 36 K 4.3670 7.9754 119.2119 55.7011 32.8460 177.5307 37 K 4.5626 8.3223 122.7449 55.9575 32.6796 176.8535 38 R 4.2514 7.9670 115.2691 56.7608 30.6894 175.1949 39 L 5.6629 8.3462 119.4051 52.2114 44.9692 175.4374 40 Q 4.5828 8.7186 125.2044 54.2985 31.0101 174.4292 41 A 4.5709 8.3171 127.8900 51.4107 19.6983 177.9835 42 F 4.7977 8.2303 118.3788 55.7061 40.8348 172.4384 43 E 4.7998 7.7559 117.9260 56.3547 29.9275 177.5199 44 G 4.3134 8.6385 113.4266 44.4407 0.0000 172.3578 45 V 4.4930 8.4134 122.5257 60.8468 34.5874 176.3996 46 V 4.5603 8.4274 128.6801 63.5725 32.2306 174.9179 47 I 4.5762 8.6225 126.0467 62.5028 43.6724 175.2412 48 A 4.0484 7.8197 123.4558 51.8859 19.7690 175.6697 49 I 3.8402 8.1042 120.5640 60.6983 39.3130 175.9523 50 R 3.9781 8.1509 125.9369 56.0148 31.4136 176.4523 51 N 4.4385 8.7070 115.7963 53.2911 37.4032 174.5374 52 R 3.9468 8.6361 115.1991 58.0098 27.6456 178.5142 53 G 3.5824 7.4310 107.4108 48.0663 0.0000 176.7325 54 L 3.4204 8.1746 121.4778 58.0675 42.9708 176.7208 55 H 4.4014 7.4931 116.2329 55.7776 29.0540 175.1095 56 S 4.8682 8.4865 118.8256 57.0922 67.1008 172.5453 57 A 5.2320 7.6268 122.2125 51.2600 21.9291 175.1409 58 F 4.6623 8.3722 116.4687 57.1365 45.8334 174.8564 59 T 3.8561 7.8424 110.0062 61.0406 69.3722 170.6927 60 V 4.8317 7.8715 120.4296 61.1510 34.3806 174.4062 61 R 4.9669 8.1975 123.7214 54.6144 31.9261 176.5204 62 K 4.1621 8.7985 122.5068 57.5301 33.9289 176.8506 63 I 3.2794 7.8030 115.7872 62.3327 34.3504 174.6469 64 S 4.3319 8.2265 115.7906 61.4649 62.7871 175.4012 65 N 4.8532 7.9628 116.9271 51.8640 39.4676 175.4583 66 G 3.9934 9.8004 105.8319 44.7688 0.0000 173.4142 67 E 4.8758 7.2495 114.6444 55.7301 32.2733 174.8948 68 G 4.2830 8.5043 110.2654 45.2759 0.0000 171.1225 69 V 4.6144 8.2092 116.4891 60.2073 36.2579 173.9654 70 E 5.1757 8.5743 119.3017 53.9214 32.4765 176.3692 71 R 4.1003 7.9977 122.6114 54.4253 33.1370 173.9925 72 V 3.6553 8.0240 127.2538 62.7226 32.4855 175.0760 73 F 4.9607 8.5556 125.1888 56.0426 41.9792 175.7986 74 Q 4.6305 9.1735 118.9976 54.7977 30.9638 175.9877 75 T 3.3376 7.8082 105.8150 62.2164 67.2334 172.0370 76 H 4.6212 7.7611 113.2925 57.4159 34.9565 174.3205 77 S 4.4785 7.9255 116.3077 56.5381 63.1572 172.5656 78 P 4.2203 0.0000 0.0000 66.1019 30.9084 178.3532 79 V 3.8076 8.1284 118.0370 65.8003 31.6922 177.8393 80 V 3.3808 7.7046 118.1686 64.5266 31.1525 176.1367 81 D 4.0219 7.0013 116.4040 54.5044 40.8763 173.4580 82 S 4.5711 6.6258 110.8083 57.2108 68.5310 173.1866 83 I 4.4602 8.1028 123.5343 59.0859 40.1382 174.6602 84 S 4.4796 8.4473 125.1115 58.0828 63.2408 175.1861 85 V 3.6220 8.5359 125.7425 62.9830 32.4942 176.7619 86 K 3.7263 8.0084 119.7814 56.4517 30.7437 174.4280 87 R 4.2449 8.3469 121.3000 57.5864 31.2673 176.8503 88 R 5.0850 7.9338 120.1873 53.7080 33.1726 174.0870 89 G 4.1973 8.3181 104.4346 45.4194 0.0000 170.9124 90 A 4.9020 8.1514 122.4522 50.2659 20.8847 176.5793 91 V 4.5019 7.7877 119.2067 60.7249 33.8776 173.6405 92 R 4.0320 8.7429 123.5627 58.7132 30.3804 176.8413 93 K 4.3598 7.9005 115.6738 55.6409 33.1445 176.1449 94 A 4.5606 8.4502 123.6715 51.9133 19.2523 176.9075 95 K 4.6411 7.5090 114.7656 55.3061 36.5845 175.7596 96 L 4.0849 7.1593 117.6761 54.1936 42.5829 177.9547 97 Y 4.3410 7.3281 116.6642 60.1523 38.9182 177.4645 98 Y 4.3318 7.1604 116.6094 57.8435 37.4296 176.5525 99 L 4.5231 7.3848 120.8646 55.8275 42.4715 178.6791 100 R 4.0076 7.7792 117.8883 58.2775 30.0279 177.6574 101 E 4.3232 7.9557 117.4713 58.5551 30.5056 177.7355 102 R 4.1633 8.1680 115.8159 58.1584 30.5507 178.4535 103 T 3.2881 8.0695 108.9530 62.0833 69.4786 171.8381 104 G 3.8873 8.3682 108.5417 46.9376 0.0000 171.1025 105 K 4.3190 9.1342 120.5710 56.0679 31.0904 177.0384 106 A 4.5713 7.5645 116.8244 51.7811 19.4760 177.3356 107 A 4.1766 7.5763 121.2059 55.0522 18.6753 179.3475 108 R 4.1103 7.7965 113.7200 56.9417 30.6077 175.3633 109 I 4.6160 7.7105 112.8552 59.9494 41.1052 173.8028 110 K 4.4164 