NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 3 K 4.4031 8.3144 122.0589 56.4897 33.6347 175.3919 4 C 4.5678 9.4479 127.9177 54.7410 44.2745 170.9847 5 S 4.8337 9.2797 122.1685 56.8765 63.3732 173.3875 6 L 4.0948 8.5080 127.7260 57.1142 42.4285 177.2368 7 T 3.8244 7.3976 114.6832 62.7473 68.6490 174.2966 8 G 3.9827 7.4790 113.5341 44.0527 0.0000 170.7752 9 K 4.7888 7.5274 118.9223 54.8798 34.0541 176.3828 10 W 5.5258 9.1565 123.3770 55.5083 34.0440 173.8217 11 T 5.4307 9.0889 114.5206 61.1944 70.9218 171.8286 12 N 5.7190 8.9628 122.3822 49.7722 40.3159 173.8389 13 D 4.5261 8.8241 117.4111 56.6728 39.2739 178.0614 14 L 4.0133 7.8956 118.2801 55.9681 41.7620 177.8595 15 G 4.1364 8.2557 105.8782 45.0252 0.0000 173.8849 16 S 4.6443 8.2734 115.6334 58.2232 64.6205 172.7633 17 N 5.7268 8.8023 119.3913 51.9017 41.9585 173.5859 18 M 4.9920 8.8605 118.2533 54.1603 35.4353 173.6962 19 T 5.0169 8.7548 117.8514 62.0380 71.7474 173.1005 20 I 4.5008 8.7879 127.5222 59.2962 39.9185 175.3325 21 G 4.4023 7.8193 111.0806 45.8363 0.0000 174.0145 22 A 4.1423 8.6101 128.7658 51.9353 18.6701 177.5445 23 V 4.2340 7.7058 117.6514 60.5835 31.8402 176.3783 24 N 4.6455 9.3538 123.7909 52.0032 38.0621 176.1812 25 S 4.0766 8.7922 113.3813 61.9798 62.5948 176.0529 26 R 4.0931 8.0230 115.7370 56.1060 29.6555 177.5451 27 G 4.0145 8.8268 107.8052 45.4259 0.0000 173.6327 28 E 4.5337 8.4384 120.1760 56.1049 31.0264 175.6504 29 F 5.2609 7.8531 115.4760 56.2482 41.4282 172.9417 30 T 4.9195 8.5852 115.6041 62.4026 72.9369 173.4588 31 G 4.7686 8.8461 110.2952 46.4615 0.0000 171.3908 32 T 5.1567 8.3839 108.4551 59.8844 72.4753 172.4058 33 Y 4.5846 9.0141 123.9382 56.3242 41.9825 174.2800 34 T 4.9295 8.6226 124.4134 61.5448 69.7540 173.2658 35 T 4.3584 8.8934 119.6960 62.0902 68.2287 173.9269 36 A 4.6710 8.5130 129.4535 51.7689 19.6109 177.0655 37 V 4.5176 7.2148 113.6593 60.9478 34.4663 173.8868 38 T 4.4822 7.9402 114.7613 60.5751 70.2799 173.6580 39 A 4.1256 8.4273 129.5777 54.0114 19.0919 177.5865 40 T 4.4982 7.1527 110.1034 60.3793 68.7262 174.8990 41 S 4.2016 8.5293 121.1646 60.2800 62.7558 174.0775 42 N 4.3960 7.8631 117.3849 53.5436 38.9239 173.7400 43 E 4.1077 8.4684 120.6730 55.2651 30.3637 176.5793 44 I 2.0000 7.7595 127.1217 60.8534 37.7503 175.3237 45 K 4.6241 7.7778 123.8085 54.1523 35.3060 175.3227 46 E 4.4666 8.9403 126.2882 57.1813 30.1600 176.0195 47 S 4.9206 9.2703 121.2176 55.8376 67.7314 171.8862 48 P 4.7323 0.0000 0.0000 62.9770 32.7833 174.9880 49 L 4.9747 8.4105 123.7348 53.7482 45.5058 175.0055 50 H 5.0806 9.1231 122.2136 54.3557 31.4420 172.0538 51 G 4.5534 7.4569 114.1124 46.3914 0.0000 169.8300 52 T 4.1026 7.6114 110.4767 61.0752 71.5500 173.0822 53 E 5.3547 9.0491 127.5860 54.3313 31.4536 175.4123 54 N 4.5412 9.2237 123.9051 53.6170 39.7336 174.5092 55 T 4.6957 8.2636 114.3040 61.3759 69.6069 175.9681 56 I 3.7663 8.1144 123.3586 65.1992 37.2317 178.5707 57 N 4.9769 7.8091 115.9055 54.0899 39.2576 174.5546 58 K 3.8501 7.7086 112.5131 56.6211 30.4845 176.2164 59 R 3.9748 8.0166 116.4216 56.9550 30.7971 178.3994 60 T 3.9917 8.7588 112.8621 64.0994 69.3948 173.5330 61 Q 5.1055 7.3538 117.6205 52.5061 27.8032 173.6740 62 P 4.6065 0.0000 0.0000 62.6269 34.0133 175.8959 63 T 4.8385 8.3261 114.5313 60.8045 69.6540 172.9730 64 F 5.4489 7.7495 120.4131 56.1652 42.4436 173.0551 65 G 4.4554 9.1309 103.9216 45.3835 0.0000 172.5892 66 F 5.6636 9.0413 118.6538 55.4164 42.6225 173.4085 67 T 5.0287 8.9252 116.0391 61.8737 71.5793 173.3587 68 V 4.0958 8.6670 127.4333 61.8288 32.8565 174.5490 69 N 4.3934 8.1125 128.3930 51.1885 37.9052 172.9687 70 W 4.3566 7.3413 