NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 20 R 4.2058 8.2501 120.8628 56.3500 31.9183 175.9697 21 A 4.0349 7.9877 118.0906 51.6103 18.4817 175.2843 22 G 3.8470 8.9856 104.8219 46.9651 0.0000 172.1038 23 L 4.9894 7.7811 116.9406 52.6360 45.2517 176.9130 24 Q 4.3104 9.8079 120.5431 58.1197 29.3251 177.3647 25 F 4.1055 8.5128 115.6065 56.3209 39.7955 174.2357 26 P 4.4817 0.0000 0.0000 62.3620 31.3815 177.2417 27 V 3.7658 8.4011 124.5364 65.8636 31.6239 177.7782 28 G 3.6381 8.0748 105.0913 47.7972 0.0000 175.4566 29 R 3.9133 7.9383 120.9891 59.0906 30.2193 178.5008 30 V 3.6536 7.9284 118.0458 66.2153 31.4564 177.4464 31 H 4.1033 8.4332 117.9291 59.3144 29.7711 177.1258 32 R 3.9252 8.1007 120.4591 59.6016 29.6775 178.4894 33 L 4.1601 8.2683 118.0005 57.6072 41.6489 179.1939 34 L 4.2678 8.4450 119.4413 57.8141 41.6221 179.3670 35 R 4.0356 8.2274 118.5686 59.4235 29.8243 178.5473 36 K 4.5424 8.3895 115.4871 56.7333 32.0506 177.0540 37 G 3.7302 8.2913 104.2095 43.7345 0.0000 172.9888 38 N 4.0844 7.8562 115.5295 54.4747 35.8712 174.2872 39 Y 4.2900 7.2752 114.4817 59.8404 39.0848 175.9468 40 A 4.4848 7.3613 119.4429 51.3559 21.9756 175.9990 41 E 4.1411 8.9773 119.0363 59.0037 29.6298 177.9828 42 R 4.6930 7.6743 114.3228 54.1811 33.8172 175.2288 43 V 4.2218 8.1503 118.3135 60.7620 33.5906 175.5431 44 G 3.8402 8.5878 116.3145 45.3916 0.0000 173.1850 45 A 4.1406 8.6355 123.3798 54.9641 18.7345 180.2717 46 G 3.7431 8.1236 101.9484 47.2037 0.0000 175.5014 47 A 4.0156 7.5794 122.4161 54.9431 18.3040 178.0365 48 P 4.1966 0.0000 0.0000 65.7532 31.3657 178.8004 49 V 3.5651 7.7271 117.6231 66.0107 31.6194 177.0716 50 Y 3.8680 8.3077 119.5952 60.6957 38.6400 177.9364 51 L 4.0374 8.4709 121.2930 58.1018 42.1334 178.7286 52 A 4.0737 8.4433 120.8648 55.1763 18.2863 179.4121 53 A 3.8510 8.0312 119.2922 55.2768 18.4256 180.0783 54 V 3.5597 7.7712 116.7161 66.0908 31.5990 178.3226 55 L 3.9086 7.9714 118.7981 57.5762 41.3992 179.1178 56 E 2.5796 7.8293 119.5340 58.8153 29.4291 178.0178 57 Y 4.0599 7.9072 119.6104 60.9439 38.8787 178.2403 58 L 3.4508 7.7794 119.5700 57.8440 41.6593 179.7878 59 T 3.7744 7.8299 115.4856 66.5500 68.3290 176.5854 60 A 3.9606 8.1703 123.1151 54.9784 18.2208 179.2365 61 E 3.6862 7.9326 118.0798 59.5223 29.6754 179.2564 62 I 3.7328 7.5577 119.7209 64.2354 37.1519 178.4323 63 L 4.0382 7.9711 119.9349 57.5041 41.5389 178.9729 64 E 3.8942 8.3552 119.5388 59.5745 29.6131 179.1042 65 L 4.0230 7.6896 118.7148 57.5952 41.6417 179.3829 66 A 4.2694 8.6816 121.4839 54.8513 18.2649 179.8994 67 G 3.5423 8.6433 104.7312 48.0927 0.0000 175.6715 68 N 4.3077 8.0603 118.6042 55.9631 38.3439 177.2842 69 A 3.9196 7.8315 120.7861 55.0599 18.6015 179.3330 70 A 3.6424 7.7983 119.3153 55.0167 18.4986 179.6505 71 R 3.7977 8.0095 117.2908 59.8192 29.9704 178.2890 72 D 4.5833 8.1910 116.5960 56.0808 40.7765 176.7281 73 N 4.7750 7.7497 115.4799 52.0541 39.4740 174.5749 74 K 3.8737 8.2381 116.6309 57.4958 29.8039 175.7320 75 K 4.6974 7.6447 115.5570 55.0233 36.1830 177.1331 76 T 4.2527 8.5169 111.1093 61.7784 69.8274 174.3886 77 R 4.5075 7.6949 122.7053 54.1014 31.4395 175.3089 78 I 3.9959 8.4270 127.1308 61.3116 37.7543 175.1629 79 I 4.6344 7.9418 117.2979 57.6358 40.8378 174.2542 80 P 4.1979 0.0000 0.0000 65.8243 30.8500 178.4844 81 R 4.0123 8.0034 116.8141 60.2130 29.9732 178.1102 82 H 4.3325 7.8907 115.1105 58.6129 28.5560 177.9201 83 L 4.0300 7.7297 120.7109 57.5517 41.5036 178.9273 84 Q 3.9303 8.3318 119.7567 59.3161 28.9405 178.2720 85 L 3.9679 8.1165 119.7911 57.7735 41.4040 179.5268 86 A 3.9793 7.6570 119.2424 55.0424 18.7344 179.6770 87 V 3.6619 7.9302 116.7791 66.3560 31.5680 178.4069 88 R 4.2697 8.1622 115.4902 58.1832 30.0419 177.0623 89 N 4.6283 7.7617 114.3181 53.0913 39.0851 174.6799 90 D 4.7859 7.8357 118.9873 51.9488 43.1732 175.3580 91 