NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.2895 8.2993 120.1390 56.4777 34.6890 174.2914 4 C 4.4213 8.4213 116.5134 53.4490 42.6454 172.1083 5 S 4.9445 9.2460 120.2378 55.9761 66.1916 175.6133 6 L 3.8128 8.4075 122.4109 57.7779 41.5968 178.2062 7 T 3.6854 7.9043 114.5436 63.7368 68.8818 174.0738 8 G 3.5938 7.0899 112.5576 44.2111 0.0000 171.1785 9 K 4.9107 7.8536 119.1122 54.8213 34.2736 176.0417 10 W 5.4769 8.9682 122.8025 55.3733 33.9586 173.9872 11 T 5.3409 9.4572 117.0325 60.3658 70.6680 172.2422 12 N 5.6336 8.7506 123.0012 49.2140 40.7620 175.0154 13 D 4.4641 8.7650 119.4186 55.1493 39.6146 177.0654 14 L 4.6400 8.6846 117.2731 54.3197 43.3517 177.4211 15 G 3.9321 8.3363 106.2192 45.4747 0.0000 173.9271 16 S 4.6450 8.8312 116.6107 57.9360 64.6015 173.0298 17 N 5.4046 8.9070 120.3733 51.8372 42.1375 173.3894 18 M 5.1346 9.1354 118.6826 54.1084 35.8317 173.7456 19 T 5.1603 9.3418 109.2520 60.3500 72.4544 173.5892 20 I 4.2004 8.6982 126.8569 60.4256 39.9775 174.3140 21 G 4.1995 8.6692 112.7945 45.9184 0.0000 173.8299 22 A 4.1095 7.7963 124.4300 51.9655 19.3668 177.8394 23 V 5.1701 7.6917 113.1658 62.3935 32.3540 171.1021 24 N 4.4252 7.8555 123.3281 52.8868 39.0038 175.7109 25 S 4.1327 8.4080 113.3092 60.5355 63.3166 176.3448 26 R 4.0019 7.9818 119.5589 60.4810 30.2259 176.7147 27 G 3.8318 7.2200 103.3110 45.6354 0.0000 173.3788 28 E 4.5637 8.0934 121.1163 56.3743 30.8558 175.7383 29 F 5.2158 8.1646 116.8986 55.9941 41.5678 172.9807 30 T 4.9377 8.1568 109.9501 60.3103 72.2906 172.4819 31 G 4.0733 8.0144 107.7331 46.4569 0.0000 172.0851 32 T 5.3034 8.2534 109.0997 59.9505 72.4526 172.5519 33 Y 4.8667 9.2055 123.6327 56.2798 42.4659 173.9876 34 T 4.8892 8.9504 123.6473 62.1071 70.7908 173.4001 35 T 4.7638 9.1639 120.4650 60.5738 68.4853 174.5605 36 A 4.1990 8.6212 129.9856 53.6847 19.1788 177.7138 37 V 4.4859 7.3417 107.7590 60.1152 34.5185 174.7591 38 T 4.3787 7.8665 108.5422 61.1647 70.6981 173.3568 39 A 4.3730 8.3737 124.5541 52.6589 20.0177 177.1365 40 T 4.5662 7.5330 109.4029 60.6761 69.4169 173.9540 41 S 4.8803 8.2959 119.5955 58.5116 63.4385 174.3675 42 N 5.0345 7.6237 116.5174 50.9144 41.6370 174.6047 43 E 3.7203 8.9756 119.7127 56.4951 29.7852 177.2958 44 I 2.5034 7.8544 124.1117 60.6868 37.8131 175.5650 45 K 4.6100 7.5727 122.0421 54.2279 35.8733 175.9123 46 E 4.0981 8.7327 121.3822 56.5302 30.1367 176.6842 47 S 5.0703 9.2583 117.1789 55.9923 67.2461 171.1137 48 P 5.3679 0.0000 0.0000 61.5627 33.6827 174.2288 49 L 5.2712 9.1291 121.1128 54.4040 44.4125 174.7858 50 H 5.0950 9.1545 117.2083 54.2142 32.2425 173.1913 51 G 4.1853 9.1904 110.3286 45.4147 0.0000 170.9299 52 T 5.4206 8.0861 113.6220 61.7304 73.1979 173.0094 53 E 5.1109 8.6426 124.2783 54.4498 32.9617 174.0570 54 N 4.8876 8.8148 125.9947 52.9787 39.7802 174.6917 55 T 4.5453 8.3827 114.2877 61.2483 69.5384 173.6252 56 I 3.8810 7.9884 123.7013 62.0929 37.0125 175.7655 57 N 4.1539 7.8808 124.8489 58.4958 34.9973 176.0473 58 K 4.8343 7.0270 117.6702 56.8872 29.6729 176.1926 59 R 4.3833 8.3930 122.5606 55.3082 31.4412 178.2897 60 T 3.7959 8.4116 116.6274 65.9919 69.0184 173.9175 61 Q 5.7019 7.5189 119.2780 52.4167 28.5373 173.0623 62 P 4.6368 0.0000 0.0000 62.7385 33.9077 176.9566 63 T 4.9194 8.2913 111.1717 61.2826 71.6995 172.9158 64 F 5.3021 8.1452 115.8915 57.4835 41.6811 172.9176 65 G 4.4089 8.8229 101.6776 46.0860 0.0000 172.8930 66 F 5.7122 8.3654 117.4686 55.4283 42.3889 173.2311 67 T 5.0177 9.1982 116.6565 61.8881 71.4420 173.2872 68 V 4.2365 8.4800 126.7965 61.3626 33.0159 174.2887 69 N 4.7576 8.2233 128.5203 51.2590 37.7038 173.1200 70 W 4.5909 7.3543 120.0408 57.1759 29.2230 176.0862 71 