NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4005 8.2893 120.3507 55.3562 33.3639 174.6577 2 E 4.5029 8.5450 124.2116 54.9060 31.8754 174.4462 3 A 4.4236 8.7410 123.3300 49.9588 21.4260 176.6211 4 K 4.5843 8.5072 121.9974 57.2172 33.7559 176.2086 5 A 4.6508 8.6685 126.4847 50.8600 22.9247 175.1904 6 I 5.0165 8.4780 122.7373 59.3363 40.7359 174.6825 7 A 4.8239 9.0282 129.0908 50.1231 21.0239 175.3369 8 R 4.8306 8.6425 118.8062 55.5516 32.3392 175.6196 9 Y 3.5329 8.5768 116.0558 58.6655 35.0676 169.6884 10 V 3.5412 7.8626 120.9259 62.9437 32.4350 176.5997 11 R 4.4640 8.0962 128.8674 56.1700 29.3605 174.8783 12 I 4.7169 7.0815 116.9180 58.9028 41.9272 174.0697 13 S 4.3961 8.3778 118.5690 57.1353 63.0716 172.5141 14 P 4.2176 0.0000 0.0000 66.2058 30.9031 178.6642 15 R 3.8641 8.0219 116.3319 59.1329 29.9099 177.7053 16 K 4.3115 7.8309 116.6973 58.3242 32.9421 178.8757 17 V 3.8706 7.6420 112.3702 64.1744 31.6602 178.2753 18 R 3.9689 8.1923 118.0568 59.5179 29.6862 178.5591 19 L 3.9771 7.9309 116.9941 57.9771 41.9847 179.4721 20 V 3.7131 8.1423 118.1598 66.0241 31.5607 177.8900 21 V 3.5992 7.9133 117.5401 66.5071 31.1732 177.4796 22 D 4.4290 8.5336 118.4747 57.1896 40.3526 178.5541 23 L 4.0803 8.2576 120.7176 56.7520 42.4255 177.1975 24 I 4.4273 7.6850 109.9830 59.8416 38.3740 175.0168 25 R 3.9928 7.5182 122.0989 58.0629 30.0015 176.2313 26 G 3.9956 8.6124 113.5248 46.4958 0.0000 173.3610 27 K 4.5595 7.6389 118.3703 54.0999 34.1752 176.2120 28 S 4.4062 8.6189 115.4122 58.5192 63.6776 174.7561 29 L 3.9214 8.5657 130.8647 58.7339 41.3625 179.2348 30 E 4.0030 8.1922 118.1948 58.9799 29.5269 178.0525 31 E 3.8105 8.6175 120.0053 59.3284 29.8007 177.9712 32 A 3.9164 8.5871 120.7438 55.7951 18.4313 179.7643 33 R 3.8337 8.0075 114.6756 59.4549 30.3804 178.9758 34 N 4.4035 7.8085 115.7024 56.7574 38.5363 177.0695 35 I 3.7278 7.7598 121.1357 64.4155 36.9592 178.0564 36 L 3.9450 8.4371 120.4211 58.1626 41.6828 179.5716 37 R 3.9353 7.8409 117.3200 59.2971 30.0565 178.0646 38 Y 4.6334 7.4682 113.1949 57.1584 39.2391 175.5164 39 T 4.3459 7.1695 116.9611 62.8911 69.4832 175.5507 40 N 4.6191 8.4125 125.3663 51.2013 37.6343 172.5338 41 K 4.1475 7.9553 115.6001 53.8102 36.6113 176.0198 42 R 3.7453 8.6239 124.7107 59.6051 29.5304 178.1910 43 G 3.8142 8.1441 104.7399 47.8051 0.0000 175.3199 44 A 3.9407 8.1806 123.1100 55.1283 18.2932 178.9516 45 Y 3.8843 7.1454 115.1909 60.3532 38.8086 178.2248 46 F 4.7129 7.5852 117.9576 60.3742 39.6393 178.0063 47 V 3.6724 7.7042 117.2848 66.0571 31.1608 176.8023 48 A 4.0411 9.8808 121.6905 52.9797 17.9070 180.5118 49 K 4.4562 7.2829 116.8359 57.8998 34.2109 178.2956 50 V 3.6453 8.2353 120.2288 64.4814 31.4362 178.0899 51 L 3.8597 8.0403 121.2501 57.8366 41.9792 178.3440 52 E 3.8845 8.7101 119.9376 59.5862 29.5653 178.8925 53 S 4.0858 8.0566 112.4903 60.9613 62.4305 175.5557 54 A 3.9434 7.9455 123.5978 55.2596 18.0102 179.4985 55 A 3.8132 7.9199 118.0662 55.2338 18.5524 179.2866 56 A 3.9414 7.8036 119.2763 55.8442 18.1735 179.7052 57 N 4.2915 8.0550 112.7859 56.3229 38.6921 176.8940 58 A 4.1033 7.5463 121.1876 55.2714 18.2010 179.0804 59 V 4.1101 7.8052 115.6277 64.8371 32.3610 177.7227 60 N 5.2647 8.6248 115.8129 53.0765 38.4740 174.9519 61 N 4.4043 7.7080 116.9602 54.2771 43.5926 176.2235 62 H 4.7687 7.6283 113.5659 55.4219 31.4635 175.7274 63 D 3.8861 8.1852 119.6945 54.9358 39.6613 173.7243 64 M 4.3484 8.1006 118.5659 54.7545 33.0145 