E 3.8916 8.8558 128.2916 59.7858 29.4776 178.7712 92 E 3.9441 8.0808 117.5197 59.4655 29.6536 179.1194 93 L 3.9660 8.3194 119.0769 57.7960 41.4357 179.0082 94 N 4.2491 8.3099 116.4503 56.4741 39.2213 176.6112 95 K 4.0604 7.9737 120.9521 59.5174 32.1836 178.4015 96 L 4.0165 7.9823 119.4968 57.1985 42.4080 177.5971 97 L 4.7917 8.1732 119.0304 54.1835 42.3317 178.9951 98 G 3.6391 8.0061 109.6340 47.9593 0.0000 175.5856 99 R 4.5205 7.9624 116.5624 55.6098 30.5534 175.2956 100 V 4.3336 7.6718 118.1009 61.3065 33.0842 175.0359 101 T 4.5063 8.3676 123.1940 61.8315 70.3063 173.8129 102 I 4.2289 8.0989 126.6951 59.1965 38.1882 175.1641 103 A 4.0385 8.5354 128.9834 53.6025 18.7032 176.5154 104 Q 3.5266 8.6577 119.2745 56.9716 26.4655 175.1857 105 G 3.7031 7.9143 108.4498 45.2084 0.0000 176.3611 106 G 3.8301 7.9776 107.6160 44.7537 0.0000 172.0205 107 V 4.5324 7.9220 111.1561 59.0320 35.3876 174.9178 108 L 4.2494 8.1839 120.6673 53.5352 42.1442 175.5684 109 P 4.2334 0.0000 0.0000 62.9867 31.4841 175.7642 110 N 4.4979 8.3430 119.4507 52.9485 41.4005 173.2634 111 I 4.5034 8.2010 126.5781 58.9847 40.0003 175.5446 112 Q 4.0258 8.7157 124.2573 56.1567 29.3040 176.9319 113 S 4.0781 9.0244 118.6262 61.6920 62.7090 177.0613 114 V 3.7756 7.8150 119.4870 62.8120 30.9519 176.3447 115 L 4.4219 8.0698 119.5233 55.0964 42.3565 176.8666 116 L 4.2697 7.9866 119.2872 53.1207 42.6089 174.9675 117 P 4.3951 0.0000 0.0000 62.9570 31.5213 177.5350 118 K 3.7418 8.6980 119.1929 57.7704 32.3061 177.3443 119 K 4.1695 7.3324 119.7201 56.9178 32.6856 174.8694 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 20 R 8.25 4.21 0.00 1.80 2.04 0.00 3.21 0.00 0.00 3.23 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.65 0.00 21 A 7.99 4.03 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 22 G 8.99 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 23 L 7.78 4.99 0.00 1.66 1.78 0.97 0.97 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 Q 9.81 4.31 0.00 2.31 2.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.35 6.89 0.00 0.00 0.00 0.00 0.00 2.56 2.55 0.00 25 F 8.51 4.11 0.00 2.96 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 26 P 0.00 4.48 0.00 2.26 2.19 0.00 3.54 0.00 0.00 3.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.05 1.90 0.00 27 V 8.40 3.77 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 1.09 0.00 0.00 0.98 0.00 0.00 28 G 8.07 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 29 R 7.94 3.91 0.00 1.89 2.10 0.00 3.16 0.00 0.00 3.25 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.72 1.70 0.00 30 V 7.93 3.65 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 0.98 0.00 0.00 1.04 0.00 0.00 31 H 8.43 4.10 0.00 3.44 3.40 0.00 5.65 0.00 0.00 0.00 0.00 6.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 R 8.10 3.93 0.00 2.05 2.14 0.00 3.16 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 1.66 1.70 0.00 33 L 8.27 4.16 0.00 1.84 1.81 0.96 1.02 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 0.00 0.00 0.00 0.00 0.00 0.00 34 L 8.45 4.27 0.00 1.94 1.76 0.87 0.58 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 35 R 8.23 4.04 0.00 2.14 1.98 0.00 3.23 0.00 0.00 3.14 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.73 0.00 36 K 8.39 4.54 0.00 1.83 1.88 0.00 1.80 0.00 0.00 1.73 0.00 0.00 3.04 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.46 1.46 7.81 37 G 8.29 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 0.00 0.00 0.00 38 N 7.86 4.08 0.00 2.65 2.75 0.00 0.00 6.99 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 39 Y 7.28 4.29 0.00 3.02 2.98 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 40 A 7.36 4.48 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 41 E 8.98 4.14 0.00 1.98 2.03 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 2.32 2.28 0.00 42 R 7.67 4.69 0.00 1.76 1.80 0.00 3.16 0.00 0.00 3.16 7.39 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.58 0.00 43 V 8.15 4.22 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 0.72 0.00 0.00 0.99 0.00 0.00 44 G 8.59 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 45 A 8.64 4.14 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 46 G 8.12 3.74 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 0.00 0.00 0.00 47 A 7.58 4.02 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 48 P 0.00 4.20 0.00 2.44 2.27 0.00 3.65 0.00 0.00 3.