120.8375 56.9854 29.3587 176.2011 71 K 4.3727 9.4735 124.2550 56.8929 32.1794 177.2992 72 F 4.9940 7.6306 113.1187 55.8915 38.0843 174.5282 73 S 4.4749 7.3608 113.7591 58.6386 64.9198 173.7279 74 E 4.4845 8.6410 117.9503 56.3954 27.9901 176.2120 75 S 5.0553 7.7312 114.1593 57.2410 66.4429 172.6085 76 T 5.0912 8.7188 115.4871 62.2409 72.9174 173.4205 77 T 5.2082 8.5920 120.4450 61.8760 72.4693 173.2738 78 V 4.8963 8.5656 118.5169 59.6107 34.9383 174.5225 79 F 5.2815 8.9275 123.8912 56.0723 41.5867 174.9030 80 T 4.7148 8.7554 118.7919 61.8592 72.2838 173.4370 81 G 4.4258 7.2785 109.9947 47.3401 0.0000 171.7788 82 Q 4.6082 7.7928 121.0563 55.0932 32.4130 175.0505 83 C 4.8258 9.1187 126.5033 56.4813 43.0799 172.2459 84 F 5.2026 9.2093 125.4226 56.0673 41.9812 175.2255 85 I 4.7583 8.7411 122.7129 58.8689 37.0357 174.0786 86 D 4.3523 9.0362 124.9710 53.4273 42.3130 177.9335 87 R 4.1840 8.9431 125.5535 59.6059 30.0641 177.8227 88 N 4.3526 8.1979 113.0546 54.0234 37.2079 175.5926 89 G 4.1002 9.0037 107.7770 44.8669 0.0000 173.2986 90 K 4.6616 8.5004 119.3604 55.0561 35.8581 174.9311 91 E 5.2295 8.6712 120.5149 55.4954 30.8032 176.4159 92 V 4.8870 9.2683 123.8287 60.0126 35.1811 174.3406 93 L 5.0832 9.5219 124.6247 53.3171 43.7203 175.4408 94 K 5.0884 8.8669 124.7575 55.1777 33.7144 175.9937 95 T 5.3355 8.8814 114.0544 60.4844 73.2748 172.5587 96 M 5.0691 9.1430 120.3676 53.4887 36.5249 174.5966 97 W 5.2259 8.3188 119.2268 54.6305 32.4538 174.3079 98 L 5.0317 8.8577 119.8960 53.0482 44.7726 175.5894 99 L 4.7671 9.1531 127.6839 54.0213 43.5827 175.1366 100 R 4.9431 9.0981 128.3774 55.0907 31.5315 175.2971 101 S 5.0835 8.8332 123.3202 57.0297 65.2599 173.9331 102 S 4.5687 8.4415 117.1759 57.5087 63.6991 174.2323 103 V 4.2254 8.2385 118.1119 59.9177 33.0499 176.0339 104 N 4.5368 8.5555 119.3832 55.1710 39.1604 175.3507 105 D 4.8735 7.6713 116.4480 51.9012 43.8540 175.8324 106 I 3.8470 8.4289 125.0809 63.0002 38.1291 176.9870 107 G 3.9921 8.0631 107.6916 46.9421 0.0000 173.8500 108 D 4.9131 8.1575 118.9300 53.5971 42.4558 177.2533 109 D 4.3658 7.8135 119.7963 56.9354 41.2963 178.4115 110 W 4.3954 8.4153 115.2678 58.6062 27.8580 176.6528 111 K 4.1035 6.7237 115.1926 56.1713 31.9826 176.7325 112 A 4.1142 7.9343 122.9767 53.8701 18.8731 177.5166 113 T 5.0853 7.6705 112.5762 61.7741 70.7037 174.1974 114 R 4.8743 8.9258 125.3660 54.6246 33.5629 175.4214 115 V 4.4004 7.7906 118.8445 60.6521 34.6947 174.5586 116 G 3.2064 6.2912 108.2033 45.6329 0.0000 171.4263 117 I 5.0414 7.7585 119.0612 59.5653 41.6486 175.5935 118 N 4.7935 8.6230 119.6282 52.8778 43.4854 173.8860 119 I 4.8937 8.8237 126.4995 60.0618 38.8896 175.2745 120 F 5.4534 9.4463 126.8592 57.0579 41.1869 175.3458 121 T 5.2899 9.2617 116.9764 61.7792 73.4873 173.5225 122 R 3.4390 8.6260 123.1022 56.0637 30.5728 176.5364 123 L 4.1557 7.9766 125.9083 55.2613 41.6817 176.6250 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 8.31 4.40 0.00 1.79 1.80 0.00 1.64 0.00 0.00 1.73 0.00 0.00 2.94 0.00 0.00 2.13 0.00 0.00 0.00 0.00 1.34 1.54 7.81 4 C 9.45 4.57 0.00 3.10 3.10 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 5 S 9.28 4.83 0.00 3.94 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 6 L 8.51 4.09 0.00 1.34 1.17 -0.04 0.