NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 E 4.2672 8.4449 121.4889 54.2536 32.0003 174.6465 3 Q 4.3906 7.9525 117.5162 53.7855 32.2951 173.4036 4 Y 4.7688 8.7997 122.2929 56.9434 39.6331 173.8217 5 Y 5.9600 8.5181 125.8424 55.8271 41.4979 174.4161 6 G 3.9582 6.9160 110.0566 44.8685 0.0000 172.0078 7 T 4.4360 8.4200 121.2941 62.4573 68.5577 174.1862 8 G 3.9654 8.4649 114.8612 45.0750 0.0000 171.3589 9 R 5.2466 7.6382 118.8504 55.9771 32.7284 173.8425 10 R 4.2617 8.4238 120.4486 56.5576 32.5021 173.8849 11 K 3.8145 9.4115 128.8839 57.8428 30.7260 175.0359 12 E 3.5564 8.0888 114.1743 55.7284 26.4958 174.9193 13 A 4.6629 7.4568 115.4884 52.3190 23.0208 176.3369 14 V 4.8209 8.0665 120.9422 61.8949 34.2180 174.3562 15 A 4.8522 8.7488 129.5937 50.2082 21.7049 175.4139 16 R 4.5159 8.3807 122.8922 55.5820 30.9194 175.5269 17 V 4.4392 7.6344 124.9372 61.1834 33.5346 174.8620 18 F 6.1291 9.1490 125.7711 55.3618 43.0740 174.9547 19 L 4.5275 8.5706 119.5160 53.8348 44.8363 174.7836 20 R 4.3722 8.4889 123.8038 53.6574 31.6261 174.5140 21 P 4.8845 0.0000 0.0000 60.7647 32.0292 175.5410 22 G 4.4803 7.9062 113.8971 46.4173 0.0000 174.5448 23 N 4.7388 9.4637 126.5915 53.1154 36.5981 176.4643 24 G 4.2522 6.9093 115.4328 46.4625 0.0000 173.4441 25 K 4.0494 8.0231 119.1501 57.0430 33.8162 175.8331 26 V 5.5359 8.2216 119.7476 60.7899 35.5406 173.9968 27 T 5.1800 8.4212 121.4109 61.8864 73.5592 172.9499 28 V 4.8614 8.5681 124.2321 61.1553 34.7549 174.4547 29 N 3.9814 9.4772 119.8574 55.5937 35.2241 174.1882 30 G 4.2741 7.9378 111.9084 45.3697 0.0000 170.6639 31 Q 4.4455 7.5640 115.5911 53.0131 32.8592 172.6341 32 D 4.6940 8.6809 123.3877 54.4615 43.0942 177.7289 33 F 4.0310 8.8906 126.3494 61.6989 39.3949 177.5433 34 N 4.2747 8.3944 113.4944 55.3010 38.5372 176.1571 35 E 4.2307 7.9274 119.4273 58.2372 30.1995 176.9650 36 Y 4.1689 7.5478 118.6530 59.6591 39.7662 176.2918 37 F 4.7675 7.1811 118.7976 56.6459 38.7239 175.5434 38 Q 4.2486 7.5836 121.9790 56.1820 30.4435 176.5017 39 G 3.9213 8.6699 110.4288 45.5869 0.0000 173.3437 40 L 4.3699 7.3298 121.0401 53.4343 42.0535 177.2509 41 V 3.9757 8.2572 122.9383 63.4296 32.0379 176.2925 42 R 4.1101 7.7407 118.5062 58.2748 30.7608 177.5965 43 A 3.7128 7.5849 121.6802 55.7746 18.1724 179.5281 44 V 4.2468 7.7583 104.0820 62.1236 31.3875 177.2414 45 A 4.1611 8.5035 125.9140 54.6635 18.7668 180.2649 46 A 4.0258 7.7838 118.6992 55.5131 18.4767 179.3658 47 L 4.2553 7.6719 114.4921 55.0719 41.1660 178.4128 48 E 4.2601 7.6675 120.3438 57.7804 29.8898 175.0775 49 P 4.0988 0.0000 0.0000 65.3532 31.6199 178.3154 50 L 3.9911 7.8180 118.5375 57.2336 41.3359 178.3620 51 R 4.5864 7.3976 114.6133 56.1235 30.4150 176.5847 52 A 4.8034 7.6731 120.7689 51.8531 19.4885 177.5237 53 V 4.3902 7.9682 109.8629 61.2073 34.1496 176.1383 54 D 4.9326 8.3914 117.6912 53.6932 40.3398 175.1422 55 A 4.8349 7.7310 121.2280 50.5403 18.2685 175.2107 56 L 4.4196 7.9168 123.2839 55.5955 43.5782 176.9168 57 G 4.1365 7.9978 105.7349 45.7742 0.0000 173.8134 58 R 4.3481 7.9421 115.8577 55.0798 32.8495 174.9424 59 F 4.8357 7.9655 116.8826 55.5344 41.3086 174.2830 60 D 5.1324 9.2910 124.2664 53.5410 40.1832 174.3447 61 A 5.0418 8.3541 124.9927 51.2514 20.0737 175.1801 62 Y 4.8442 8.9165 124.4656 56.1523 40.9863 174.2641 63 I 5.2360 8.4052 127.7028 59.0605 40.9128 175.1478 64 T 5.2538 8.0196 121.7682 60.5852 69.2994 173.7213 65 V 4.3361 7.8638 124.7432 61.5258 33.8524 176.7649 66 R 4.1861 9.0551 120.2731 60.0341 32.3912 173.7969 67 G 4.3087 9.6789 114.1979 45.2294 0.0000 173.9373 68 G 4.1311 8.6937 107.8535 45.2053 0.0000 176.7706 69 G 4.2215 8.4979 113.4777 42.8686 0.0000 172.6734 70 K 4.1228 8.6380 119.5425 57.8979 31.8844 176.9036 71 S 4.4856 7.8882 111.2024 