NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.4523 8.3049 120.3992 55.8233 33.3246 177.2621 2 S 4.2102 8.3861 105.2611 55.2200 63.6690 173.8886 3 F 4.7059 6.4936 115.3774 55.5505 38.7589 176.5951 4 V 3.6225 7.3033 119.3824 64.2995 31.6916 173.9477 5 I 4.1482 7.3347 122.8198 62.1714 38.2177 176.8426 6 E 4.4965 7.7213 125.2083 54.3874 30.3972 178.0088 7 K 3.8687 8.8350 117.7105 59.0400 31.8364 179.1850 8 E 3.9204 9.1399 128.6756 59.3577 30.4768 178.0325 9 S 4.5859 8.1349 112.4094 59.3555 64.8941 175.5468 10 D 4.8338 9.2395 118.1770 53.8543 40.3027 174.9958 11 F 5.0863 8.1339 117.7196 56.7514 42.4231 174.1502 12 K 4.1239 6.4409 123.2566 54.1569 33.2666 175.6064 13 Y 3.9877 8.4586 122.0894 60.2729 37.9925 177.8514 14 I 4.8077 7.3672 117.4491 58.5547 40.0119 174.2413 15 H 4.9097 8.6610 121.4379 54.0207 32.0314 173.0389 16 R 4.8686 8.4281 121.0920 54.9371 31.4725 175.4294 17 I 4.4261 8.6735 126.0459 61.1261 41.8214 175.1457 18 L 3.7122 9.5056 119.1228 56.6914 39.7591 176.0413 19 N 4.2006 8.2574 127.1752 55.1508 38.2415 174.9828 20 T 4.2343 9.0382 110.1585 64.0443 69.0227 174.7828 21 N 4.6775 7.8236 121.3673 53.1010 37.8479 173.9867 22 I 4.6675 8.0458 123.6820 60.5024 38.5934 174.7761 23 D 5.0181 8.4633 124.0606 52.4884 43.9884 175.8973 24 G 3.8322 8.5939 110.8579 44.3321 0.0000 173.6855 25 K 4.3155 8.3142 123.8526 55.4283 31.6617 175.1110 26 R 4.6453 7.5691 126.0428 54.7250 37.5834 174.3944 27 I 4.8408 7.5636 115.5343 57.6382 42.8097 175.6201 28 T 3.8039 8.0462 115.1016 64.7216 68.2871 174.7088 29 P 4.1898 0.0000 0.0000 65.1096 31.7589 178.1607 30 I 3.8851 7.9207 117.5501 64.4860 36.9164 177.9570 31 A 4.0124 8.4085 121.8746 55.4307 18.0992 179.5370 32 L 3.8994 7.9108 117.0287 58.3503 41.4480 179.6374 33 T 4.3843 7.3012 116.2967 65.9482 68.4130 176.2055 34 G 3.7967 7.6870 106.6678 46.2269 0.0000 174.2297 35 I 4.6875 7.7203 123.0552 60.9707 37.6766 176.6440 36 R 4.6694 8.8360 125.5620 54.2930 27.3598 177.3438 37 G 5.0486 7.5154 121.8375 46.2329 0.0000 170.4491 38 I 4.7461 7.1909 120.4473 59.7131 39.3952 174.7563 39 G 4.1900 8.6078 110.3714 44.9316 0.0000 174.9180 40 R 3.2547 7.1173 114.2410 57.4715 31.2926 178.4413 41 R 4.0550 7.7302 117.5399 58.5170 30.5441 178.5480 42 F 4.6099 8.7934 121.0917 61.1602 39.4434 176.8230 43 A 3.9730 8.1984 120.2052 55.5207 18.0549 178.9421 44 Y 3.9180 7.6107 110.6378 61.1859 38.1440 178.8032 45 I 3.9161 7.7564 120.6830 64.5353 37.2856 178.0979 46 I 3.5687 7.6937 120.5146 65.0623 37.1528 178.2184 47 C 4.0788 7.9019 116.3155 62.5620 27.6087 176.2503 48 K 4.0807 7.9295 119.4843 58.6890 31.7275 179.3326 49 V 3.7860 7.4856 117.6853 65.6794 31.7215 177.0452 50 L 4.4074 7.7363 115.6209 53.4244 41.5329 176.4754 51 K 3.9165 7.8611 115.7326 57.0826 29.9488 174.8236 52 I 4.0446 7.2232 117.9421 60.5723 37.7604 175.8701 53 D 4.4049 8.4344 124.3649 53.9635 41.2104 174.4496 54 P 4.2592 0.0000 0.0000 65.1131 32.2174 177.8230 55 N 4.1800 8.1510 116.9603 55.4148 38.4137 175.6883 56 A 4.0869 7.4356 117.7568 51.7774 19.7535 178.4059 57 R 4.7731 8.5849 118.2758 55.9464 30.8064 175.1122 58 A 4.6183 8.7103 120.5767 51.9464 19.4080 177.5824 59 G 3.9092 9.2326 109.9721 45.3847 0.0000 173.7039 60 L 4.9078 7.5595 118.1042 54.7031 42.2587 176.3584 61 L 4.6561 7.6762 118.2103 52.2019 44.8079 177.4756 62 T 4.1756 8.3667 114.5262 61.4538 70.8402 174.6797 63 E 4.0255 8.7050 119.3759 59.3155 29.1548 179.1425 64 D 4.2984 