NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 1 M 4.3423 8.3044 120.3289 52.9711 32.6240 173.1792 2 L 4.5712 7.3216 120.8005 53.0888 44.8709 171.0956 3 Q 3.8007 8.7495 123.7894 53.8945 32.3057 171.7661 4 P 4.3430 0.0000 0.0000 62.2792 31.3408 177.7384 5 K 3.9175 8.6333 123.9882 59.2571 32.2357 177.1464 6 R 4.6915 7.2930 115.6318 55.1134 33.1731 174.0920 7 T 4.7149 8.2391 112.9234 59.7093 71.5708 174.9946 8 K 3.8227 8.8938 125.3352 58.4812 32.3389 177.1716 9 F 5.0974 7.4045 116.4679 55.3499 42.1665 175.2590 10 R 4.1530 9.1012 124.3093 58.4663 30.1820 177.3394 11 K 4.4267 7.7605 115.9249 54.5164 35.1445 175.5320 12 M 4.4454 8.3888 123.5189 54.8600 34.5338 176.5437 13 H 4.6582 8.4066 120.4234 56.0604 27.7862 175.7205 14 K 4.4650 8.4797 127.5513 56.1535 37.4791 178.5120 15 G 3.7551 7.8321 110.4937 46.6585 0.0000 172.4946 16 R 4.3966 7.8693 115.9473 55.5866 31.2250 174.3064 17 N 4.6387 8.7730 117.3293 53.7651 39.1398 175.0337 18 R 4.5520 8.0148 119.0146 55.8823 31.4332 175.2562 19 G 3.6852 8.9014 109.4750 45.1892 0.0000 171.5939 20 L 3.4489 8.4506 123.2690 54.1637 39.4298 174.7971 21 A 4.4290 8.0809 126.9940 51.5834 20.1099 175.9659 22 Q 4.4472 8.6311 114.0467 57.5910 31.4448 177.5110 23 G 4.0303 7.6482 108.3526 44.5863 0.0000 173.7542 24 T 4.1532 8.1651 123.3750 64.5095 67.3627 177.4067 25 D 4.4175 9.3363 123.3557 54.0290 40.2890 177.9590 26 V 3.8194 8.0180 114.1251 62.1952 32.0733 176.5715 27 S 4.3891 8.2649 117.4648 58.1492 63.8163 174.8076 28 F 4.3945 7.3371 117.7803 58.5957 45.5230 177.3305 29 G 4.0507 7.9991 116.2309 45.0677 0.0000 174.6000 30 S 4.3819 8.4285 118.6685 58.3765 65.9136 175.8667 31 F 5.8459 7.6673 118.0725 55.7582 43.6908 176.9943 32 G 4.1109 9.9029 112.3302 45.1513 0.0000 171.7619 33 L 4.5064 7.5416 116.9156 52.5698 44.9012 176.8304 34 K 4.2387 8.5429 124.9218 55.5449 34.3949 174.7682 35 A 3.9817 8.2804 125.1502 49.6002 17.4638 179.4762 36 V 3.5422 9.1181 120.4156 61.7519 31.9533 171.0425 37 G 4.2610 7.5071 105.3973 44.5940 0.0000 171.3582 38 R 4.7131 9.5692 117.3739 53.6257 33.4405 177.8044 39 G 3.8905 6.6264 105.1898 45.8493 0.0000 171.5365 40 R 4.9851 7.8454 116.3939 54.7044 32.5308 174.2262 41 L 4.6833 8.7321 121.5160 53.9030 41.8465 177.8626 42 T 4.0378 9.4535 118.8042 64.0085 68.4269 176.3622 43 A 4.4236 8.1561 130.5194 53.8956 18.0405 179.8514 44 R 4.0021 9.3247 114.0564 58.2719 29.9881 178.2954 45 Q 4.1979 7.9521 117.4864 58.7793 29.3697 177.4302 46 I 4.4431 7.8125 114.9216 63.5447 37.0312 177.8412 47 E 4.0372 7.9166 119.2696 59.1366 29.6841 178.6851 48 A 3.6282 7.5716 119.6403 54.9963 18.2472 179.6247 49 A 4.0185 8.7643 119.6003 55.0456 18.6846 179.5824 50 R 3.6309 8.0589 117.5749 59.9449 30.1470 178.3190 51 R 3.9291 8.7811 118.3231 59.6291 29.8832 178.5340 52 A 3.9627 7.4828 118.4562 55.5797 18.4674 178.7930 53 M 3.9985 8.2698 116.7868 59.4414 32.2384 178.2397 54 T 3.8321 8.5571 115.8272 66.0693 69.3949 174.6946 55 R 4.6439 8.2190 125.0073 55.6355 28.1232 176.2355 56 A 5.1393 7.6374 135.0000 53.3903 18.3453 178.6147 57 V 3.7375 7.0119 113.5750 63.2651 33.5034 178.8382 58 K 3.7991 8.3427 119.4438 58.1085 30.9376 175.7053 59 R 4.3297 9.2054 122.7158 58.7234 31.7976 175.0738 60 Q 3.8268 7.8616 114.9007 57.2107 29.3170 178.2690 61 G 4.2656 8.6744 104.6627 46.4530 0.0000 172.2909 62 K 4.4833 8.3258 119.6419 54.4178 34.6750 174.8730 63 I 5.1367 7.9953 126.6268 59.5636 39.9829 174.5702 64 W 4.9616 9.0527 122.7909 55.3998 34.2249 175.0296 65 I 4.6728 8.1891 121.3253 60.1871 39.0823 175.2161 66 R 