K 4.2481 9.5003 125.5798 58.1657 32.1797 177.0317 72 F 4.7973 8.7172 111.2909 56.5885 38.2734 174.5099 73 S 4.4934 7.2972 114.4775 57.3160 65.4487 172.6307 74 E 4.4861 8.5879 119.6011 56.0609 29.5965 175.8935 75 S 4.9676 7.8172 115.0531 57.0433 66.4384 172.7416 76 T 5.0089 9.1078 115.5910 62.1714 72.8012 173.5636 77 T 5.2531 8.4848 120.6615 61.9545 72.6124 173.4296 78 V 5.0717 8.7126 117.6888 59.6625 35.7500 174.7124 79 F 5.4826 8.9029 121.9964 56.3544 42.8406 174.2390 80 T 4.6224 8.1374 116.5139 62.6010 73.5968 174.3002 81 G 4.0654 6.2510 108.5394 45.7872 0.0000 171.6986 82 Q 4.8576 7.6576 118.8392 54.3146 33.4514 175.8422 83 C 5.1429 8.5698 123.4030 55.2565 44.6816 172.6449 84 F 5.5129 9.3464 125.1173 56.0538 42.4597 175.1037 85 I 4.6445 8.9071 122.2974 59.8015 37.6916 175.6990 86 D 4.6500 9.6321 128.7683 53.1937 42.0200 177.3660 87 R 3.9472 8.5424 118.7763 59.2811 29.3823 177.8741 88 N 4.2765 8.1558 114.8852 54.7832 38.5478 175.7355 89 G 4.0883 8.2228 105.0894 44.6976 0.0000 173.7125 90 K 4.4124 7.8313 119.8010 55.6623 33.6696 176.1555 91 E 4.8923 8.8476 124.1773 56.5842 30.4692 176.5098 92 V 4.8411 9.2723 123.6500 61.3462 35.4302 173.8865 93 L 5.1130 9.6437 128.6978 53.6016 43.2698 175.4916 94 K 5.0132 9.0512 124.7369 55.3318 34.1167 176.1490 95 T 5.3129 9.0932 120.5844 62.4210 73.7491 172.4363 96 M 5.3303 9.2525 121.9656 54.1942 36.3255 173.5082 97 W 5.5304 8.6945 120.2816 55.1394 32.6874 173.2168 98 L 5.2503 8.8785 119.8274 52.8599 44.7808 175.5287 99 L 5.0831 9.2373 126.0163 53.5153 44.4786 174.6699 100 R 5.0341 9.0617 128.5647 54.8338 31.7619 175.2970 101 S 5.0902 8.2682 120.4374 56.3859 66.3635 173.5907 102 S 4.4688 8.4827 116.3982 57.8561 63.5296 174.4673 103 V 4.4552 7.9917 117.4385 59.6668 34.0070 175.6814 104 N 4.6249 8.5382 118.1162 54.5181 39.1611 175.0342 105 D 4.6603 7.5070 117.3492 52.6300 44.1746 175.2741 106 I 3.9702 8.5356 124.5636 62.4041 37.9054 176.3916 107 G 3.9093 7.9242 108.0053 47.4708 0.0000 174.5127 108 D 4.8898 8.6758 119.6950 54.0378 41.5384 177.5348 109 D 4.2734 8.3379 121.5027 57.1266 41.0882 178.4185 110 W 4.5207 8.4208 113.9488 58.2857 27.9486 176.3342 111 K 3.6394 6.6656 116.8120 56.1757 31.8915 176.6393 112 A 4.1771 8.1515 123.1894 53.3699 19.2302 177.3407 113 T 4.8023 7.6317 112.5213 61.7550 70.6171 174.3179 114 R 4.7654 8.9566 125.7947 54.9087 32.9365 175.7130 115 V 4.4388 7.6987 119.2171 60.5754 34.6762 174.6939 116 G 3.0744 6.6401 108.1633 45.6556 0.0000 171.6346 117 I 5.2084 7.8599 119.2942 59.9189 41.2595 175.1840 118 N 5.0194 8.9960 117.8160 52.7578 43.9773 173.8110 119 I 5.1895 9.8048 125.4054 59.7876 39.8596 174.6337 120 F 5.3441 9.8991 126.7580 56.4411 41.3923 174.9536 121 T 5.3541 9.8816 116.5379 60.3934 71.6213 172.7079 122 R 3.9647 8.5431 123.9939 55.9681 30.2156 176.5829 123 L 4.1076 8.0993 126.6487 57.9229 42.6082 177.7398 124 R 3.8610 7.7651 115.6596 57.1405 30.6258 176.5146 125 T 4.1304 8.2468 115.9886 63.7711 68.6916 174.7430 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 3 K 8.30 4.29 0.00 1.81 1.82 0.00 1.75 0.00 0.00 1.73 0.00 0.00 3.02 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.38 1.42 7.81 4 C 8.42 4.42 0.00 3.36 3.