8.2596 122.2293 55.8157 33.8889 175.5557 111 E 4.7683 8.3798 121.8155 54.7912 30.5827 175.9435 112 R 3.8485 8.7279 126.2611 57.9955 30.4904 177.7759 113 L 3.7656 7.9523 116.5631 54.1931 40.5657 174.0831 114 N 4.5325 8.3234 115.2151 54.2093 39.6213 174.5584 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 S 8.19 4.48 0.00 3.90 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 2 N 8.52 4.11 0.00 2.83 2.86 0.00 0.00 6.68 6.44 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 3 I 7.59 4.32 1.87 0.00 0.00 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.23 0.91 0.00 0.00 4 I 7.36 4.24 1.88 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 1.41 1.02 0.92 0.00 0.00 5 K 7.67 4.35 0.00 2.05 1.92 0.00 1.72 0.00 0.00 1.87 0.00 0.00 2.99 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.43 1.47 7.81 6 Q 7.61 3.95 0.00 2.37 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.17 6.57 0.00 0.00 0.00 0.00 0.00 2.49 2.37 0.00 7 L 7.11 3.93 0.00 1.70 1.75 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 0.00 0.00 0.00 0.00 0.00 0.00 8 E 7.61 4.03 0.00 2.29 2.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.30 0.00 9 Q 8.34 3.99 0.00 2.26 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.21 6.55 0.00 0.00 0.00 0.00 0.00 2.39 2.53 0.00 10 E 8.07 4.05 0.00 2.14 2.15 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 2.33 2.37 0.00 11 Q 7.84 4.51 0.00 2.17 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.32 6.62 0.00 0.00 0.00 0.00 0.00 2.44 2.42 0.00 12 M 7.60 4.23 0.00 1.96 2.10 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.59 2.70 0.00 13 K 8.42 4.38 0.00 1.80 1.84 0.00 1.48 0.00 0.00 1.73 0.00 0.00 3.11 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.26 1.66 7.81 14 Q 8.19 4.50 0.00 1.91 1.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.69 6.79 0.00 0.00 0.00 0.00 0.00 2.24 2.21 0.00 15 D 8.43 4.82 0.00 2.59 2.56 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 0.00 0.00 0.00 0.00 16 V 8.04 4.60 2.30 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 0.73 0.00 0.00 1.04 0.00 0.00 17 P 0.00 4.59 0.00 1.28 1.72 0.00 3.88 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 1.82 1.96 0.00 18 S 8.24 4.81 0.00 3.81 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 19 F 9.05 4.69 0.00 3.15 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 20 R 8.66 4.46 0.00 1.74 1.85 0.00 3.33 0.00 0.00 3.24 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.68 0.00 21 P 0.00 4.44 0.00 2.04 1.96 0.00 3.77 0.00 0.00 4.51 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.03 0.00 22 G 8.58 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 23 D 8.08 5.02 0.00 2.95 2.77 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 24 T 8.67 4.09 4.27 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 1.23 0.00 0.00 25 V 7.57 4.14 2.15 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 1.04 0.00 0.00 0.94 0.00 0.00 26 E 7.98 4.57 0.00 1.97 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.27 0.00 27 V 8.48 3.77 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 0.15 0.00 0.00 0.18 0.00 0.00 28 K 8.54 4.87 0.00 1.58 1.62 0.00 1.61 0.00 0.00 1.59 0.00 0.00 2.77 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.25 1.44 7.81 29 V 8.25 4.90 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 1.20 0.00 0.00 30 W 8.87 4.79 0.00 3.44 2.87 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 31 V 8.58 3.67 2.15 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 0.80 0.00 0.00 1.09 0.00 0.00 32 V 7.60 3.69 2.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.09 0.00 0.00 0.85 0.00 0.00 33 E 8.16 4.04 0.00 1.98 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 0.00 2.31 2.37 0.00 34 G 7.59 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 0.00 0.00 0.00 35 S 8.52 4.32 0.00 3.92 4.