175.7614 65 L 4.5350 9.5510 122.4039 52.9921 43.0340 176.6976 66 E 3.8330 8.9389 125.3051 59.7568 29.4690 178.6554 67 D 4.5939 8.1543 116.6351 56.5170 41.2359 177.0175 68 R 4.8707 8.6261 116.6603 55.6828 30.9435 174.4908 69 L 6.1220 8.5773 119.4586 54.7053 43.4682 174.6252 70 Y 5.1837 8.3217 117.3608 55.3868 42.3079 174.7160 71 V 4.0059 8.6439 121.3605 62.3474 30.0914 176.2303 72 K 3.3699 8.1423 126.7178 58.2591 32.1541 175.9353 73 A 4.8373 7.4643 119.5127 50.5556 22.9870 173.7375 74 A 4.6265 8.0381 119.2442 51.6067 22.4326 174.7217 75 Y 4.8551 8.2757 117.1898 56.6546 41.9366 173.2644 76 V 5.1328 8.5095 118.1623 60.2864 34.5402 174.3857 77 D 4.9980 8.6991 122.6580 52.1950 44.3306 174.9472 78 E 4.2145 8.7171 123.0717 56.2067 30.1992 176.4324 79 G 3.8651 8.3625 115.0000 43.1745 0.0000 171.2938 80 P 4.3004 0.0000 0.0000 63.0806 31.4824 175.9820 81 A 4.5480 8.3262 123.3110 51.2371 20.8821 177.1090 82 L 4.4648 8.6707 120.5208 53.0515 42.3082 176.0651 83 K 4.6968 8.4546 123.6438 56.3994 32.6776 176.9107 84 R 4.7582 9.0783 122.9918 54.5045 34.5494 175.4410 85 V 4.4954 8.3325 115.0865 61.1797 33.7221 176.3429 86 L 4.4226 8.5337 124.3116 53.4265 44.0820 171.9912 87 P 4.6640 0.0000 0.0000 62.9014 31.5576 175.6948 88 R 4.7772 8.6360 123.6252 53.7206 33.6661 174.7954 89 A 4.2270 8.4486 124.9433 53.4411 18.8699 177.3958 90 R 3.8206 9.1698 117.8767 57.3715 27.4142 176.8376 91 G 4.3350 8.1086 110.0029 45.4774 0.0000 175.2780 92 R 4.1019 7.7632 115.6542 56.4079 30.2784 175.1472 93 A 5.0422 8.4440 121.1071 50.4356 22.2753 174.9561 94 D 5.1606 8.8878 120.7142 52.3922 44.6572 175.1188 95 I 4.9994 8.2245 113.2674 59.3050 40.0793 174.6425 96 I 4.3934 9.3895 127.6243 59.5765 39.4122 174.9247 97 K 4.4811 8.6482 127.0197 55.2914 32.6677 177.1582 98 K 4.3020 8.6633 127.0149 55.5181 32.2122 177.4600 99 R 4.6129 8.3122 124.4470 56.0063 31.8503 175.5586 100 T 4.9073 7.9162 110.8996 61.2744 71.1250 172.5149 101 S 5.0782 9.8280 123.5707 57.1808 67.7850 172.9216 102 H 5.2183 9.0843 119.4844 54.1345 30.1713 172.3159 103 I 4.5849 8.6796 124.2950 60.9915 38.8753 175.2426 104 T 4.9781 9.0987 122.8267 62.1254 72.8606 173.0505 105 V 4.6414 8.6451 126.3703 60.8901 35.2076 174.3527 106 I 4.9790 8.7151 119.1371 59.4028 40.6661 174.5475 107 L 4.7409 8.7473 127.0494 53.7723 43.8083 175.8617 108 G 4.5071 8.3174 106.7583 44.4311 0.0000 172.0065 109 E 4.3502 8.7816 120.8682 56.0907 30.3556 176.5877 110 K 3.8349 9.3877 125.4592 57.7973 31.2400 179.4060 111 H 4.4810 7.1297 122.4063 54.0620 31.4268 174.0127 112 G 3.7988 8.7549 107.1452 46.2845 0.0000 172.4115 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 M 8.29 4.40 0.00 2.00 2.05 0.00 0.00 0.00 0.00 0.00 -0.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.43 2.52 0.00 2 E 8.54 4.50 0.00 2.01 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 2.19 2.32 0.00 3 A 8.74 4.42 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 4 K 8.51 4.58 0.00 1.74 1.68 0.00 1.78 0.00 0.00 1.72 0.00 0.00 2.88 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.40 7.81 5 A 8.67 4.65 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 6 I 8.48 5.02 1.89 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 1.32 0.72 1.00 0.00 0.00 7 A 9.03 4.82 1.21 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 0.00 0.00 8 R 8.64 4.83 0.00 1.51 1.64 0.00 3.18 0.00 0.00 3.50 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.78 0.00 9 Y 8.58 3.53 0.00 3.20 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 10 V 7.86 3.54 1.91 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 0.14 0.00 0.00 0.93 0.00 0.00 11 R 8.10 4.46 0.00 1.78 1.88 0.00 3.41 0.00 0.00 3.17 7.