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.75 0.00 0.00 0.00 0.00 0.00 0.00 7 T 7.40 3.82 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 1.17 0.00 0.00 8 G 7.48 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 9 K 7.53 4.79 0.00 1.53 1.61 0.00 1.55 0.00 0.00 1.74 0.00 0.00 3.02 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.39 1.35 7.81 10 W 9.16 5.53 0.00 3.06 3.15 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 11 T 9.09 5.43 4.39 0.00 0.00 0.00 0.00 0.00 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 0.00 0.00 12 N 8.96 5.72 0.00 2.25 1.44 0.00 0.00 6.94 7.59 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 13 D 8.82 4.53 0.00 2.83 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 7.90 4.01 0.00 1.87 1.82 0.99 1.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.99 0.00 0.00 0.00 0.00 0.00 0.00 15 G 8.26 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 0.00 0.00 0.00 0.00 16 S 8.27 4.64 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 17 N 8.80 5.73 0.00 2.55 2.64 0.00 0.00 6.73 7.20 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 18 M 8.86 4.99 0.00 1.46 1.89 0.00 0.00 0.00 0.00 0.00 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.28 2.15 0.00 19 T 8.75 5.02 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 1.16 0.00 0.00 20 I 8.79 4.50 1.82 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 0.58 0.67 0.32 0.00 0.00 21 G 7.82 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 22 A 8.61 4.14 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 23 V 7.71 4.23 2.39 0.00 0.00 0.00 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 1.03 0.00 0.00 24 N 9.35 4.65 0.00 2.83 2.99 0.00 0.00 6.27 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 25 S 8.79 4.08 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 26 R 8.02 4.09 0.00 1.99 1.99 0.00 3.35 0.00 0.00 3.22 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.62 0.00 27 G 8.83 4.01 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 0.00 0.00 0.00 28 E 8.44 4.53 0.00 1.99 1.78 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 2.24 2.40 0.00 29 F 7.85 5.26 0.00 2.87 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 30 T 8.59 4.92 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 31 G 8.85 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 0.00 0.00 0.00 0.00 32 T 8.38 5.16 4.38 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 1.22 0.00 0.00 33 Y 9.01 4.58 0.00 2.89 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 34 T 8.62 4.93 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 1.23 0.00 0.00 35 T 8.89 4.36 4.83 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 1.33 0.00 0.00 36 A 8.51 4.67 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 37 V 7.21 4.52 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 0.61 0.00 0.00 0.92 0.00 0.00 38 T 7.94 4.48 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 1.24 0.00 0.00 39 A 8.43 4.13 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 40 T 7.15 4.50 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 1.32 0.00 0.00 41 S 8.53 4.20 0.00 3.86 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 42 N 7.86 4.40 0.00 2.96 3.00 0.00 0.00 6.91 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 43 E 8.47 4.11 0.00 1.91 1.81 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 2.21 2.29 0.00 44 I 7.76 2.00 1.58 0.00 0.00 0.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.30 0.73 0.00 0.00 45 K 7.78 4.62 0.00 1.86 1.87 0.00 1.79 0.00 0.00 1.69 0.00 0.00 3.02 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.41 1.54 7.81 46 E 8.94 4.47 0.00 2.08 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 0.00 2.35 2.41 0.00 47 S 9.27 4.92 0.00 3.71 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 48 P 0.00 4.73 0.00 2.05 1.97 0.00 3.68 0.00 0.00 3.