NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 K 4.1966 8.1727 122.0536 56.3033 34.1279 173.9681 2 V 4.5745 8.1829 127.0019 60.7764 32.3038 174.6327 3 F 4.2786 9.3963 128.2537 57.2788 40.0380 175.5513 4 G 3.8037 9.0022 109.6103 45.7794 0.0000 175.0415 5 R 3.3713 8.4738 118.9136 59.2716 29.3562 179.9300 6 C 4.2974 8.0550 116.7148 59.3679 36.0492 175.2580 7 E 3.8999 8.1491 120.5607 59.3740 29.2353 178.6379 8 L 3.5410 8.2641 120.3223 57.8028 42.0188 178.4402 9 A 3.9681 8.1351 120.7497 55.3189 18.2709 179.5539 10 A 3.8903 8.2907 118.9973 55.2222 18.5516 179.7280 11 A 3.9602 7.9276 119.2552 55.6089 18.4549 179.7932 12 M 3.8609 8.4553 117.5702 58.2633 31.9784 178.9334 13 K 3.9085 8.2687 120.0099 59.6166 32.1903 179.1576 14 R 3.9784 7.9633 117.1354 58.7452 29.8718 177.6317 15 H 4.7484 7.6815 114.2433 55.2395 29.1530 175.8484 16 G 3.8867 7.7957 108.0414 45.8433 0.0000 174.8693 17 L 3.7778 7.7482 118.7215 54.7316 41.8611 176.0169 18 D 4.3967 7.8088 118.2969 55.0458 40.3717 174.3582 19 N 4.7827 9.0537 124.8288 54.3924 37.4819 172.9656 20 Y 4.2003 8.1511 117.6170 58.3397 39.1975 175.6748 21 R 3.7300 9.0701 126.5225 57.3314 28.7141 176.7009 22 G 3.7509 8.1393 101.8787 45.2456 0.0000 173.6568 23 Y 4.5207 8.0124 118.9830 55.8554 38.6199 175.7939 24 S 4.6720 8.6182 119.9441 57.8633 64.1124 174.8111 25 L 4.3231 9.0323 123.2282 58.8404 41.5319 179.6177 26 G 3.9008 8.3446 104.8500 47.9067 0.0000 175.1282 27 N 4.5257 8.3891 118.7172 56.2205 38.5534 177.5287 28 W 3.8531 7.9131 119.7930 59.4400 29.2023 178.7441 29 V 3.6301 7.9949 118.3764 66.1527 31.0541 177.2782 30 C 3.2269 8.3631 118.2343 59.1316 42.5651 175.2702 31 A 3.9702 8.1289 122.2521 55.2361 17.9598 179.4684 32 A 3.9966 7.7014 120.5049 54.3858 18.3999 179.5627 33 K 2.4800 7.4867 118.0687 59.1857 31.8306 178.7073 34 F 4.3375 7.2924 115.1620 58.9594 39.1493 177.9733 35 E 4.2263 8.2902 118.7643 58.7912 29.7808 177.8356 36 S 4.5996 7.8065 110.1395 56.9257 64.0491 173.6260 37 N 3.6270 8.5787 117.1106 54.6340 36.5196 174.6949 38 F 4.0694 7.4637 111.8084 58.2388 37.5677 174.2684 39 N 5.2063 7.9439 121.1719 52.2546 39.0536 175.7828 40 T 4.1100 9.0092 117.7965 64.0737 69.6921 175.5163 41 Q 4.7528 8.5455 119.3295 55.3644 29.8354 175.8969 42 A 4.3061 8.0571 123.2241 52.5541 19.4432 177.2014 43 T 4.9990 8.3115 110.8424 60.1263 72.3842 173.2098 44 N 4.9015 8.6061 120.6991 51.7461 42.8872 173.6448 45 R 4.5306 8.6827 124.7317 56.1636 31.2456 175.3965 46 N 4.9183 9.1668 123.3932 51.9271 40.7087 176.4393 47 T 3.8866 8.5942 117.3904 66.7809 68.6347 175.2892 48 D 4.5138 8.0301 117.9827 53.6153 39.5694 177.1245 49 G 3.9404 8.1935 109.4898 45.2934 0.0000 174.0468 50 S 4.6175 8.2072 114.8627 58.3798 65.1033 173.2630 51 T 5.0044 9.0287 116.3075 61.9220 72.7069 172.8670 52 D 5.3849 8.9268 125.3679 53.3654 43.0719 175.0211 53 Y 4.8582 9.1821 120.9590 57.5330 41.2941 177.0852 54 G 4.4030 9.2992 112.4013 45.5549 0.0000 173.1912 55 I 3.6953 8.4435 116.9735 63.4474 38.0163 177.9778 56 L 4.5626 7.8492 117.1281 53.5625 42.5171 176.3974 57 Q 3.4718 8.0340 115.9624 57.0903 26.7077 174.4382 58 I 4.3567 8.2202 119.0613 60.9719 39.0833 176.9445 59 N 5.6242 9.2003 124.7701 52.0737 39.1669 175.8393 60 S 4.9972 8.9602 115.1414 59.4197 63.4810 175.2463 61 R 3.8502 8.2645 122.1033 58.7872 30.5236 177.6205 62 W 3.8940 8.1786 117.2802 56.7688 31.3199 177.8449 63 W 4.9718 8.5167 118.7289 57.4006 31.6528 173.7467 64 C 5.3817 8.1570 112.0620 53.7186 46.7761 172.5329 65 N 5.1695 8.9397 119.3457 52.1506 39.8693 174.7458 66 D 4.6825 8.8818 124.7073 52.5626 40.0673 177.5164 67 G 3.9816 8.6506 107.8068 46.3569 0.0000 174.5629 68 R 4.6882 8.4431 116.5130 55.9478 31.8735 176.0763 69 T 4.4836 7.5435 116.5302 59.9158 68.7517 169.9833 70 P 4.2523 0.0000 0.0000 64.4069 31.9196 176.8684 71 G 3.7668 8.9354 110.5822 44.8879 0.0000 173.1245 72 S 4.0144 7.4383 113.6141 