58.7543 64.2113 175.3808 72 G 3.4304 7.9546 106.5364 47.1002 0.0000 176.1314 73 Q 3.9659 7.8864 120.0016 59.2585 28.7860 178.2803 74 I 3.8003 7.6469 118.7903 64.7014 37.2017 177.6834 75 D 4.3819 7.6847 119.3842 56.9052 40.6572 178.0699 76 A 3.9703 7.8663 120.5911 55.7222 18.3763 179.5882 77 I 3.6039 8.2284 118.2498 64.6331 36.9480 178.5737 78 K 3.8160 8.1279 120.0228 58.8318 31.9903 178.6220 79 L 4.1829 7.7074 120.6976 57.7352 41.9285 178.5185 80 G 3.5977 8.3350 105.5239 46.8592 0.0000 175.4718 81 I 3.8019 8.1828 120.8990 62.8869 37.3090 176.9559 82 A 4.3893 7.0620 119.9834 52.4902 19.9387 177.9326 83 R 4.2576 7.6003 115.7757 57.2232 30.6372 177.7068 84 A 4.5520 7.8427 119.8424 53.0542 18.6826 177.7644 85 L 4.4877 7.7825 113.9860 55.4678 41.0427 177.2239 86 V 4.0821 7.1631 117.6358 62.2862 31.8354 176.4302 87 Q 4.0124 7.1973 122.9594 58.6022 29.4794 176.0250 88 Y 3.8548 7.6187 113.7033 58.7286 36.7031 176.1402 89 N 4.7899 8.1484 119.7092 51.7431 41.5829 173.5169 90 P 4.5644 0.0000 0.0000 64.9165 32.1154 177.4142 91 D 4.5285 8.2372 118.1198 57.0103 41.5361 176.3218 92 Y 4.3590 7.6557 118.0986 58.0124 37.0198 175.6264 93 R 4.4563 7.7951 119.0240 56.4365 32.5010 175.9175 94 A 4.8219 7.9828 119.5313 52.0146 17.8180 177.5199 95 K 4.5201 7.9064 117.9397 57.7013 34.6007 177.4486 96 L 4.4329 7.6422 120.7591 55.8184 42.6991 177.3169 97 K 4.1746 7.9303 117.2297 57.7092 33.4974 175.1257 98 P 4.2591 0.0000 0.0000 65.5723 31.8072 177.4680 99 L 4.0171 7.3173 119.8427 57.0800 40.6658 178.6421 100 G 3.9428 6.3858 108.4306 45.7316 0.0000 172.1349 101 F 5.2345 8.7943 123.3346 56.6519 39.8058 176.4086 102 L 4.6877 7.3246 123.1223 52.4989 42.2398 174.8584 103 T 4.2185 7.4393 115.9572 62.5742 72.1589 173.9687 104 R 4.1844 8.8680 123.9231 56.0997 30.2250 176.0118 105 D 4.2211 7.9991 114.3099 55.0722 37.8944 174.0047 106 A 4.1864 8.1801 121.0394 53.3905 18.7341 179.7798 107 R 4.2990 7.7632 116.4995 56.1783 27.3912 175.2848 108 V 4.2703 7.4748 113.0604 58.5772 34.0917 175.5095 109 V 3.4775 8.5280 123.8695 63.0231 31.1199 175.5388 110 E 4.2175 8.4780 125.1090 55.4770 30.3264 176.5227 111 R 3.9107 8.1850 119.8222 55.9653 30.6023 175.7622 112 K 4.2178 8.4857 126.4510 55.9946 32.9016 176.4845 113 K 4.3560 8.4632 126.0404 55.4480 33.2591 175.6524 114 Y 4.4710 8.7375 120.6357 58.6059 38.2541 175.7510 115 G 3.9685 9.7162 113.1843 44.9894 0.0000 173.6289 116 K 4.4678 7.8580 119.2523 53.7862 32.7284 176.5816 117 H 4.1239 8.1659 120.3473 58.5683 29.6762 175.9861 118 K 4.5322 7.4908 117.3677 55.1458 33.0299 175.4653 119 A 4.4210 8.8164 128.1904 52.5680 18.6489 179.7397 120 R 4.4459 7.5805 109.0914 56.7383 33.2758 175.6001 121 R 4.0120 7.9381 116.8975 55.5599 28.3233 175.5632 122 A 4.0563 8.1666 126.8811 50.9052 19.1346 176.4696 123 P 4.4330 0.0000 0.0000 62.5418 32.4243 177.5479 124 Q 4.3777 8.4039 117.9150 57.0598 28.5336 175.0970 125 Y 4.6314 8.1487 118.2803 58.7447 41.4254 173.5582 126 S 4.3940 9.3356 123.8542 59.6380 64.3912 174.8214 127 K 4.4446 8.5520 125.1061 57.0079 31.6118 176.0006 128 R 4.0911 7.7298 117.1749 56.4063 29.3131 176.0760 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 2 E 8.44 4.27 0.00 1.97 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 2.13 2.30 0.00 3 Q 7.95 4.39 0.00 1.91 1.71 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.06 6.79 0.00 0.00 0.00 0.00 0.00 2.06 2.37 0.00 4 Y 8.80 4.77 0.00 2.83 2.86 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 5 Y 8.52 5.96 0.00 3.52 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 6 G 6.92 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 0.00 0.00 0.00 7 T 8.42 4.44 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 1.26 0.00 0.00 8 G 8.46 3.97 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 0.00 0.00 0.00 9 R 7.64 5.25 0.00 1.72 1.75 0.00 3.14 0.00 0.00 3.82 7.