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 5 S 9.25 4.94 0.00 3.94 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 6 L 8.41 3.81 0.00 1.16 1.06 -0.14 0.52 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.53 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.90 3.69 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 1.17 0.00 0.00 8 G 7.09 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 9 K 7.85 4.91 0.00 1.53 1.60 0.00 1.55 0.00 0.00 1.75 0.00 0.00 3.01 0.00 0.00 2.85 0.00 0.00 0.00 0.00 1.37 1.35 7.81 10 W 8.97 5.48 0.00 3.31 3.38 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 11 T 9.46 5.34 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 1.26 0.00 0.00 12 N 8.75 5.63 0.00 2.02 1.47 0.00 0.00 6.59 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 13 D 8.76 4.46 0.00 2.82 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 14 L 8.68 4.64 0.00 1.72 1.69 1.11 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.34 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 0.00 0.00 0.00 16 S 8.83 4.64 0.00 3.77 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 0.00 17 N 8.91 5.40 0.00 2.51 2.76 0.00 0.00 6.52 8.45 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 18 M 9.14 5.13 0.00 1.51 2.13 0.00 0.00 0.00 0.00 0.00 1.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.35 2.43 0.00 19 T 9.34 5.16 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 20 I 8.70 4.20 1.80 0.00 0.00 0.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.97 1.05 0.35 0.00 0.00 21 G 8.67 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 22 A 7.80 4.11 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 23 V 7.69 5.17 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 0.00 0.00 1.15 0.00 0.00 24 N 7.86 4.43 0.00 2.99 2.80 0.00 0.00 7.02 7.57 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 25 S 8.41 4.13 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 26 R 7.98 4.00 0.00 2.01 1.97 0.00 3.76 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 1.62 1.62 0.00 27 G 7.22 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 28 E 8.09 4.56 0.00 2.17 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 2.30 2.19 0.00 29 F 8.16 5.22 0.00 3.01 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 30 T 8.16 4.94 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 1.05 0.00 0.00 31 G 8.01 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.25 5.30 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 1.21 0.00 0.00 33 Y 9.21 4.87 0.00 2.85 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 34 T 8.95 4.89 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 1.23 0.00 0.00 35 T 9.16 4.76 4.77 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 1.24 0.00 0.00 36 A 8.62 4.20 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 37 V 7.34 4.49 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 0.77 0.00 0.00 0.92 0.00 0.00 38 T 7.87 4.38 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 1.26 0.00 0.00 39 A 8.37 4.37 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 40 T 7.53 4.57 4.14 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 1.07 0.00 0.00 41 S 8.30 4.88 0.00 3.90 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 42 N 7.62 5.03 0.00 2.94 2.80 0.00 0.00 6.80 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 43 E 8.98 3.72 0.00 2.02 2.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.30 2.36 0.00 44 I 7.85 2.50 1.56 0.00 0.00 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.98 -0.36 0.58 0.00 0.00 45 K 7.57 4.61 0.00 1.78 1.76 0.00 1.85 0.00 0.00 1.79 0.00 0.00 3.01 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.35 1.46 7.81 46 E 8.73 4.10 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 2.38 2.38 0.00 47 S 9.26 5.07 0.00 3.86 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 48 P 0.00 5.37 0.00 2.15 2.20 0.00 3.85 0.00 0.00 3.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.02 1.97 0.00 49 L 9.13 5.27 0.00 1.75 1.61 0.81 0.56 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 50 H 9.15 5.10 0.00 3.07 3.17 0.00 5.58 0.00 0.00 0.00 0.00 6.