59.0096 62.5396 174.8116 73 R 3.8350 8.3147 126.1551 56.6139 30.7756 175.9263 74 N 4.2512 8.0521 116.1188 54.4713 37.1687 175.2261 75 L 4.0849 8.2634 117.7546 57.6001 42.2424 178.1616 76 C 4.5866 8.6326 114.5947 56.1299 40.9814 172.7065 77 N 4.2232 8.1105 117.9856 53.7317 37.4154 173.3945 78 I 4.5532 7.1630 116.7869 58.9349 42.1542 171.8078 79 P 4.7905 0.0000 0.0000 62.5549 31.9515 178.4214 80 C 4.1216 8.6732 120.4479 59.9015 34.6004 176.6620 81 S 3.8186 7.9279 115.2314 61.3448 62.1419 176.2657 82 A 4.0945 7.8519 123.3285 54.2747 18.1999 177.8979 83 L 4.3993 7.9513 116.5568 55.1113 41.8892 177.5755 84 L 5.2954 7.5501 116.9222 53.7026 41.9622 176.6990 85 S 4.4034 7.7920 113.2344 58.0124 62.9513 174.4973 86 S 4.2901 8.5669 121.0421 60.9015 62.9487 174.3365 87 D 4.7748 7.9138 119.7491 53.3299 41.9235 176.3194 88 I 4.1063 8.2259 118.8202 61.5243 37.9822 177.6770 89 T 3.5440 8.2074 119.0913 67.1142 68.3715 176.0122 90 A 3.9878 7.8630 121.7969 55.2609 18.4096 179.6510 91 S 4.0729 7.9429 113.2247 61.6460 62.9326 177.0036 92 V 3.3008 7.8569 121.0715 65.8790 31.1845 177.5901 93 N 4.1466 8.3154 116.7143 56.7217 38.3401 176.5567 94 C 4.2403 8.2367 119.3484 59.4738 43.0330 175.2806 95 A 4.0547 8.3271 122.8662 55.2960 17.6765 179.7930 96 K 3.7448 7.6335 116.1068 59.1929 32.1598 179.5140 97 K 4.2139 7.5267 118.5367 59.2978 32.1251 179.3131 98 I 2.7575 7.6029 120.4324 64.1125 36.8298 178.9063 99 V 4.0785 8.6129 121.1354 63.1081 30.9367 177.3203 100 S 4.9250 7.4974 113.1847 58.2242 63.3684 173.8794 101 D 4.7076 9.1432 120.4248 54.5046 41.3961 176.2954 102 G 4.0396 7.1831 114.6994 46.7186 0.0000 173.5538 103 N 4.9629 7.5997 116.3915 51.7112 40.9894 175.2299 104 G 4.0735 8.0304 107.5185 46.0545 0.0000 175.2873 105 M 4.1166 7.9018 119.6159 56.0876 31.8783 177.8422 106 N 4.6264 7.8118 116.1383 55.6147 38.8858 176.0290 107 A 3.7415 7.8222 120.3579 54.1917 18.4873 177.6425 108 W 4.5947 7.9788 116.5765 55.2823 29.5314 177.1742 109 V 3.6635 8.3696 124.6985 65.9124 31.1453 177.5512 110 A 4.0498 8.5745 120.6347 54.6561 18.1057 179.4164 111 W 3.9636 8.4659 126.5619 60.6162 30.6727 177.8452 112 R 3.4316 8.2818 117.4364 59.4068 29.6212 177.6217 113 N 4.5123 7.9086 113.5722 54.1945 38.9427 175.9967 114 R 4.2455 7.5970 116.7171 55.6088 32.9107 175.4303 115 C 4.5730 7.9876 114.3148 57.9272 41.9514 174.2909 116 K 3.3380 6.4676 118.7590 57.8232 31.6159 176.7994 117 G 3.8649 8.7957 113.7289 45.7094 0.0000 173.2114 118 T 4.3258 7.3647 109.8644 60.3871 70.9617 176.0510 119 D 4.7070 8.1890 120.4066 53.7809 37.5689 176.6122 120 V 4.1190 7.7717 116.4840 63.9718 32.1958 177.5272 121 Q 4.0621 8.3687 118.8822 58.9718 28.8906 177.9199 122 A 3.9814 8.0909 121.8947 54.8360 18.0613 179.3898 123 W 4.3706 8.2467 116.6807 58.5200 29.3697 177.0312 124 I 4.4954 7.5597 111.8806 60.1648 37.3545 175.1068 125 R 4.0109 7.5404 121.4325 58.3233 30.0008 177.1788 126 G 3.9954 8.9228 112.7820 45.7272 0.0000 174.2097 127 C 4.4243 7.7054 117.0817 56.5781 40.7849 173.7085 128 R 4.2753 8.4733 123.1357 55.6913 29.7347 176.6827 129 L 4.3192 8.4166 122.2866 54.7620 41.9494 176.6256 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 4.20 0.00 1.76 1.66 0.00 1.34 0.00 0.00 1.21 0.00 0.00 2.13 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.97 1.18 7.81 2 V 8.18 4.57 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 1.01 0.00 0.00 0.97 0.00 0.00 3 F 9.40 4.28 0.00 2.81 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 4 G 9.00 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 5 R 8.47 3.37 0.00 2.28 2.43 0.00 3.45 0.00 0.00 3.66 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.80 0.00 6 C 8.06 4.30 0.00 3.00 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 7 E 8.15 3.90 0.00 2.05 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 0.00 2.63 2.42 0.00 8 L 8.26 3.54 0.00 1.42 1.49 -0.05 