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 1.46 0.00 10 R 8.42 4.26 0.00 1.83 1.74 0.00 3.38 0.00 0.00 3.26 7.29 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.42 0.00 11 K 9.41 3.81 0.00 1.91 1.83 0.00 1.97 0.00 0.00 1.70 0.00 0.00 2.84 0.00 0.00 2.82 0.00 0.00 0.00 0.00 1.32 1.44 7.81 12 E 8.09 3.56 0.00 2.20 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 2.30 2.23 0.00 13 A 7.46 4.66 1.39 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 0.00 0.00 14 V 8.07 4.82 2.10 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 1.00 0.00 0.00 0.95 0.00 0.00 15 A 8.75 4.85 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 16 R 8.38 4.52 0.00 1.61 1.86 0.00 3.13 0.00 0.00 3.13 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.61 0.00 17 V 7.63 4.44 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 1.02 0.00 0.00 0.81 0.00 0.00 18 F 9.15 6.13 0.00 3.34 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 19 L 8.57 4.53 0.00 1.72 1.76 0.69 0.87 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 20 R 8.49 4.37 0.00 1.71 1.74 0.00 3.14 0.00 0.00 3.14 7.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.48 1.69 0.00 21 P 0.00 4.88 0.00 1.69 1.66 0.00 3.53 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 1.70 1.38 0.00 22 G 7.91 4.48 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 0.00 23 N 9.46 4.74 0.00 2.85 2.16 0.00 0.00 6.52 7.65 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 24 G 6.91 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 0.00 0.00 0.00 0.00 25 K 8.02 4.05 0.00 1.87 2.03 0.00 1.46 0.00 0.00 1.76 0.00 0.00 2.84 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.65 1.52 7.81 26 V 8.22 5.54 1.83 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 1.01 0.00 0.00 0.81 0.00 0.00 27 T 8.42 5.18 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 1.25 0.00 0.00 28 V 8.57 4.86 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 0.86 0.00 0.00 0.97 0.00 0.00 29 N 9.48 3.98 0.00 2.44 2.56 0.00 0.00 7.09 7.58 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 30 G 7.94 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 31 Q 7.56 4.45 0.00 2.10 1.77 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.96 6.74 0.00 0.00 0.00 0.00 0.00 2.25 2.25 0.00 32 D 8.68 4.69 0.00 2.76 2.58 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 33 F 8.89 4.03 0.00 3.17 3.08 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 0.00 0.00 0.00 34 N 8.39 4.27 0.00 2.78 2.90 0.00 0.00 6.79 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 35 E 7.93 4.23 0.00 1.96 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 2.25 2.35 0.00 36 Y 7.55 4.17 0.00 2.81 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 37 F 7.18 4.77 0.00 2.70 2.62 0.00 0.00 0.00 0.00 0.00 0.00 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 Q 7.58 4.25 0.00 2.17 1.91 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 8.05 5.75 0.00 0.00 0.00 0.00 0.00 2.36 2.33 0.00 39 G 8.67 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 0.00 0.00 0.00 40 L 7.33 4.37 0.00 1.57 1.51 0.77 0.71 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 41 V 8.26 3.98 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 0.76 0.00 0.00 0.92 0.00 0.00 42 R 7.74 4.11 0.00 1.83 1.80 0.00 3.22 0.00 0.00 3.26 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.58 0.00 43 A 7.58 3.71 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 44 V 7.76 4.25 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 0.87 0.00 0.00 0.98 0.00 0.00 45 A 8.50 4.16 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 46 A 7.78 4.03 1.