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 G 9.19 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.09 5.42 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 1.19 0.00 0.00 53 E 8.64 5.11 0.00 2.41 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 2.36 2.36 0.00 54 N 8.81 4.89 0.00 2.85 2.73 0.00 0.00 6.99 7.65 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 55 T 8.38 4.55 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 1.24 0.00 0.00 56 I 7.99 3.88 2.08 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 1.30 0.81 0.92 0.00 0.00 57 N 7.88 4.15 0.00 2.96 2.91 0.00 0.00 7.10 7.31 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 58 K 7.03 4.83 0.00 1.78 1.74 0.00 1.75 0.00 0.00 1.72 0.00 0.00 3.16 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.70 1.53 7.81 59 R 8.39 4.38 0.00 1.84 1.84 0.00 3.40 0.00 0.00 3.17 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.89 1.74 0.00 60 T 8.41 3.80 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 1.26 0.00 0.00 61 Q 7.52 5.70 0.00 1.66 2.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.78 6.95 0.00 0.00 0.00 0.00 0.00 2.36 2.18 0.00 62 P 0.00 4.64 0.00 2.18 2.29 0.00 3.68 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 2.11 2.10 0.00 63 T 8.29 4.92 4.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.17 0.00 0.00 64 F 8.15 5.30 0.00 3.36 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 65 G 8.82 4.41 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 0.00 66 F 8.37 5.71 0.00 3.33 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 67 T 9.20 5.02 4.29 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 1.20 0.00 0.00 68 V 8.48 4.24 1.66 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 -0.99 0.00 0.00 0.82 0.00 0.00 69 N 8.22 4.76 0.00 2.74 2.67 0.00 0.00 7.24 7.23 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 70 W 7.35 4.59 0.00 3.26 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 71 K 9.50 4.25 0.00 1.88 2.02 0.00 1.71 0.00 0.00 1.83 0.00 0.00 3.21 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.48 1.57 7.81 72 F 8.72 4.80 0.00 3.29 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 73 S 7.30 4.49 0.00 2.93 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 74 E 8.59 4.49 0.00 1.97 1.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.23 2.24 0.00 75 S 7.82 4.97 0.00 4.00 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 76 T 9.11 5.01 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 1.21 0.00 0.00 77 T 8.48 5.25 4.51 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 1.10 0.00 0.00 78 V 8.71 5.07 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 0.83 0.00 0.00 1.01 0.00 0.00 79 F 8.90 5.48 0.00 1.58 2.44 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 0.00 0.00 0.00 0.00 80 T 8.14 4.62 4.07 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 0.00 0.00 0.00 1.15 0.00 0.00 81 G 6.25 4.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 82 Q 7.66 4.86 0.00 1.79 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.03 6.81 0.00 0.00 0.00 0.00 0.00 1.35 2.22 0.00 83 C 8.57 5.14 0.00 2.98 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 84 F 9.35 5.51 0.00 2.97 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 85 I 8.91 4.64 1.97 0.00 0.00 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.89 1.01 0.00 0.00 86 D 9.63 4.65 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 87 R 8.54 3.95 0.00 1.97 2.07 0.00 3.11 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 1.60 1.66 0.00 88 N 8.16 4.28 0.00 2.76 2.97 0.00 0.00 7.15 7.65 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 89 G 8.22 4.