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.19 0.00 0.00 0.00 0.00 0.00 0.00 9 A 8.14 3.97 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 10 A 8.29 3.89 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 11 A 7.93 3.96 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 12 M 8.46 3.86 0.00 1.85 2.22 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 2.55 2.32 0.00 13 K 8.27 3.91 0.00 1.86 2.01 0.00 1.84 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.47 7.81 14 R 7.96 3.98 0.00 1.90 1.84 0.00 3.15 0.00 0.00 3.20 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.81 0.00 15 H 7.68 4.75 0.00 3.01 3.15 0.00 5.68 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 G 7.80 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 17 L 7.75 3.78 0.00 1.44 0.71 0.11 -0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.56 0.00 0.00 0.00 0.00 0.00 0.00 18 D 7.81 4.40 0.00 2.64 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 19 N 9.05 4.78 0.00 3.10 2.93 0.00 0.00 7.32 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 20 Y 8.15 4.20 0.00 3.16 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 21 R 9.07 3.73 0.00 2.06 2.33 0.00 3.58 0.00 0.00 3.51 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.62 0.00 22 G 8.14 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 0.00 0.00 0.00 23 Y 8.01 4.52 0.00 3.32 2.52 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 0.00 0.00 0.00 0.00 24 S 8.62 4.67 0.00 4.12 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 25 L 9.03 4.32 0.00 2.06 1.85 1.02 1.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 0.00 0.00 0.00 0.00 0.00 0.00 26 G 8.34 3.90 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 0.00 0.00 0.00 27 N 8.39 4.53 0.00 2.91 2.60 0.00 0.00 6.96 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 28 W 7.91 3.85 0.00 3.47 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 29 V 7.99 3.63 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 1.19 0.00 0.00 1.01 0.00 0.00 30 C 8.36 3.23 0.00 2.75 3.19 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 31 A 8.13 3.97 0.97 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 0.00 0.00 32 A 7.70 4.00 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 33 K 7.49 2.48 0.00 0.79 0.80 0.00 0.61 0.00 0.00 0.61 0.00 0.00 3.08 0.00 0.00 2.56 0.00 0.00 0.00 0.00 0.30 0.21 7.81 34 F 7.29 4.34 0.00 3.00 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 35 E 8.29 4.23 0.00 1.95 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 2.55 2.52 0.00 36 S 7.81 4.60 0.00 4.13 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 37 N 8.58 3.63 0.00 2.84 2.84 0.00 0.00 6.97 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 38 F 7.46 4.07 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 39 N 7.94 5.21 0.00 2.87 2.88 0.00 0.00 6.96 7.32 0.00 0.00 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 9.01 4.11 4.56 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 1.51 0.00 0.00 41 Q 8.55 4.75 0.00 2.11 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.76 6.85 0.00 0.00 0.00 0.00 0.00 2.36 2.34 0.00 42 A 8.06 4.31 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 8.31 5.00 3.98 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 0.00 0.00 0.00 1.21 0.00 0.00 44 N 8.61 4.90 0.00 2.70 2.68 0.00 0.00 6.59 7.74 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 45 R 8.68 4.53 0.00 1.79 1.80 0.00 3.22 0.00 0.00 3.22 7.