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.17 1.85 0.00 49 V 7.73 3.57 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 1.03 0.00 0.00 1.02 0.00 0.00 50 Y 8.31 3.87 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 51 L 8.47 4.04 0.00 1.87 1.74 0.94 1.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 0.00 0.00 0.00 0.00 0.00 0.00 52 A 8.44 4.07 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 53 A 8.03 3.85 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 54 V 7.77 3.56 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 1.10 0.00 0.00 1.06 0.00 0.00 55 L 7.97 3.91 0.00 1.75 1.66 1.05 0.68 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 56 E 7.83 2.58 0.00 1.44 1.80 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 2.15 2.12 0.00 57 Y 7.91 4.06 0.00 3.00 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 58 L 7.78 3.45 0.00 1.62 1.58 0.93 0.44 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 59 T 7.83 3.77 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 1.33 0.00 0.00 60 A 8.17 3.96 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 61 E 7.93 3.69 0.00 1.49 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 2.09 2.26 0.00 62 I 7.56 3.73 1.82 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 1.46 0.45 0.89 0.00 0.00 63 L 7.97 4.04 0.00 1.69 1.71 0.95 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.73 0.00 0.00 0.00 0.00 0.00 0.00 64 E 8.36 3.89 0.00 2.08 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 0.00 2.30 2.39 0.00 65 L 7.69 4.02 0.00 1.79 1.68 0.90 nan 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 66 A 8.68 4.27 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 67 G 8.64 3.54 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 0.00 0.00 0.00 68 N 8.06 4.31 0.00 2.92 2.86 0.00 0.00 6.94 6.55 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 69 A 7.83 3.92 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 70 A 7.80 3.64 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 71 R 8.01 3.80 0.00 1.87 2.08 0.00 3.09 0.00 0.00 3.15 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.67 0.00 72 D 8.19 4.58 0.00 2.65 2.70 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 73 N 7.75 4.78 0.00 2.77 2.82 0.00 0.00 6.97 7.19 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 74 K 8.24 3.87 0.00 1.87 1.87 0.00 1.66 0.00 0.00 1.70 0.00 0.00 3.00 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.37 1.53 7.81 75 K 7.64 4.70 0.00 1.69 1.69 0.00 1.83 0.00 0.00 1.81 0.00 0.00 3.07 0.00 0.00 3.08 0.00 0.00 0.00 0.00 1.35 1.63 7.81 76 T 8.52 4.25 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 77 R 7.69 4.51 0.00 1.78 1.87 0.00 3.24 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 1.53 1.62 0.00 78 I 8.43 4.00 1.90 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 1.50 0.67 0.94 0.00 0.00 79 I 7.94 4.63 1.81 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 1.01 0.67 0.92 0.00 0.00 80 P 0.00 4.20 0.00 2.32 2.30 0.00 3.58 0.00 0.00 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.14 0.00 81 R 8.00 4.01 0.00 1.75 1.83 0.00 3.35 0.00 0.00 3.35 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.67 0.00 82 H 7.89 4.33 0.00 3.34 3.47 0.00 5.69 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 83 L 7.73 4.03 0.00 1.85 1.71 0.92 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 0.00 0.00 0.00 0.00 0.00 0.00 84 Q 8.33 3.93 0.00 2.15 2.32 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.36 6.78 0.00 0.00 0.00 0.00 0.00 2.58 2.45 0.00 85 L 8.12 3.97 0.00 1.75 1.72 0.96 0.