4.3187 8.6678 123.8429 56.1786 30.3832 176.7222 67 V 4.5496 7.1614 111.3333 59.6323 34.6072 174.8350 68 F 4.9012 8.2650 122.5962 55.8752 41.9974 171.5385 69 P 4.3918 0.0000 0.0000 59.8902 31.4317 178.4599 70 D 4.6250 7.6501 121.9488 53.3153 40.6220 173.9792 71 K 4.4585 8.5924 121.7850 54.0497 32.2867 173.8926 72 P 2.9700 0.0000 0.0000 62.3349 31.0409 172.0462 73 I 2.9136 7.8311 134.5851 61.2893 35.3720 173.3330 74 T 4.6169 7.7852 115.1266 60.4395 71.1445 173.9089 75 E 4.6332 8.3366 120.2919 54.7539 33.5332 175.0742 76 K 4.3631 8.6045 125.8842 54.3664 33.4076 174.5332 77 P 4.4710 0.0000 0.0000 62.2198 33.4932 177.8311 78 L 4.0283 8.8360 120.5660 55.6364 40.0917 179.5851 79 A 3.9416 9.3028 135.0000 53.9346 18.2098 178.6683 80 V 4.0344 7.7421 115.5614 61.7433 33.2283 172.9920 81 R 4.1070 8.7045 124.2665 56.2199 30.6339 176.0117 82 M 4.2536 8.2752 118.5991 56.0170 33.1557 175.3784 83 G 3.7025 9.3382 109.5031 45.6274 0.0000 174.5047 84 K 4.4432 7.5972 122.3715 55.3824 33.7043 177.5829 85 G 4.0712 8.2917 103.0116 44.9418 0.0000 173.9430 86 K 4.0782 8.2627 120.2250 55.9129 33.0807 178.6069 87 G 3.9438 8.1999 109.7254 46.1894 0.0000 171.9633 88 N 5.0717 8.4773 116.4663 51.0941 41.9078 174.7723 89 V 3.1973 8.2238 115.3261 62.1146 31.0624 175.9017 90 E 4.0478 8.1083 127.2672 58.3476 29.9033 175.5527 91 Y 4.9738 6.7598 113.2650 55.0176 40.9092 173.5779 92 W 5.1548 9.2036 118.5372 54.2874 31.8727 175.2666 93 V 4.6149 8.8313 123.8410 60.6042 33.8177 175.2802 94 A 5.0657 8.7785 122.8995 49.8072 21.2143 175.3775 95 L 4.4178 8.6827 121.9890 55.9507 41.7226 177.0393 96 I 4.9047 8.5894 117.0783 59.1893 41.6057 174.1886 97 Q 4.4770 8.3113 119.7986 53.6696 33.0447 171.0353 98 P 3.9692 0.0000 0.0000 66.4689 31.7228 175.4884 99 G 3.3302 9.5513 117.4208 45.5846 0.0000 173.0792 100 K 3.8030 7.9179 122.9091 56.3653 33.1092 176.6777 101 V 3.7771 8.3185 126.2541 61.0312 30.8402 176.0497 102 L 3.5739 8.8487 126.0878 57.8735 41.7605 179.0500 103 Y 5.3872 7.1506 116.0210 56.4775 42.8258 173.2771 104 E 5.0437 8.9835 118.3008 56.7509 32.7595 175.4390 105 M 5.0929 9.4753 127.4895 55.7030 34.3303 174.3282 106 D 4.9402 8.1790 120.3260 55.5422 47.3800 176.6783 107 G 4.0284 7.9975 109.8007 42.2391 0.0000 172.3851 108 V 4.2517 7.2631 117.6178 60.6080 33.8956 171.6316 109 P 4.4946 0.0000 0.0000 62.8889 31.7074 177.1958 110 E 3.6259 8.8150 116.6737 56.7364 29.3886 176.4280 111 E 4.1740 8.4291 119.7134 58.3843 31.8594 176.6032 112 L 4.5229 7.5142 119.1183 52.8434 41.4126 174.2067 113 A 4.1784 7.1044 129.2313 53.1707 25.2478 179.0878 114 R 3.5106 7.3962 115.8912 58.3292 30.6266 176.2955 115 E 4.6410 7.4968 117.4744 54.5231 29.5912 174.8562 116 A 4.6711 7.4553 120.7956 52.7392 25.7078 178.9937 117 F 4.5849 9.0211 115.1631 60.5617 38.9434 178.0605 118 K 3.8982 7.7665 117.0535 59.3854 31.9291 178.0687 119 L 4.1881 7.8443 119.1903 58.2624 42.5243 177.4036 120 A 4.1524 8.4276 121.6686 53.4658 19.1017 176.9758 121 A 4.6701 8.6318 124.1698 51.2135 16.3210 177.2643 122 A 4.5471 7.7031 118.7415 52.1176 23.8732 177.5125 123 K 4.4360 8.0220 114.4280 56.5952 33.9220 177.0781 124 L 4.4076 7.7334 117.6300 53.6855 42.6397 175.2908 125 P 4.3785 0.0000 0.0000 65.6211 31.6834 177.4830 126 I 3.8458 7.5869 118.1883 60.4931 37.4301 176.1868 127 K 4.1195 8.5088 124.7387 57.6662 32.8654 175.2605 128 T 5.3085 7.4620 106.1544 62.6835 71.0365 172.3120 129 T 4.3407 7.8175 111.5199 61.8328 70.3818 173.1985 130 F 4.6815 9.0476 129.1931 58.0394 40.5815 174.6166 131 V 4.3762 6.6658 121.5586 62.9908 34.7032 173.6412 132 T 4.2685 9.1138 124.6369 64.8181 66.8239 175.3405 133 K 4.2470 9.4104 130.2198 56.3493 38.8653 171.3409 134 T 3.2350 8.2082 120.6302 63.0403 67.7249 171.5785 135 V 3.5745 8.2921 126.4337 65.3804 32.1224 175.3362 136 M 4.1234 7.7414 123.0682 55.5448 32.0981 175.7113 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 4.34 0.00 2.03 2.12 0.00 0.00 0.00 0.00 0.00 -0.