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 L 7.67 4.26 0.00 1.59 1.63 0.43 0.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.18 0.00 0.00 0.00 0.00 0.00 0.00 48 E 7.67 4.26 0.00 2.39 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 2.40 2.58 0.00 49 P 0.00 4.10 0.00 2.06 1.29 0.00 3.57 0.00 0.00 2.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 1.61 0.00 50 L 7.82 3.99 0.00 1.83 1.75 0.85 0.88 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 51 R 7.40 4.59 0.00 1.70 2.00 0.00 3.15 0.00 0.00 3.26 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.80 0.00 52 A 7.67 4.80 1.52 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 0.00 0.00 53 V 7.97 4.39 2.60 0.00 0.00 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 1.16 0.00 0.00 54 D 8.39 4.93 0.00 2.93 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 55 A 7.73 4.83 1.61 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 0.00 0.00 56 L 7.92 4.42 0.00 1.65 1.73 0.91 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.11 0.00 0.00 0.00 0.00 0.00 0.00 57 G 8.00 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 58 R 7.94 4.35 0.00 1.38 1.14 0.00 3.10 0.00 0.00 3.22 7.09 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.44 1.55 0.00 59 F 7.97 4.84 0.00 2.79 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 60 D 9.29 5.13 0.00 2.76 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 61 A 8.35 5.04 1.20 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 0.00 0.00 62 Y 8.92 4.84 0.00 3.20 3.13 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 63 I 8.41 5.24 1.76 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 1.18 0.86 0.83 0.00 0.00 64 T 8.02 5.25 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 1.24 0.00 0.00 65 V 7.86 4.34 2.13 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 0.85 0.00 0.00 1.04 0.00 0.00 66 R 9.06 4.19 0.00 1.87 1.82 0.00 3.07 0.00 0.00 3.18 7.12 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.56 0.00 67 G 9.68 4.31 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 0.00 68 G 8.69 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 0.00 0.00 0.00 0.00 69 G 8.50 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 0.00 0.00 0.00 0.00 70 K 8.64 4.12 0.00 1.65 1.77 0.00 1.21 0.00 0.00 1.48 0.00 0.00 2.69 0.00 0.00 2.71 0.00 0.00 0.00 0.00 1.31 1.40 7.81 71 S 7.89 4.49 0.00 3.77 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 72 G 7.95 3.43 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 73 Q 7.89 3.97 0.00 2.18 2.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.76 0.00 0.00 0.00 0.00 0.00 2.62 2.77 0.00 74 I 7.65 3.80 1.63 0.00 0.00 0.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.50 -0.13 0.74 0.00 0.00 75 D 7.68 4.38 0.00 2.79 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 76 A 7.87 3.97 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 77 I 8.23 3.60 2.04 0.00 0.00 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 1.46 1.05 0.96 0.00 0.00 78 K 8.13 3.82 0.00 1.87 1.88 0.00 1.62 0.00 0.00 1.52 0.00 0.00 2.92 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.13 1.34 7.81 79 L 7.71 4.18 0.00 1.70 1.81 0.89 1.12 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 80 G 8.34 3.