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 36 K 7.98 4.37 0.00 1.81 1.72 0.00 1.80 0.00 0.00 1.82 0.00 0.00 2.94 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.44 7.81 37 K 8.32 4.56 0.00 1.73 1.82 0.00 0.61 0.00 0.00 1.00 0.00 0.00 2.69 0.00 0.00 2.47 0.00 0.00 0.00 0.00 1.15 1.16 7.81 38 R 7.97 4.25 0.00 1.93 2.11 0.00 2.92 0.00 0.00 3.36 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.74 0.00 39 L 8.35 5.66 0.00 1.51 1.57 0.91 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 0.00 0.00 0.00 0.00 0.00 0.00 40 Q 8.72 4.58 0.00 2.17 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.44 7.11 0.00 0.00 0.00 0.00 0.00 2.12 2.27 0.00 41 A 8.32 4.57 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 42 F 8.23 4.80 0.00 3.04 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 43 E 7.76 4.80 0.00 2.00 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 0.00 2.28 2.20 0.00 44 G 8.64 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 0.00 0.00 0.00 0.00 45 V 8.41 4.49 2.15 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 0.96 0.00 0.00 0.96 0.00 0.00 46 V 8.43 4.56 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 1.00 0.00 0.00 1.19 0.00 0.00 47 I 8.62 4.58 1.64 0.00 0.00 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 0.94 0.54 0.00 0.00 0.00 48 A 7.82 4.05 1.16 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 0.00 0.00 49 I 8.10 3.84 1.80 0.00 0.00 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 1.35 1.11 0.86 0.00 0.00 50 R 8.15 3.98 0.00 1.63 0.96 0.00 3.26 0.00 0.00 3.41 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.61 0.00 51 N 8.71 4.44 0.00 2.91 2.96 0.00 0.00 7.12 7.35 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 52 R 8.64 3.95 0.00 2.17 2.20 0.00 3.36 0.00 0.00 3.22 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 53 G 7.43 3.58 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 0.00 0.00 0.00 54 L 8.17 3.42 0.00 1.58 1.26 0.70 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 55 H 7.49 4.40 0.00 3.22 3.28 0.00 5.70 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 56 S 8.49 4.87 0.00 4.18 3.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 57 A 7.63 5.23 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 58 F 8.37 4.66 0.00 3.22 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 59 T 7.84 3.86 4.18 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 1.14 0.00 0.00 60 V 7.87 4.83 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 1.21 0.00 0.00 1.07 0.00 0.00 61 R 8.20 4.97 0.00 2.00 1.83 0.00 3.32 0.00 0.00 3.10 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.67 0.00 62 K 8.80 4.16 0.00 1.81 1.88 0.00 2.04 0.00 0.00 2.00 0.00 0.00 3.09 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.46 1.56 7.81 63 I 7.80 3.28 1.90 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 1.33 0.57 0.93 0.00 0.00 64 S 8.23 4.33 0.00 3.87 3.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 65 N 7.96 4.85 0.00 2.69 2.75 0.00 0.00 7.30 9.00 0.00 0.00 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 G 9.80 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 67 E 7.25 4.88 0.00 2.11 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 2.21 0.00 68 G 8.50 4.28 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 0.00 69 V 8.21 4.61 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 0.78 0.00 0.00 1.00 0.00 0.00 70 E 8.57 5.18 0.00 1.76 1.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.37 2.11 0.00 71 R 8.00 4.10 0.00 1.38 1.13 0.00 2.87 0.00 0.00 2.89 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.71 1.22 0.00 72 V 8.02 3.66 1.93 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 0.83 0.00 0.00 0.81 0.00 0.00 73 F 8.56 4.96 0.00 2.80 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 74 Q 9.17 4.63 0.00 2.06 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.18 6.85 0.00 0.00 0.00 0.00 0.00 2.31 2.25 0.00 75 T 7.81 3.34 4.05 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 0.54 0.00 0.00 76 H 7.76 4.62 0.00 3.16 3.32 0.00 5.69 0.00 0.00 0.00 0.00 6.