8.0321 117.9561 57.5171 41.5187 178.0964 65 Q 3.9646 7.9531 118.0166 59.0477 28.8072 178.5492 66 C 4.1922 8.0707 117.8062 62.9483 28.2383 175.9254 67 N 4.3664 8.7181 118.4580 56.1280 37.8621 177.3497 68 K 3.9053 8.2491 120.1656 59.8000 32.1406 179.1030 69 I 3.7779 7.2381 118.6629 64.2864 37.0472 178.3789 70 T 3.8656 7.5097 115.5338 66.4886 68.6941 175.8281 71 D 4.5673 8.2559 120.5108 55.4830 39.8874 178.3391 72 L 3.8648 7.5093 121.8435 58.0516 41.7208 178.7801 73 I 3.9527 7.5615 118.3658 63.4271 37.2873 177.7356 74 A 4.2447 7.6155 121.0639 54.4944 19.6719 178.0729 75 D 4.7404 7.7453 115.5519 51.9605 42.5091 173.9471 76 P 4.9868 0.0000 0.0000 65.2575 31.7019 178.7747 77 E 4.4403 8.6596 118.5705 57.8489 29.6664 178.6435 78 A 3.9693 8.0719 121.4624 55.4206 18.4169 178.3965 79 H 4.4286 7.8511 111.3659 57.0765 30.9772 173.5348 80 G 3.8443 8.9671 109.0798 43.4854 0.0000 175.5692 81 I 3.0343 9.0454 126.9797 60.7504 35.5220 171.7566 82 P 4.2667 0.0000 0.0000 62.5849 32.0130 177.9337 83 T 3.8369 8.6577 119.7798 66.5145 68.5714 174.8603 84 W 4.7257 7.9035 116.3786 56.4745 28.1197 176.5113 85 L 4.3462 7.3894 116.6572 54.6757 42.2834 176.8848 86 L 5.0740 6.9233 117.1502 53.6925 42.4666 177.0281 87 N 4.4560 8.8666 118.7020 55.5377 38.7727 175.8093 88 R 4.6483 7.8457 117.3837 54.3537 32.3965 174.5368 89 I 4.7354 7.7953 124.3924 60.6145 40.1780 172.9716 90 N 4.2057 9.0574 127.1991 53.2896 35.8445 172.8889 91 D 4.8395 8.6483 122.0882 52.8697 43.5279 175.8797 92 F 3.7370 9.6742 116.8042 57.5876 36.8344 176.3951 93 K 3.8783 8.3849 118.6673 57.9821 30.8631 174.5707 94 D 4.3723 7.1911 114.9838 55.8282 43.9399 174.6255 95 G 3.8096 5.6975 114.4564 45.3018 0.0000 172.8647 96 K 3.7700 8.2877 124.5188 59.2234 31.8763 176.9444 97 N 5.4988 7.8376 118.7630 52.7681 43.7997 172.9964 98 Y 4.5862 7.9792 116.0507 57.7776 42.6385 175.0650 99 Q 4.4387 8.6681 116.9458 59.5306 29.1927 176.0619 100 M 3.6891 7.0648 114.9621 55.5378 28.6818 177.0433 101 A 4.3822 8.0631 126.1578 50.9486 19.7963 178.4937 102 S 4.8653 8.6678 113.5937 60.8091 62.9759 176.0657 103 N 5.1417 7.9146 118.3832 53.8940 39.0974 177.3507 104 T 3.9293 7.7909 116.8206 66.5200 68.7902 175.6633 105 L 3.8995 8.1468 122.5191 58.6269 41.8737 178.4977 106 D 4.4217 8.2094 117.8563 58.1917 40.7984 179.2678 107 T 3.9971 7.5975 114.0883 65.9839 68.5210 177.0926 108 K 3.8542 8.2327 120.9057 59.8491 32.0128 179.1533 109 M 3.9988 7.9183 118.1586 58.6233 32.1049 178.8989 110 R 3.8944 7.6135 118.1137 59.4075 30.0669 178.7327 111 E 4.1670 8.2310 118.0452 58.9060 29.6049 178.7028 112 D 4.3700 7.9755 119.0977 57.2607 40.9526 178.7753 113 L 4.0195 8.1925 119.5727 57.4030 41.4925 179.1147 114 E 4.0297 7.7577 118.8600 58.9986 29.6674 178.5640 115 R 3.8996 8.1333 119.2540 59.3825 30.0223 178.2663 116 L 4.2948 8.0966 118.3543 56.9269 41.6915 179.1052 117 K 3.8133 8.2928 118.2818 59.5467 32.0513 179.0967 118 K 4.1222 7.6949 117.2808 59.2433 32.1142 179.1414 119 I 3.7816 6.9311 117.7250 63.6515 37.3866 177.6577 120 K 3.8868 8.8166 116.7340 57.8735 29.2188 177.4434 121 S 4.4713 7.8556 112.5445 58.1201 65.4610 172.7495 122 H 4.4876 8.7760 121.4670 59.7376 29.3691 177.0443 123 R 3.9509 8.1342 119.4470 59.5724 29.9365 178.4029 124 G 3.7597 7.9782 104.8050 47.8286 0.0000 175.2222 125 L 4.1526 9.0342 124.8673 57.6846 41.9809 178.8367 126 R 3.8876 8.5589 118.8255 60.0688 29.7285 177.8575 127 H 4.1453 7.8036 114.3341 59.6103 