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.56 0.00 12 I 7.08 4.72 2.33 0.00 0.00 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.23 1.06 0.00 0.00 13 S 8.38 4.40 0.00 3.91 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 14 P 0.00 4.22 0.00 2.18 2.07 0.00 3.67 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 2.41 2.24 0.00 15 R 8.02 3.86 0.00 1.80 2.00 0.00 3.23 0.00 0.00 3.23 7.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.75 0.00 16 K 7.83 4.31 0.00 2.03 1.87 0.00 1.77 0.00 0.00 1.73 0.00 0.00 3.08 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.43 1.48 7.81 17 V 7.64 3.87 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 1.08 0.00 0.00 18 R 8.19 3.97 0.00 1.86 2.05 0.00 3.15 0.00 0.00 3.18 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.69 1.86 0.00 19 L 7.93 3.98 0.00 1.80 1.76 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 20 V 8.14 3.71 2.19 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 0.92 0.00 0.00 0.90 0.00 0.00 21 V 7.91 3.60 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 1.03 0.00 0.00 0.96 0.00 0.00 22 D 8.53 4.43 0.00 3.04 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 23 L 8.26 4.08 0.00 1.71 1.71 0.93 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 0.00 0.00 0.00 0.00 0.00 0.00 24 I 7.69 4.43 1.87 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.56 0.92 0.00 0.00 25 R 7.52 3.99 0.00 1.93 1.91 0.00 3.38 0.00 0.00 3.25 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.58 0.00 26 G 8.61 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 27 K 7.64 4.56 0.00 2.13 1.76 0.00 1.61 0.00 0.00 1.73 0.00 0.00 2.99 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.41 1.78 7.81 28 S 8.62 4.41 0.00 3.93 3.96 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 29 L 8.57 3.92 0.00 1.83 1.78 0.91 0.83 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 30 E 8.19 4.00 0.00 2.09 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 0.00 2.39 2.38 0.00 31 E 8.62 3.81 0.00 2.05 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 2.33 2.34 0.00 32 A 8.59 3.92 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 33 R 8.01 3.83 0.00 1.84 2.01 0.00 3.35 0.00 0.00 3.17 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.72 0.00 34 N 7.81 4.40 0.00 2.95 2.94 0.00 0.00 7.03 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 35 I 7.76 3.73 1.99 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 1.56 1.59 0.94 0.00 0.00 36 L 8.44 3.94 0.00 1.53 1.74 0.93 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 37 R 7.84 3.94 0.00 1.72 2.08 0.00 2.77 0.00 0.00 2.96 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.06 0.75 0.00 38 Y 7.47 4.63 0.00 3.06 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 39 T 7.17 4.35 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 1.22 0.00 0.00 40 N 8.41 4.62 0.00 2.68 2.76 0.00 0.00 6.98 6.68 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 41 K 7.96 4.15 0.00 1.74 1.68 0.00 1.77 0.00 0.00 1.74 0.00 0.00 2.83 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.32 1.25 7.81 42 R 8.62 3.75 0.00 1.79 1.90 0.00 3.14 0.00 0.00 3.33 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.46 0.00 43 G 8.14 