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.09 0.00 49 L 8.41 4.97 0.00 1.54 1.38 0.32 0.99 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.93 0.00 0.00 0.00 0.00 0.00 0.00 50 H 9.12 5.08 0.00 3.08 3.14 0.00 5.61 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 7.46 4.55 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 0.00 0.00 0.00 52 T 7.61 4.10 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 1.17 0.00 0.00 53 E 9.05 5.35 0.00 2.30 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 2.53 2.33 0.00 54 N 9.22 4.54 0.00 2.74 2.78 0.00 0.00 7.01 7.25 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 55 T 8.26 4.70 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 1.29 0.00 0.00 56 I 8.11 3.77 1.96 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 1.50 0.81 0.91 0.00 0.00 57 N 7.81 4.98 0.00 2.68 2.80 0.00 0.00 7.12 7.61 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 58 K 7.71 3.85 0.00 1.83 1.85 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.41 1.40 7.81 59 R 8.02 3.97 0.00 1.85 1.90 0.00 3.29 0.00 0.00 3.40 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.59 0.00 60 T 8.76 3.99 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 1.24 0.00 0.00 61 Q 7.35 5.11 0.00 1.99 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.74 6.99 0.00 0.00 0.00 0.00 0.00 2.39 2.16 0.00 62 P 0.00 4.61 0.00 2.20 2.34 0.00 3.70 0.00 0.00 3.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.01 0.00 63 T 8.33 4.84 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 64 F 7.75 5.45 0.00 3.60 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 65 G 9.13 4.46 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 0.00 0.00 0.00 66 F 9.04 5.66 0.00 3.13 3.28 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 67 T 8.93 5.03 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 1.25 0.00 0.00 68 V 8.67 4.10 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 -0.67 0.00 0.00 0.84 0.00 0.00 69 N 8.11 4.39 0.00 2.71 2.64 0.00 0.00 7.28 7.98 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 70 W 7.34 4.36 0.00 3.05 2.54 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 0.00 0.00 0.00 0.00 71 K 9.47 4.37 0.00 1.87 2.00 0.00 1.69 0.00 0.00 1.79 0.00 0.00 3.14 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.49 1.47 7.81 72 F 7.63 4.99 0.00 3.28 3.15 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 73 S 7.36 4.47 0.00 3.79 3.61 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 74 E 8.64 4.48 0.00 1.96 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 2.26 2.27 0.00 75 S 7.73 5.06 0.00 3.96 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 76 T 8.72 5.09 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 1.20 0.00 0.00 77 T 8.59 5.21 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 0.93 0.00 0.00 78 V 8.57 4.90 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 0.77 0.00 0.00 0.97 0.00 0.00 79 F 8.93 5.28 0.00 1.51 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 80 T 8.76 4.71 4.13 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 1.15 0.00 0.00 81 G 7.28 4.43 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 0.00 82 Q 7.79 4.61 0.00 1.81 1.