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.51 2.49 0.00 2 L 7.32 4.57 0.00 1.64 1.45 0.99 0.43 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 0.00 0.00 0.00 0.00 0.00 0.00 3 Q 8.75 3.80 0.00 0.93 1.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.67 6.76 0.00 0.00 0.00 0.00 0.00 1.98 1.96 0.00 4 P 0.00 4.34 0.00 1.88 2.02 0.00 2.20 0.00 0.00 2.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 2.08 0.00 5 K 8.63 3.92 0.00 1.71 1.87 0.00 1.76 0.00 0.00 1.61 0.00 0.00 2.89 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.42 1.37 7.81 6 R 7.29 4.69 0.00 1.83 1.72 0.00 3.18 0.00 0.00 3.26 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.56 0.00 7 T 8.24 4.71 4.57 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 1.42 0.00 0.00 8 K 8.89 3.82 0.00 1.59 1.29 0.00 1.50 0.00 0.00 1.63 0.00 0.00 2.80 0.00 0.00 2.78 0.00 0.00 0.00 0.00 1.27 1.26 7.81 9 F 7.40 5.10 0.00 3.04 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 10 R 9.10 4.15 0.00 1.86 2.02 0.00 3.39 0.00 0.00 3.28 7.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 1.65 0.00 11 K 7.76 4.43 0.00 1.63 1.59 0.00 1.70 0.00 0.00 1.57 0.00 0.00 2.92 0.00 0.00 2.90 0.00 0.00 0.00 0.00 1.24 1.36 7.81 12 M 8.39 4.45 0.00 1.95 1.94 0.00 0.00 0.00 0.00 0.00 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.62 2.57 0.00 13 H 8.41 4.66 0.00 3.13 2.39 0.00 5.75 0.00 0.00 0.00 0.00 6.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 K 8.48 4.46 0.00 1.61 1.63 0.00 1.87 0.00 0.00 1.68 0.00 0.00 2.96 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.30 1.40 7.81 15 G 7.83 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 16 R 7.87 4.40 0.00 1.88 1.86 0.00 3.04 0.00 0.00 3.22 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.48 0.00 17 N 8.77 4.64 0.00 2.73 2.80 0.00 0.00 6.74 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 18 R 8.01 4.55 0.00 1.75 1.88 0.00 3.53 0.00 0.00 3.23 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 1.53 0.00 19 G 8.90 3.69 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 0.00 0.00 0.00 20 L 8.45 3.45 0.00 1.81 1.73 0.92 0.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.48 0.00 0.00 0.00 0.00 0.00 0.00 21 A 8.08 4.43 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 22 Q 8.63 4.45 0.00 2.02 2.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 7.46 0.00 0.00 0.00 0.00 0.00 2.25 2.26 0.00 23 G 7.65 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 24 T 8.17 4.15 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 25 D 9.34 4.42 0.00 2.72 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 26 V 8.02 3.82 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 0.72 0.00 0.00 0.85 0.00 0.00 27 S 8.26 4.39 0.00 3.31 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 28 F 7.34 4.39 0.00 2.06 1.45 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 29 G 8.00 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 0.00 0.00 0.00 30 S 8.43 4.38 0.00 3.45 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 31 F 7.67 5.85 0.00 3.25 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 32 