28.8452 176.7227 128 F 3.9957 8.6551 119.9130 61.4168 39.0665 176.2426 129 W 4.5885 8.8663 119.9898 57.8825 30.5603 176.7750 130 G 4.0293 10.1017 106.2020 45.3712 0.0000 172.1047 131 L 4.5533 7.3749 118.5591 53.3257 46.2079 175.8700 132 K 3.8860 8.5285 121.6012 57.3091 32.7610 176.4208 133 V 4.0617 8.2402 119.8310 64.7478 32.8482 177.4115 134 R 4.1337 7.9593 115.7232 58.7102 30.0522 178.3735 135 G 3.6354 8.5031 106.4019 47.1964 0.0000 176.6861 136 Q 2.6350 8.4365 113.5269 58.6076 31.3401 175.0142 137 H 4.0588 8.3215 120.4950 55.9186 28.6942 175.4776 138 T 4.4369 8.2502 120.2430 63.5149 69.6870 175.8362 139 K 4.0084 7.8610 120.7348 59.3029 32.5104 177.9157 140 T 4.1724 7.7328 114.7584 65.4863 69.4309 175.4995 141 S 3.8974 8.6424 114.3777 58.2873 63.1566 176.2404 142 G 3.7620 7.0289 110.1110 46.4087 0.0000 174.6668 143 R 4.4586 7.9177 123.2726 55.5544 32.6789 175.4587 144 H 3.8340 8.1218 113.1591 61.6223 25.5752 178.0164 145 G 3.7883 7.7632 100.6867 47.2780 0.0000 176.0392 146 V 3.8744 7.3703 130.0869 62.6485 33.1282 175.4169 147 V 3.7978 8.2813 120.0873 63.0861 32.3225 177.2046 148 C 4.7525 8.3082 133.7941 58.9168 30.6592 175.2524 149 G 3.9013 8.6107 107.0171 43.7326 0.0000 170.0189 150 V 3.1129 8.3500 123.6435 62.5525 30.6157 171.6590 151 V 4.4315 8.2732 125.9876 60.8675 33.6164 174.7627 152 R 4.6302 8.3358 125.1674 53.9979 32.7642 175.4848 153 K 4.2614 8.5144 123.5933 56.6062 33.1317 176.2932 154 N 4.4892 8.3717 120.4402 53.9170 39.4700 174.4724 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 8.30 4.45 0.00 2.37 1.89 0.00 0.00 0.00 0.00 0.00 -0.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.58 0.00 2 S 8.39 4.21 0.00 3.83 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 3 F 6.49 4.71 0.00 3.10 3.12 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 4 V 7.30 3.62 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 0.86 0.00 0.00 0.73 0.00 0.00 5 I 7.33 4.15 1.92 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 1.39 0.81 0.95 0.00 0.00 6 E 7.72 4.50 0.00 2.18 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 0.00 2.38 2.40 0.00 7 K 8.83 3.87 0.00 1.85 1.48 0.00 1.73 0.00 0.00 1.86 0.00 0.00 2.89 0.00 0.00 3.07 0.00 0.00 0.00 0.00 1.57 1.55 7.81 8 E 9.14 3.92 0.00 1.93 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 2.30 2.41 0.00 9 S 8.13 4.59 0.00 4.00 4.06 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 10 D 9.24 4.83 0.00 2.64 2.84 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 0.00 0.00 0.00 0.00 11 F 8.13 5.09 0.00 2.94 3.01 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 12 K 6.44 4.12 0.00 1.51 1.39 0.00 1.82 0.00 0.00 1.59 0.00 0.00 2.76 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.22 1.27 7.81 13 Y 8.46 3.99 0.00 2.73 3.03 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 14 I 7.37 4.81 1.87 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 1.07 0.90 0.00 0.00 15 H 8.66 4.91 0.00 3.18 3.16 0.00 5.59 0.00 0.00 0.00 0.00 6.74 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 16 R 8.43 4.87 0.00 1.77 1.80 0.00 3.22 0.00 0.00 3.21 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.69 0.00 17 I 8.67 4.43 1.86 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.93 0.89 0.00 0.00 18 L 9.51 3.71 0.00 1.71 1.82 0.92 1.