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.74 0.00 46 N 9.17 4.92 0.00 2.93 2.73 0.00 0.00 6.82 7.05 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 47 T 8.59 3.89 4.25 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 1.22 0.00 0.00 48 D 8.03 4.51 0.00 2.79 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 49 G 8.19 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 50 S 8.21 4.62 0.00 4.05 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 51 T 9.03 5.00 4.17 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 0.57 0.00 0.00 52 D 8.93 5.38 0.00 2.64 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 53 Y 9.18 4.86 0.00 3.04 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 54 G 9.30 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 0.00 0.00 0.00 55 I 8.44 3.70 1.91 0.00 0.00 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.27 1.17 0.86 0.00 0.00 56 L 7.85 4.56 0.00 1.69 1.72 0.75 0.47 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 57 Q 8.03 3.47 0.00 2.43 2.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.26 6.82 0.00 0.00 0.00 0.00 0.00 2.48 2.61 0.00 58 I 8.22 4.36 2.04 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 1.05 1.09 0.00 0.00 59 N 9.20 5.62 0.00 2.98 3.25 0.00 0.00 6.03 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 60 S 8.96 5.00 0.00 4.03 4.37 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 61 R 8.26 3.85 0.00 1.88 1.97 0.00 3.26 0.00 0.00 3.42 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.92 1.35 0.00 62 W 8.18 3.89 0.00 2.60 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 0.00 0.00 0.00 63 W 8.52 4.97 0.00 3.55 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 64 C 8.16 5.38 0.00 3.14 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 65 N 8.94 5.17 0.00 2.94 2.69 0.00 0.00 7.14 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 66 D 8.88 4.68 0.00 2.80 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 67 G 8.65 3.98 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 68 R 8.44 4.69 0.00 1.81 1.90 0.00 3.15 0.00 0.00 3.25 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.70 0.00 69 T 7.54 4.48 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 1.25 0.00 0.00 70 P 0.00 4.25 0.00 1.99 1.99 0.00 3.66 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 2.01 2.09 0.00 71 G 8.94 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 0.00 0.00 0.00 72 S 7.44 4.01 0.00 3.93 3.73 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 73 R 8.31 3.84 0.00 1.52 1.80 0.00 3.03 0.00 0.00 2.25 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.24 0.00 74 N 8.05 4.25 0.00 2.81 2.73 0.00 0.00 7.24 6.66 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 75 L 8.26 4.08 0.00 1.88 1.96 0.63 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.81 0.00 0.00 0.00 0.00 0.00 0.00 76 C 8.63 4.59 0.00 3.26 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 77 N 8.11 4.22 0.00 2.81 2.84 0.00 0.00 6.83 8.29 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 78 I 7.16 4.55 2.02 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 1.29 1.03 0.94 0.00 0.00 79 P 0.00 4.79 0.00 2.17 1.90 0.00 3.64 0.00 0.00 3.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.09 2.08 0.00 80 C 8.67 4.12 0.00 2.10 1.57 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 81 S 7.93 3.82 0.00 4.02 4.08 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 82 A 7.85 4.09 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 83 L 7.95 4.40 0.00 1.88 1.76 0.99 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.29 0.00 0.00 0.00 0.00 0.00 0.00 84 L 7.55 5.30 0.00 1.84 1.73 1.11 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 85 S 7.79 4.40 0.00 3.94 4.02 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 0.00 0.00 0.00 0.00 86 S 8.57 4.29 0.00 3.91 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 87 D 7.91 4.77 0.00 2.66 2.58 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 88 I 8.23 4.11 1.68 0.00 0.00 0.