G 9.90 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 0.00 0.00 0.00 0.00 33 L 7.54 4.51 0.00 1.09 1.38 0.89 0.66 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 34 K 8.54 4.24 0.00 1.68 1.70 0.00 1.74 0.00 0.00 1.67 0.00 0.00 3.08 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.48 7.81 35 A 8.28 3.98 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 36 V 9.12 3.54 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 0.78 0.00 0.00 0.94 0.00 0.00 37 G 7.51 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 0.00 0.00 0.00 0.00 38 R 9.57 4.71 0.00 1.79 1.84 0.00 3.33 0.00 0.00 3.24 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.59 0.00 39 G 6.63 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 40 R 7.85 4.99 0.00 1.93 1.89 0.00 3.09 0.00 0.00 3.31 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.69 0.00 41 L 8.73 4.68 0.00 1.74 1.66 0.91 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.64 0.00 0.00 0.00 0.00 0.00 0.00 42 T 9.45 4.04 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 0.83 0.00 0.00 43 A 8.16 4.42 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 R 9.32 4.00 0.00 1.91 1.90 0.00 3.05 0.00 0.00 3.16 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.68 0.00 45 Q 7.95 4.20 0.00 2.17 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.58 0.00 0.00 0.00 0.00 0.00 2.39 2.39 0.00 46 I 7.81 4.44 1.99 0.00 0.00 0.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.79 0.94 0.00 0.00 47 E 7.92 4.04 0.00 2.16 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 2.36 2.48 0.00 48 A 7.57 3.63 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 49 A 8.76 4.02 1.33 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 50 R 8.06 3.63 0.00 2.22 2.13 0.00 3.18 0.00 0.00 3.28 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.80 0.00 51 R 8.78 3.93 0.00 1.85 1.95 0.00 3.20 0.00 0.00 3.17 7.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.84 0.00 52 A 7.48 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 53 M 8.27 4.00 0.00 2.11 2.04 0.00 0.00 0.00 0.00 0.00 2.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.55 2.55 0.00 54 T 8.56 3.83 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 1.23 0.00 0.00 55 R 8.22 4.64 0.00 1.74 1.98 0.00 3.39 0.00 0.00 3.21 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.64 0.00 56 A 7.64 5.14 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 57 V 7.01 3.74 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 0.82 0.00 0.00 0.94 0.00 0.00 58 K 8.34 3.80 0.00 1.93 1.33 0.00 1.83 0.00 0.00 1.61 0.00 0.00 3.00 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.35 1.38 7.81 59 R 9.21 4.33 0.00 1.73 1.90 0.00 3.27 0.00 0.00 3.21 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 60 Q 7.86 3.83 0.00 2.08 2.08 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.50 0.00 0.00 0.00 0.00 0.00 2.38 2.40 0.00 61 G 8.67 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 0.00 0.00 0.00 0.00 62 K 8.33 4.48 0.00 1.72 1.63 0.00 1.43 0.00 0.00 1.63 0.00 0.00 2.30 0.00 0.00 2.34 0.00 0.00 0.00 0.00 0.30 0.66 7.81 63 I 8.00 5.14 1.85 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 1.36 0.66 1.09 0.00 0.00 64 W 9.05 4.96 0.00 3.60 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 65 I 8.19 4.67 1.90 0.00 0.00 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.04 0.89 0.00 0.00 66 R 8.67 4.32 0.00 1.94 1.95 0.00 3.21 0.00 0.00 3.48 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.76 0.00 67 V 7.16 4.55 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 0.58 0.00 0.00 0.69 0.00 0.00 68 F 8.26 4.90 0.00 2.82 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 69 P 0.00 4.39 0.00 2.20 1.98 0.00 2.20 0.00 0.00 3.