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 44 A 8.18 3.94 1.32 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 0.00 0.00 0.00 0.00 0.00 0.00 45 Y 7.15 3.88 0.00 2.91 2.65 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 0.00 0.00 0.00 0.00 46 F 7.59 4.71 0.00 3.25 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 47 V 7.70 3.67 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 1.09 0.00 0.00 1.03 0.00 0.00 48 A 9.88 4.04 1.22 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 0.00 0.00 49 K 7.28 4.46 0.00 1.62 1.80 0.00 1.55 0.00 0.00 1.83 0.00 0.00 2.75 0.00 0.00 2.29 0.00 0.00 0.00 0.00 1.42 1.44 7.81 50 V 8.24 3.65 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 0.75 0.00 0.00 0.98 0.00 0.00 51 L 8.04 3.86 0.00 1.82 1.99 0.89 0.81 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 52 E 8.71 3.88 0.00 2.02 1.89 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 2.28 2.35 0.00 53 S 8.06 4.09 0.00 3.95 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 54 A 7.95 3.94 1.36 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 55 A 7.92 3.81 1.36 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 56 A 7.80 3.94 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 57 N 8.05 4.29 0.00 2.75 2.95 0.00 0.00 7.06 6.80 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 58 A 7.55 4.10 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 59 V 7.81 4.11 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 1.04 0.00 0.00 0.99 0.00 0.00 60 N 8.62 5.26 0.00 2.67 2.80 0.00 0.00 7.05 7.89 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 61 N 7.71 4.40 0.00 2.67 2.63 0.00 0.00 6.97 8.16 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 62 H 7.63 4.77 0.00 3.37 3.22 0.00 5.96 0.00 0.00 0.00 0.00 7.07 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 63 D 8.19 3.89 0.00 2.95 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 64 M 8.10 4.35 0.00 1.96 2.18 0.00 0.00 0.00 0.00 0.00 2.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.87 2.54 0.00 65 L 9.55 4.53 0.00 1.75 1.59 0.92 0.75 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 66 E 8.94 3.83 0.00 1.99 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 0.00 2.39 2.38 0.00 67 D 8.15 4.59 0.00 2.70 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 68 R 8.63 4.87 0.00 1.72 2.02 0.00 2.70 0.00 0.00 3.20 7.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.59 0.00 69 L 8.58 6.12 0.00 1.80 1.87 0.98 0.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 70 Y 8.32 5.18 0.00 3.25 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 71 V 8.64 4.01 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 0.78 0.00 0.00 0.88 0.00 0.00 72 K 8.14 3.37 0.00 1.24 1.68 0.00 1.77 0.00 0.00 1.60 0.00 0.00 2.94 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.36 1.34 7.81 73 A 7.46 4.84 1.13 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 74 A 8.04 4.63 1.07 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 75 Y 8.28 4.86 0.00 2.89 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 76 V 8.51 5.13 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 0.83 0.00 0.00 0.96 0.00 0.00 77 D 8.70 5.00 0.00 2.56 2.47 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 78 E 8.72 4.21 0.00 1.90 1.79 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 2.23 2.30 0.00 79 G 8.36 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 0.00 0.00 0.00 80 