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 0.00 0.00 0.00 0.00 0.00 0.00 19 N 8.26 4.20 0.00 2.83 2.23 0.00 0.00 7.33 7.70 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 20 T 9.04 4.23 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 1.21 0.00 0.00 21 N 7.82 4.68 0.00 2.88 2.78 0.00 0.00 6.97 7.46 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 22 I 8.05 4.67 1.88 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 1.34 0.70 0.92 0.00 0.00 23 D 8.46 5.02 0.00 2.60 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 G 8.59 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 25 K 8.31 4.32 0.00 1.85 1.59 0.00 1.64 0.00 0.00 1.98 0.00 0.00 2.55 0.00 0.00 2.72 0.00 0.00 0.00 0.00 1.25 1.31 7.81 26 R 7.57 4.65 0.00 1.97 1.87 0.00 2.96 0.00 0.00 3.33 7.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.63 0.00 27 I 7.56 4.84 1.88 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 1.66 0.72 0.90 0.00 0.00 28 T 8.05 3.80 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 1.23 0.00 0.00 29 P 0.00 4.19 0.00 2.21 2.16 0.00 3.64 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 1.60 1.92 0.00 30 I 7.92 3.89 2.04 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 1.66 0.96 0.94 0.00 0.00 31 A 8.41 4.01 1.44 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 0.00 0.00 32 L 7.91 3.90 0.00 1.99 1.71 0.93 0.62 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 33 T 7.30 4.38 4.35 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 1.24 0.00 0.00 34 G 7.69 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 35 I 7.72 4.69 1.92 0.00 0.00 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 1.45 0.92 0.00 0.00 36 R 8.84 4.67 0.00 1.89 1.91 0.00 3.36 0.00 0.00 3.35 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.64 0.00 37 G 7.52 5.05 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 0.00 0.00 0.00 38 I 7.19 4.75 1.88 0.00 0.00 0.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.07 1.21 0.90 0.00 0.00 39 G 8.61 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 40 R 7.12 3.25 0.00 1.86 1.81 0.00 3.27 0.00 0.00 3.26 7.69 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.71 1.60 0.00 41 R 7.73 4.05 0.00 1.82 1.91 0.00 3.18 0.00 0.00 3.27 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 1.66 0.00 42 F 8.79 4.61 0.00 3.01 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 43 A 8.20 3.97 1.46 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 44 Y 7.61 3.92 0.00 3.15 3.12 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 45 I 7.76 3.92 2.43 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 1.60 0.89 1.06 0.00 0.00 46 I 7.69 3.57 1.97 0.00 0.00 0.49 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 0.29 0.78 0.00 0.00 47 C 7.90 4.08 0.00 2.86 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 48 K 7.93 4.08 0.00 1.91 1.87 0.00 1.74 0.00 0.00 1.65 0.00 0.00 3.00 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.47 1.44 7.81 49 V 7.49 3.79 2.14 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 0.84 0.00 0.00 0.94 0.00 0.00 50 L 7.74 4.41 0.00 1.60 1.62 0.84 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.80 0.00 0.00 0.00 0.00 0.00 0.00 51 K 7.86 3.92 0.00 1.81 1.82 0.00 1.73 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.36 1.59 7.81 52 I 7.22 4.04 1.81 0.00 0.00 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.54 0.86 0.00 0.00 53 D 8.43 4.40 0.00 2.61 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 54 P 0.00 4.26 0.00 1.83 1.94 0.00 3.65 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.84 0.00 55 N 8.15 4.18 0.00 2.69 2.94 0.00 0.00 6.85 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 56 A 7.44 4.09 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 57 R 8.58 4.77 0.00 1.53 1.79 0.00 3.25 0.00 0.00 4.01 7.