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.82 0.00 0.00 0.00 0.00 0.00 0.00 86 A 7.66 3.98 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 87 V 7.93 3.66 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 1.02 0.00 0.00 0.98 0.00 0.00 88 R 8.16 4.27 0.00 1.82 1.97 0.00 3.72 0.00 0.00 3.22 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.95 1.73 0.00 89 N 7.76 4.63 0.00 2.81 2.84 0.00 0.00 6.68 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 90 D 7.84 4.79 0.00 2.77 2.50 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 91 E 8.86 3.89 0.00 2.07 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 0.00 2.39 2.45 0.00 92 E 8.08 3.94 0.00 2.06 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 2.41 2.41 0.00 93 L 8.32 3.97 0.00 1.68 1.70 0.88 0.38 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 94 N 8.31 4.25 0.00 2.92 3.07 0.00 0.00 7.21 6.23 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 95 K 7.97 4.06 0.00 2.03 1.94 0.00 1.71 0.00 0.00 1.58 0.00 0.00 2.91 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.44 1.45 7.81 96 L 7.98 4.02 0.00 1.64 1.87 0.93 1.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 0.00 0.00 0.00 0.00 0.00 0.00 97 L 8.17 4.79 0.00 1.78 1.61 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.31 0.00 0.00 0.00 0.00 0.00 0.00 98 G 8.01 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 99 R 7.96 4.52 0.00 1.79 1.93 0.00 3.18 0.00 0.00 3.16 7.33 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.58 0.00 100 V 7.67 4.33 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 0.79 0.00 0.00 0.94 0.00 0.00 101 T 8.37 4.51 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 0.00 102 I 8.10 4.23 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 0.83 0.91 0.00 0.00 103 A 8.54 4.04 1.24 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 0.00 0.00 104 Q 8.66 3.53 0.00 2.19 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 6.92 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 105 G 7.91 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 0.00 106 G 7.98 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 0.00 107 V 7.92 4.53 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 0.79 0.00 0.00 0.93 0.00 0.00 108 L 8.18 4.25 0.00 1.64 1.59 0.99 1.01 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 0.00 109 P 0.00 4.23 0.00 2.04 2.01 0.00 3.72 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 2.03 2.07 0.00 110 N 8.34 4.50 0.00 2.61 2.65 0.00 0.00 7.04 7.94 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 0.00 111 I 8.20 4.50 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 1.41 0.79 0.91 0.00 0.00 112 Q 8.72 4.03 0.00 2.08 2.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.79 6.77 0.00 0.00 0.00 0.00 0.00 2.45 2.30 0.00 113 S 9.02 4.08 0.00 3.99 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 0.00 114 V 7.81 3.78 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 0.74 0.00 0.00 0.93 0.00 0.00 115 L 8.07 4.42 0.00 1.75 1.75 0.92 0.96 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 0.00 116 L 7.99 4.27 0.00 1.70 1.60 0.92 1.04 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 0.00 117 P 0.00 4.40 0.00 2.21 2.20 0.00 3.70 0.00 0.00 3.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.08 2.01 0.00 118 K 8.70 3.74 0.00 1.77 1.92 0.00 1.90 0.00 0.00 1.70 0.00 0.00 2.99 0.00 0.00 2.97 0.00 0.00 0.00 0.00 1.45 1.47 7.81 119 K 7.33 4.17 0.00 1.95 1.77 0.00 1.73 0.00 0.00 1.74 0.00 0.00 3.01 0.00 0.00 2.92 0.00 0.00 0.00 0.00 1.38 1.51 7.81