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 90 K 7.83 4.41 0.00 1.78 1.80 0.00 1.71 0.00 0.00 1.83 0.00 0.00 2.91 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.53 1.49 7.81 91 E 8.85 4.89 0.00 2.00 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 0.00 2.66 2.48 0.00 92 V 9.27 4.84 2.31 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 1.21 0.00 0.00 1.10 0.00 0.00 93 L 9.64 5.11 0.00 1.62 1.77 0.29 -0.67 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 94 K 9.05 5.01 0.00 2.10 1.92 0.00 1.59 0.00 0.00 1.76 0.00 0.00 2.90 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.57 1.70 7.81 95 T 9.09 5.31 5.06 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 2.03 0.00 0.00 96 M 9.25 5.33 0.00 1.97 1.80 0.00 0.00 0.00 0.00 0.00 1.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 97 W 8.69 5.53 0.00 2.98 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 0.00 0.00 0.00 98 L 8.88 5.25 0.00 1.62 1.59 0.90 0.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 99 L 9.24 5.08 0.00 1.74 1.87 0.88 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.24 0.00 0.00 0.00 0.00 0.00 0.00 100 R 9.06 5.03 0.00 1.96 1.79 0.00 3.11 0.00 0.00 3.20 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.61 0.00 101 S 8.27 5.09 0.00 3.77 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 0.00 102 S 8.48 4.47 0.00 3.86 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 0.00 103 V 7.99 4.46 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 0.64 0.00 0.00 0.94 0.00 0.00 104 N 8.54 4.62 0.00 2.71 2.86 0.00 0.00 6.66 8.06 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 0.00 105 D 7.51 4.66 0.00 2.71 2.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 106 I 8.54 3.97 1.89 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 1.37 0.96 0.92 0.00 0.00 107 G 7.92 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 0.00 108 D 8.68 4.89 0.00 2.84 2.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 109 D 8.34 4.27 0.00 2.78 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 0.00 110 W 8.42 4.52 0.00 3.73 3.31 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 0.00 111 K 6.67 3.64 0.00 0.79 0.74 0.00 1.17 0.00 0.00 1.42 0.00 0.00 2.78 0.00 0.00 3.18 0.00 0.00 0.00 0.00 0.79 0.97 7.81 112 A 8.15 4.18 1.26 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 0.00 0.00 113 T 7.63 4.80 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 1.20 0.00 0.00 114 R 8.96 4.77 0.00 1.90 1.98 0.00 3.19 0.00 0.00 3.25 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.57 0.00 115 V 7.70 4.44 1.90 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 0.53 0.00 0.00 0.71 0.00 0.00 116 G 6.64 3.07 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 117 I 7.86 5.21 1.85 0.00 0.00 0.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.36 0.78 1.00 0.00 0.00 118 N 9.00 5.02 0.00 3.28 2.76 0.00 0.00 7.21 7.58 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 0.00 119 I 9.80 5.19 1.94 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.29 1.04 0.00 0.00 120 F 9.90 5.34 0.00 2.93 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 0.00 121 T 9.88 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 1.34 0.00 0.00 122 R 8.54 3.96 0.00 1.47 1.46 0.00 2.65 0.00 0.00 2.25 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 0.85 0.00 123 L 8.10 4.11 0.00 1.56 1.58 0.95 1.39 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 0.00 124 R 7.77 3.86 0.00 1.68 1.77 0.00 2.89 0.00 0.00 3.01 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.43 0.00 125 T 8.25 4.13 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 1.18 0.00 0.00