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 1.21 0.00 58 A 8.71 4.62 1.28 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 59 G 9.23 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 60 L 7.56 4.91 0.00 1.64 1.69 0.74 0.94 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 61 L 7.68 4.66 0.00 1.50 1.50 0.87 0.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.43 0.00 0.00 0.00 0.00 0.00 0.00 62 T 8.37 4.18 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 1.23 0.00 0.00 63 E 8.70 4.03 0.00 2.03 2.05 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 2.40 2.37 0.00 64 D 8.03 4.30 0.00 2.71 2.66 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 0.00 0.00 0.00 0.00 65 Q 7.95 3.96 0.00 2.23 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.39 6.69 0.00 0.00 0.00 0.00 0.00 2.44 2.36 0.00 66 C 8.07 4.19 0.00 3.05 2.97 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 67 N 8.72 4.37 0.00 2.67 2.86 0.00 0.00 7.04 7.44 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 68 K 8.25 3.91 0.00 1.94 1.84 0.00 1.65 0.00 0.00 1.64 0.00 0.00 3.03 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.72 1.64 7.81 69 I 7.24 3.78 2.00 0.00 0.00 0.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 1.04 0.82 0.00 0.00 70 T 7.51 3.87 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 1.21 0.00 0.00 71 D 8.26 4.57 0.00 2.99 2.93 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 72 L 7.51 3.86 0.00 1.89 1.71 0.76 0.83 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 73 I 7.56 3.95 2.02 0.00 0.00 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.78 0.95 0.00 0.00 74 A 7.62 4.24 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 75 D 7.75 4.74 0.00 2.64 2.51 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 76 P 0.00 4.99 0.00 2.30 2.51 0.00 3.90 0.00 0.00 3.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.12 2.03 0.00 77 E 8.66 4.44 0.00 2.00 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 2.36 2.27 0.00 78 A 8.07 3.97 1.27 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 0.00 0.00 79 H 7.85 4.43 0.00 3.19 3.37 0.00 5.65 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 80 G 8.97 3.84 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 I 9.05 3.03 1.87 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 1.44 0.50 0.85 0.00 0.00 82 P 0.00 4.27 0.00 1.16 1.99 0.00 3.22 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 1.95 2.06 0.00 83 T 8.66 3.84 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 1.26 0.00 0.00 84 W 7.90 4.73 0.00 3.54 3.17 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 85 L 7.39 4.35 0.00 1.15 1.19 0.38 0.24 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 86 L 6.92 5.07 0.00 1.71 1.78 1.01 1.05 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 87 N 8.87 4.46 0.00 2.76 2.89 0.00 0.00 6.70 7.66 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 88 R 7.85 4.65 0.00 1.88 1.83 0.00 3.19 0.00 0.00 3.34 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.67 0.00 89 I 7.80 4.74 1.90 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 