P 0.00 4.30 0.00 2.24 2.13 0.00 3.57 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 2.11 2.16 0.00 81 A 8.33 4.55 1.23 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 0.00 0.00 0.00 82 L 8.67 4.46 0.00 1.76 1.65 0.95 0.73 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 0.00 0.00 0.00 0.00 0.00 0.00 83 K 8.45 4.70 0.00 1.64 1.75 0.00 1.69 0.00 0.00 1.71 0.00 0.00 2.96 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.45 1.48 7.81 84 R 9.08 4.76 0.00 1.66 1.76 0.00 3.28 0.00 0.00 3.26 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.73 0.00 85 V 8.33 4.50 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 0.65 0.00 0.00 0.93 0.00 0.00 86 L 8.53 4.42 0.00 1.75 1.67 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.00 0.00 0.00 0.00 0.00 0.00 87 P 0.00 4.66 0.00 2.09 2.06 0.00 3.50 0.00 0.00 3.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 2.09 0.00 88 R 8.64 4.78 0.00 2.10 1.89 0.00 3.14 0.00 0.00 3.28 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 89 A 8.45 4.23 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 90 R 9.17 3.82 0.00 1.99 2.07 0.00 3.21 0.00 0.00 3.23 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.61 0.00 91 G 8.11 4.33 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 0.00 92 R 7.76 4.10 0.00 1.89 2.11 0.00 2.91 0.00 0.00 3.34 7.21 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.87 1.68 0.00 93 A 8.44 5.04 1.19 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 94 D 8.89 5.16 0.00 2.64 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 95 I 8.22 5.00 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 1.35 0.67 0.91 0.00 0.00 96 I 9.39 4.39 1.87 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 1.23 0.79 0.92 0.00 0.00 97 K 8.65 4.48 0.00 1.64 1.78 0.00 1.74 0.00 0.00 1.70 0.00 0.00 2.95 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.40 1.46 7.81 98 K 8.66 4.30 0.00 1.92 1.79 0.00 1.66 0.00 0.00 1.66 0.00 0.00 2.82 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.45 1.43 7.81 99 R 8.31 4.61 0.00 1.70 2.03 0.00 3.21 0.00 0.00 3.57 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.78 0.00 100 T 7.92 4.91 4.32 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 0.00 0.00 0.00 1.17 0.00 0.00 101 S 9.83 5.08 0.00 3.64 3.68 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 0.00 102 H 9.08 5.22 0.00 2.96 3.15 0.00 5.63 0.00 0.00 0.00 0.00 6.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 103 I 8.68 4.58 1.91 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 1.29 0.63 0.95 0.00 0.00 104 T 9.10 4.98 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 0.75 0.00 0.00 105 V 8.65 4.64 1.97 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 0.90 0.00 0.00 0.90 0.00 0.00 106 I 8.72 4.98 1.74 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.25 0.42 0.76 0.00 0.00 107 L 8.75 4.74 0.00 1.51 1.53 0.79 0.46 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 0.00 108 G 8.32 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 0.00 0.00 0.00 0.00 109 E 8.78 4.35 0.00 1.98 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 0.00 2.42 2.33 0.00 110 K 9.39 3.83 0.00 1.68 1.38 0.00 0.94 0.00 0.00 1.34 0.00 0.00 2.85 0.00 0.00 2.84 0.00 0.00 0.00 0.00 1.25 1.22 7.81 111 H 7.13 4.48 0.00 3.20 2.87 0.00 5.63 0.00 0.00 0.00 0.00 7.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 112 G 8.75 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