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.86 1.47 0.00 70 D 7.65 4.63 0.00 3.15 3.22 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 71 K 8.59 4.46 0.00 1.85 2.00 0.00 1.70 0.00 0.00 1.68 0.00 0.00 3.02 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.36 1.41 7.81 72 P 0.00 2.97 0.00 1.90 1.34 0.00 3.66 0.00 0.00 4.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 1.68 0.00 73 I 7.83 2.91 1.21 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 1.48 0.96 0.48 0.00 0.00 74 T 7.79 4.62 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 1.04 0.00 0.00 75 E 8.34 4.63 0.00 1.83 1.85 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 2.21 2.27 0.00 76 K 8.60 4.36 0.00 1.74 1.69 0.00 1.79 0.00 0.00 1.83 0.00 0.00 2.69 0.00 0.00 2.96 0.00 0.00 0.00 0.00 1.36 1.44 7.81 77 P 0.00 4.47 0.00 2.07 2.02 0.00 3.73 0.00 0.00 3.79 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.03 2.13 0.00 78 L 8.84 4.03 0.00 1.63 1.25 0.92 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 79 A 9.30 3.94 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 80 V 7.74 4.03 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 0.69 0.00 0.00 0.92 0.00 0.00 81 R 8.70 4.11 0.00 1.79 1.93 0.00 3.24 0.00 0.00 3.22 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.72 0.00 82 M 8.28 4.25 0.00 1.99 1.97 0.00 0.00 0.00 0.00 0.00 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.57 2.47 0.00 83 G 9.34 3.70 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 84 K 7.60 4.44 0.00 1.69 1.75 0.00 1.81 0.00 0.00 1.70 0.00 0.00 2.85 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.33 1.37 7.81 85 G 8.29 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 86 K 8.26 4.08 0.00 1.69 1.68 0.00 1.75 0.00 0.00 1.65 0.00 0.00 2.78 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.36 1.40 7.81 87 G 8.20 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 88 N 8.48 5.07 0.00 2.66 2.66 0.00 0.00 6.88 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 89 V 8.22 3.20 1.55 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 0.33 0.00 0.00 0.82 0.00 0.00 90 E 8.11 4.05 0.00 1.64 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 2.37 2.36 0.00 91 Y 6.76 4.97 0.00 3.08 2.90 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 92 W 9.20 5.15 0.00 3.21 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 93 V 8.83 4.61 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 0.87 0.00 0.00 1.11 0.00 0.00 94 A 8.78 5.07 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 95 L 8.68 4.42 0.00 1.57 1.68 0.96 0.86 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 0.00 0.00 0.00 0.00 0.00 0.00 96 I 8.59 4.90 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 1.41 0.97 0.99 0.00 0.00 97 Q 8.31 4.48 0.00 2.06 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.33 6.98 0.00 0.00 0.00 0.00 0.00 2.31 2.33 0.00 98 P 0.00 3.97 0.00 2.09 2.10 0.00 3.59 0.00 0.00 3.