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.12 7.04 0.00 0.00 0.00 0.00 0.00 1.70 2.24 0.00 83 C 9.12 4.83 0.00 3.14 3.00 0.00 0.00 0.00 0.00 0.00 0.00 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 9.21 5.20 0.00 3.19 2.83 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 85 I 8.74 4.76 1.97 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 1.23 0.71 1.02 0.00 0.00 86 D 9.04 4.35 0.00 2.77 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 87 R 8.94 4.18 0.00 1.84 2.03 0.00 3.26 0.00 0.00 3.26 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.66 0.00 88 N 8.20 4.35 0.00 2.84 2.97 0.00 0.00 7.30 7.02 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 89 G 9.00 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 0.00 0.00 0.00 90 K 8.50 4.66 0.00 1.90 1.96 0.00 1.36 0.00 0.00 1.70 0.00 0.00 2.97 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.37 1.59 7.81 91 E 8.67 5.23 0.00 2.01 2.27 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 2.42 2.39 0.00 92 V 9.27 4.89 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 0.99 0.00 0.00 1.10 0.00 0.00 93 L 9.52 5.08 0.00 1.88 1.83 -0.27 0.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.22 0.00 0.00 0.00 0.00 0.00 0.00 94 K 8.87 5.09 0.00 2.03 1.94 0.00 1.81 0.00 0.00 1.81 0.00 0.00 2.99 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.91 1.71 7.81 95 T 8.88 5.34 4.68 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 1.64 0.00 0.00 96 M 9.14 5.07 0.00 1.75 1.86 0.00 0.00 0.00 0.00 0.00 2.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.46 2.56 0.00 97 W 8.32 5.23 0.00 2.62 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 0.00 0.00 0.00 0.00 98 L 8.86 5.03 0.00 1.57 1.61 0.90 0.86 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 99 L 9.15 4.77 0.00 1.90 1.80 0.85 0.41 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 0.00 100 R 9.10 4.94 0.00 1.97 1.94 0.00 3.18 0.00 0.00 3.17 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.64 0.00 101 S 8.83 5.08 0.00 3.72 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 0.00 102 S 8.44 4.57 0.00 3.85 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 0.00 103 V 8.24 4.23 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 0.98 0.00 0.00 104 N 8.56 4.54 0.00 2.71 2.87 0.00 0.00 6.65 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 7.67 4.87 0.00 2.70 2.45 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 0.00 106 I 8.43 3.85 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 1.38 1.21 0.93 0.00 0.00 107 G 8.06 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 0.00 108 D 8.16 4.91 0.00 2.93 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 0.00 109 D 7.81 4.37 0.00 2.80 2.83 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 0.00 110 W 8.42 4.40 0.00 3.56 3.23 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 0.00 111 K 6.72 4.10 0.00 1.29 0.88 0.00 1.06 0.00 0.00 1.20 0.00 0.00 2.75 0.00 0.00 2.80 0.00 0.00 0.00 0.00 0.30 0.21 7.81 112 A 7.93 4.11 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 0.00 113 T 7.67 5.09 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 1.22 0.00 0.00 114 R 8.93 4.87 0.00 1.94 2.02 0.00 3.12 0.00 0.00 3.33 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.57 0.00 115 V 7.79 4.40 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 0.50 0.00 0.00 0.66 0.00 0.00 116 G 6.29 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 0.00 0.00 0.00 117 I 7.76 5.04 1.80 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 1.63 0.97 0.96 0.00 0.00 118 N 8.62 4.79 0.00 3.22 2.80 0.00 0.00 7.32 6.63 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 0.00 119 I 8.82 4.89 1.94 0.00 0.00 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.31 1.05 0.00 0.00 120 F 9.45 5.45 0.00 2.96 3.02 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 0.00 121 T 9.26 5.29 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 1.29 0.00 0.00 122 R 8.63 3.44 0.00 1.46 1.57 0.00 2.96 0.00 0.00 2.55 7.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 1.11 0.00 123 L 7.98 4.16 0.00 1.72 1.52 0.96 0.88 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