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 0.14 0.67 0.00 0.00 89 T 8.21 3.54 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 1.18 0.00 0.00 90 A 7.86 3.99 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 91 S 7.94 4.07 0.00 3.95 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 92 V 7.86 3.30 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 0.70 0.00 0.00 0.71 0.00 0.00 93 N 8.32 4.15 0.00 2.84 2.83 0.00 0.00 6.71 7.26 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 94 C 8.24 4.24 0.00 3.02 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 95 A 8.33 4.05 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 96 K 7.63 3.74 0.00 1.70 1.65 0.00 1.35 0.00 0.00 1.27 0.00 0.00 2.33 0.00 0.00 2.47 0.00 0.00 0.00 0.00 0.30 0.91 7.81 97 K 7.53 4.21 0.00 2.13 1.97 0.00 1.73 0.00 0.00 1.75 0.00 0.00 3.00 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.53 1.51 7.81 98 I 7.60 2.76 1.52 0.00 0.00 0.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 -0.30 0.02 -0.47 0.00 0.00 99 V 8.61 4.08 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 1.38 0.00 0.00 0.94 0.00 0.00 100 S 7.50 4.93 0.00 4.09 4.12 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 0.00 101 D 9.14 4.71 0.00 3.13 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 0.00 102 G 7.18 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 0.00 0.00 0.00 103 N 7.60 4.96 0.00 2.64 2.73 0.00 0.00 7.13 7.68 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 0.00 104 G 8.03 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 0.00 105 M 7.90 4.12 0.00 0.51 0.57 0.00 0.00 0.00 0.00 0.00 0.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.00 1.04 0.00 106 N 7.81 4.63 0.00 2.96 2.98 0.00 0.00 6.87 7.50 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 0.00 107 A 7.82 3.74 0.57 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 0.00 0.00 108 W 7.98 4.59 0.00 3.53 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 0.00 109 V 8.37 3.66 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 1.08 0.00 0.00 0.97 0.00 0.00 110 A 8.57 4.05 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 0.00 111 W 8.47 3.96 0.00 3.34 3.50 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 0.00 112 R 8.28 3.43 0.00 2.05 2.22 0.00 3.63 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.60 0.00 113 N 7.91 4.51 0.00 2.66 2.75 0.00 0.00 6.87 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 0.00 114 R 7.60 4.25 0.00 1.20 0.78 0.00 2.97 0.00 0.00 2.94 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.88 0.00 115 C 7.99 4.57 0.00 2.15 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 0.00 116 K 6.47 3.34 0.00 0.79 1.20 0.00 1.76 0.00 0.00 1.55 0.00 0.00 3.08 0.00 0.00 3.04 0.00 0.00 0.00 0.00 1.20 1.21 7.81 117 G 8.80 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 0.00 118 T 7.36 4.33 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 1.18 0.00 0.00 119 D 8.19 4.71 0.00 2.82 2.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 V 7.77 4.12 2.38 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 0.95 0.00 0.00 1.11 0.00 0.00 121 Q 8.37 4.06 0.00 2.18 2.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.87 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 122 A 8.09 3.98 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 0.00 123 W 8.25 4.37 0.00 3.61 3.44 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 0.00 124 I 7.56 4.50 1.95 0.00 0.00 0.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.38 0.87 1.05 0.00 0.00 125 R 7.54 4.01 0.00 1.85 1.91 0.00 3.27 0.00 0.00 3.17 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.57 0.00 126 G 8.92 4.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 127 C 7.71 4.42 0.00 3.08 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 0.00 128 R 8.47 4.28 0.00 1.81 1.90 0.00 3.18 0.00 0.00 3.23 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.65 0.00 129 L 8.42 4.32 0.00 1.63 1.56 0.96 0.92 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.83 0.00 0.00 0.00 0.00 0.00 0.00