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.13 2.15 0.00 99 G 9.55 3.33 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 0.00 100 K 7.92 3.80 0.00 1.83 1.80 0.00 1.67 0.00 0.00 1.69 0.00 0.00 3.09 0.00 0.00 3.05 0.00 0.00 0.00 0.00 1.47 1.58 7.81 101 V 8.32 3.78 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 0.75 0.00 0.00 0.98 0.00 0.00 102 L 8.85 3.57 0.00 1.72 1.38 0.85 0.70 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.00 0.00 0.00 0.00 0.00 0.00 103 Y 7.15 5.39 0.00 2.92 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 0.00 104 E 8.98 5.04 0.00 2.20 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 0.00 2.26 2.32 0.00 105 M 9.48 5.09 0.00 2.65 1.87 0.00 0.00 0.00 0.00 0.00 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.79 2.73 0.00 106 D 8.18 4.94 0.00 3.24 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 0.00 107 G 8.00 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 0.00 108 V 7.26 4.25 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 0.78 0.00 0.00 0.96 0.00 0.00 109 P 0.00 4.49 0.00 2.18 2.04 0.00 3.61 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 2.12 2.12 0.00 110 E 8.81 3.63 0.00 1.95 2.29 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 2.21 2.31 0.00 111 E 8.43 4.17 0.00 1.92 1.84 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 2.13 2.16 0.00 112 L 7.51 4.52 0.00 1.59 1.54 0.90 0.89 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 0.00 113 A 7.10 4.18 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 114 R 7.40 3.51 0.00 1.04 1.53 0.00 2.71 0.00 0.00 3.02 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.40 0.92 0.00 115 E 7.50 4.64 0.00 1.83 1.77 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 2.16 2.30 0.00 116 A 7.46 4.67 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 0.00 117 F 9.02 4.58 0.00 3.36 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 0.00 118 K 7.77 3.90 0.00 1.98 1.91 0.00 1.78 0.00 0.00 1.63 0.00 0.00 3.11 0.00 0.00 2.99 0.00 0.00 0.00 0.00 1.48 1.49 7.81 119 L 7.84 4.19 0.00 1.68 1.79 0.90 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 0.00 0.00 0.00 0.00 0.00 0.00 120 A 8.43 4.15 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 0.00 121 A 8.63 4.67 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 0.00 122 A 7.70 4.55 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 0.00 123 K 8.02 4.44 0.00 1.78 1.86 0.00 1.72 0.00 0.00 1.71 0.00 0.00 2.79 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.56 1.65 7.81 124 L 7.73 4.41 0.00 1.68 1.64 1.09 1.15 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.70 0.00 0.00 0.00 0.00 0.00 0.00 125 P 0.00 4.38 0.00 2.05 2.10 0.00 3.70 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 2.14 2.10 0.00 126 I 7.59 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 1.48 0.50 0.99 0.00 0.00 127 K 8.51 4.12 0.00 1.87 1.87 0.00 1.59 0.00 0.00 1.77 0.00 0.00 3.03 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.43 1.40 7.81 128 T 7.46 5.31 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 1.33 0.00 0.00 129 T 7.82 4.34 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 1.23 0.00 0.00 130 F 9.05 4.68 0.00 3.16 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 0.00 131 V 6.67 4.38 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 0.82 0.00 0.00 0.88 0.00 0.00 132 T 9.11 4.27 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 1.35 0.00 0.00 133 K 9.41 4.25 0.00 1.70 1.68 0.00 1.78 0.00 0.00 1.49 0.00 0.00 2.87 0.00 0.00 2.73 0.00 0.00 0.00 0.00 1.21 1.29 7.81 134 T 8.21 3.23 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 0.00 135 V 8.29 3.57 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 0.74 0.00 0.00 0.92 0.00 0.00 136 M 7.74 4.12 0.00 1.99 1.89 0.00 0.00 0.00 0.00 0.00 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.49 2.49 0.00