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 77 S 7.93 4.48 0.00 3.90 3.76 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 78 P 0.00 4.22 0.00 2.55 2.55 0.00 3.82 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 2.19 2.09 0.00 79 V 8.13 3.81 2.17 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 1.06 0.00 0.00 1.05 0.00 0.00 80 V 7.70 3.38 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 0.58 0.00 0.00 1.02 0.00 0.00 81 D 7.00 4.02 0.00 2.51 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 0.00 0.00 0.00 82 S 6.63 4.57 0.00 3.53 3.57 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 83 I 8.10 4.46 1.52 0.00 0.00 0.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.66 0.72 0.00 0.00 84 S 8.45 4.48 0.00 3.86 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 85 V 8.54 3.62 1.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.72 0.00 0.00 0.56 0.00 0.00 86 K 8.01 3.73 0.00 2.01 1.80 0.00 1.95 0.00 0.00 1.63 0.00 0.00 2.93 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.34 1.32 7.81 87 R 8.35 4.24 0.00 1.89 1.80 0.00 3.40 0.00 0.00 3.39 7.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.63 0.00 88 R 7.93 5.08 0.00 1.79 1.82 0.00 2.79 0.00 0.00 2.46 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 1.35 0.00 89 G 8.32 4.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 A 8.15 4.90 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 91 V 7.79 4.50 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 0.67 0.00 0.00 1.04 0.00 0.00 92 R 8.74 4.03 0.00 1.80 2.00 0.00 3.23 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 93 K 7.90 4.36 0.00 1.94 2.01 0.00 1.81 0.00 0.00 1.90 0.00 0.00 3.02 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.48 1.47 7.81 94 A 8.45 4.56 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 95 K 7.51 4.64 0.00 1.63 0.99 0.00 1.08 0.00 0.00 1.60 0.00 0.00 3.20 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.30 1.49 7.81 96 L 7.16 4.08 0.00 1.39 1.13 0.91 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 97 Y 7.33 4.34 0.00 3.03 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 98 Y 7.16 4.33 0.00 3.22 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 99 L 7.38 4.52 0.00 1.66 1.70 0.88 1.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.46 0.00 0.00 0.00 0.00 0.00 0.00 100 R 7.78 4.01 0.00 1.95 2.01 0.00 3.23 0.00 0.00 3.40 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.82 0.00 101 E 7.96 4.32 0.00 2.00 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 0.00 2.28 2.41 0.00 102 R 8.17 4.16 0.00 2.09 2.04 0.00 3.41 0.00 0.00 3.32 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.85 0.00 103 T 8.07 3.29 4.26 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 1.25 0.00 0.00 104 G 8.37 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 0.00 105 K 9.13 4.32 0.00 1.83 2.26 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.99 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.28 1.39 7.81 106 A 7.56 4.57 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 0.00 107 A 7.58 4.18 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 0.00 108 R 7.80 4.11 0.00 1.84 1.91 0.00 3.23 0.00 0.00 3.29 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.65 0.00 109 I 7.71 4.62 1.91 0.00 0.00 0.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.43 0.98 0.00 0.00 110 K 8.26 4.42 0.00 1.91 1.79 0.00 1.65 0.00 0.00 1.58 0.00 0.00 2.78 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.44 1.39 7.81 111 E 8.38 4.77 0.00 1.95 1.83 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 2.21 2.34 0.00 112 R 8.73 3.85 0.00 1.84 1.93 0.00 3.61 0.00 0.00 3.22 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.71 0.00 113 L 7.95 3.77 0.00 1.84 1.72 0.92 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.92 0.00 0.00 0.00 0.00 0.00 0.00 114 N 8.32 4.53 0.00 2.63 2.62 0.00 0.00 6.64 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