1.45 0.78 1.00 0.00 0.00 90 N 9.06 4.21 0.00 2.83 2.82 0.00 0.00 6.86 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 91 D 8.65 4.84 0.00 2.57 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 0.00 0.00 0.00 0.00 92 F 9.67 3.74 0.00 3.24 3.14 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 93 K 8.38 3.88 0.00 1.95 2.03 0.00 1.62 0.00 0.00 1.64 0.00 0.00 3.06 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.33 1.48 7.81 94 D 7.19 4.37 0.00 2.80 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 95 G 5.70 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 96 K 8.29 3.77 0.00 1.62 1.65 0.00 1.57 0.00 0.00 1.77 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.50 1.61 7.81 97 N 7.84 5.50 0.00 2.55 2.67 0.00 0.00 6.67 7.46 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 98 Y 7.98 4.59 0.00 2.79 2.91 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 99 Q 8.67 4.44 0.00 2.20 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.57 6.52 0.00 0.00 0.00 0.00 0.00 2.63 2.68 0.00 100 M 7.06 3.69 0.00 2.13 2.22 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 2.60 2.56 0.00 101 A 8.06 4.38 1.30 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 0.00 0.00 0.00 0.00 0.00 102 S 8.67 4.87 0.00 4.00 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 0.00 103 N 7.91 5.14 0.00 2.76 2.89 0.00 0.00 7.62 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 0.00 104 T 7.79 3.93 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 1.23 0.00 0.00 105 L 8.15 3.90 0.00 1.77 1.88 0.94 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 0.00 0.00 0.00 0.00 0.00 0.00 106 D 8.21 4.42 0.00 2.84 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 0.00 107 T 7.60 4.00 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 1.19 0.00 0.00 108 K 8.23 3.85 0.00 1.90 1.83 0.00 1.52 0.00 0.00 1.54 0.00 0.00 2.80 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.56 1.58 7.81 109 M 7.92 4.00 0.00 2.05 2.22 0.00 0.00 0.00 0.00 0.00 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.98 0.00 110 R 7.61 3.89 0.00 1.98 2.00 0.00 3.15 0.00 0.00 3.16 7.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.87 0.00 111 E 8.23 4.17 0.00 2.18 1.96 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 2.28 2.61 0.00 112 D 7.98 4.37 0.00 2.70 2.71 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 0.00 113 L 8.19 4.02 0.00 1.69 1.72 0.82 0.65 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 0.00 0.00 0.00 0.00 0.00 0.00 114 E 7.76 4.03 0.00 2.34 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 0.00 2.30 2.36 0.00 115 R 8.13 3.90 0.00 2.08 2.19 0.00 3.18 0.00 0.00 3.20 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.70 0.00 116 L 8.10 4.29 0.00 1.77 1.73 0.95 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.76 0.00 0.00 0.00 0.00 0.00 0.00 117 K 8.29 3.81 0.00 1.87 1.89 0.00 1.81 0.00 0.00 1.92 0.00 0.00 3.42 0.00 0.00 3.13 0.00 0.00 0.00 0.00 1.68 1.83 7.81 118 K 7.69 4.12 0.00 1.70 1.85 0.00 1.71 0.00 0.00 1.69 0.00 0.00 3.03 0.00 0.00 3.29 0.00 0.00 0.00 0.00 1.46 1.71 7.81 119 I 6.93 3.78 2.04 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 1.53 0.67 0.95 0.00 0.00 120 K 8.82 3.89 0.00 1.89 2.00 0.00 1.67 0.00 0.00 1.72 0.00 0.00 2.90 0.00 0.00 2.80 0.00 0.00 0.00 0.00 1.27 1.59 7.81 121 S 7.86 4.47 0.00 4.09 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 0.00 122 H 8.78 4.49 0.00 3.27 3.36 0.00 5.89 0.00 0.00 0.00 0.00 6.94 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 123 R 8.13 3.95 0.00 1.84 2.00 0.00 3.45 0.00 0.00 3.27 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.86 0.00 124 G 7.98 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 0.00 0.00 0.00 125 L 9.03 4.15 0.00 1.99 1.93 0.98 1.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.06 0.00 0.00 0.00 0.00 0.00 0.00 126 R 8.56 3.89 0.00 1.93 2.02 0.00 3.08 0.00 0.00 3.01 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.89 0.00 127 H 7.80 4.15 0.00 3.40 3.43 0.00 5.73 0.00 0.00 0.00 0.00 7.03 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 128 F 8.66 4.00 0.00 3.02 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 0.00 129 W 8.87 4.59 0.00 3.42 3.41 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 0.00 130 G 10.10 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 0.00 0.00 0.00 131 L 7.37 4.55 0.00 1.59 1.51 0.84 1.01 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 0.00 132 K 8.53 3.89 0.00 1.73 1.78 0.00 1.73 0.00 0.00 1.63 0.00 0.00 2.74 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.45 1.46 7.81 133 V 8.24 4.06 2.05 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 0.83 0.00 0.00 0.84 0.00 0.00 134 R 7.96 4.13 0.00 2.04 2.17 0.00 3.05 0.00 0.00 3.35 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.63 0.00 135 G 8.50 3.64 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 136 Q 8.44 2.63 0.00 2.21 2.48 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 6.91 6.80 0.00 0.00 0.00 0.00 0.00 2.58 2.39 0.00 137 H 8.32 4.06 0.00 3.10 3.33 0.00 5.81 0.00 0.00 0.00 0.00 6.78 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 138 T 8.25 4.44 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 1.19 0.00 0.00 139 K 7.86 4.01 0.00 1.75 1.83 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.01 0.00 0.00 3.00 0.00 0.00 0.00 0.00 1.44 1.46 7.81 140 T 7.73 4.17 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 1.21 0.00 0.00 141 S 8.64 3.90 0.00 3.85 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 0.00 142 G 7.03 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 0.00 0.00 0.00 143 R 7.92 4.46 0.00 1.74 1.68 0.00 3.30 0.00 0.00 3.15 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.98 0.00 144 H 8.12 3.83 0.00 3.33 3.38 0.00 5.73 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 0.00 145 G 7.76 3.79 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 0.00 0.00 0.00 146 V 7.37 3.87 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 0.80 0.00 0.00 0.99 0.00 0.00 147 V 8.28 3.80 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 0.83 0.00 0.00 0.94 0.00 0.00 148 C 8.31 4.75 0.00 2.98 2.25 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 0.00 149 G 8.61 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 0.00 150 V 8.35 3.11 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 0.76 0.00 0.00 0.94 0.00 0.00 151 V 8.27 4.43 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 0.91 0.00 0.00 0.94 0.00 0.00 152 R 8.34 4.63 0.00 1.80 1.79 0.00 3.26 0.00 0.00 3.15 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.57 0.00 153 K 8.51 4.26 0.00 1.72 1.71 0.00 1.80 0.00 0.00 1.71 0.00 0.00 2.95 0.00 0.00 2.89 0.00 0.00 0.00 0.00 1.42 1.46 7.81 154 N 8.37 4.49 0.00 2.71 2.63 0.00 0.00 6.81 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