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.18 3.80 1.72 0.00 0.00 0.76 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 0.70 0.76 0.00 0.00 82 A 7.06 4.39 1.29 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 0.00 0.00 0.00 0.00 0.00 83 R 7.60 4.26 0.00 1.93 1.88 0.00 3.05 0.00 0.00 3.16 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.50 1.60 0.00 84 A 7.84 4.55 1.42 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 7.78 4.49 0.00 1.48 1.50 0.98 0.46 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 0.00 0.00 0.00 0.00 0.00 0.00 86 V 7.16 4.08 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 0.74 0.00 0.00 1.02 0.00 0.00 87 Q 7.20 4.01 0.00 2.24 1.89 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.83 7.11 0.00 0.00 0.00 0.00 0.00 2.04 2.24 0.00 88 Y 7.62 3.85 0.00 2.44 2.48 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 89 N 8.15 4.79 0.00 2.72 2.64 0.00 0.00 6.77 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 90 P 0.00 4.56 0.00 2.21 2.19 0.00 3.83 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 2.03 2.00 0.00 91 D 8.24 4.53 0.00 2.90 2.80 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 92 Y 7.66 4.36 0.00 3.13 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 93 R 7.80 4.46 0.00 1.89 1.90 0.00 3.24 0.00 0.00 3.36 7.37 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.66 0.00 94 A 7.98 4.82 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 95 K 7.91 4.52 0.00 2.01 2.01 0.00 1.55 0.00 0.00 1.88 0.00 0.00 3.18 0.00 0.00 3.18 0.00 0.00 0.00 0.00 1.48 1.51 7.81 96 L 7.64 4.43 0.00 1.92 1.74 1.15 0.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.75 0.00 0.00 0.00 0.00 0.00 0.00 97 K 7.93 4.17 0.00 1.72 1.77 0.00 1.72 0.00 0.00 1.70 0.00 0.00 3.09 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.32 1.47 7.81 98 P 0.00 4.26 0.00 2.11 2.07 0.00 3.75 0.00 0.00 3.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.14 2.06 0.00 99 L 7.32 4.02 0.00 1.61 1.54 -0.03 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 100 G 6.39 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 0.00 101 F 8.79 5.23 0.00 3.01 2.88 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 0.00 102 L 7.32 4.69 0.00 1.60 1.56 0.94 0.95 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 0.00 0.00 0.00 0.00 0.00 0.00 103 T 7.44 4.22 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 1.23 0.00 0.00 104 R 8.87 4.18 0.00 1.77 1.93 0.00 3.39 0.00 0.00 3.23 7.28 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.79 0.00 105 D 8.00 4.22 0.00 2.89 2.64 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 0.00 106 A 8.18 4.19 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 0.00 107 R 7.76 4.30 0.00 1.82 1.92 0.00 3.13 0.00 0.00 3.42 7.23 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.60 0.00 108 V 7.47 4.27 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 0.70 0.00 0.00 1.01 0.00 0.00 109 V 8.53 3.48 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 0.81 0.00 0.00 0.93 0.00 0.00 110 E 8.48 4.22 0.00 2.11 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 2.30 0.00 111 R 8.19 3.91 0.00 1.77 1.85 0.00 3.17 0.00 0.00 3.09 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.58 1.58 0.00 112 K 8.49 4.22 0.00 1.77 1.72 0.00 1.86 0.00 0.00 1.74 0.00 0.00 3.03 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.70 1.43 7.81 113 K 8.46 4.36 0.00 2.10 1.88 0.00 1.60 0.00 0.00 2.04 0.00 0.00 3.02 0.00 0.00 2.87 0.00 0.00 0.00 0.00 1.55 1.51 7.81 114 Y 8.74 4.47 0.00 3.03 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 0.00 115 G 9.72 3.97 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 0.00 0.00 0.00 116 K 7.86 4.47 0.00 2.02 1.72 0.00 1.74 0.00 0.00 1.63 0.00 0.00 2.94 0.00 0.00 3.09 0.00 0.00 0.00 0.00 1.36 1.56 7.81 117 H 8.17 4.12 0.00 3.14 3.37 0.00 5.68 0.00 0.00 0.00 0.00 7.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 118 K 7.49 4.53 0.00 1.70 1.72 0.00 1.85 0.00 0.00 1.73 0.00 0.00 3.07 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.36 1.47 7.81 119 A 8.82 4.42 1.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 120 R 7.58 4.45 0.00 1.75 1.91 0.00 3.22 0.00 0.00 3.16 7.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.53 1.77 0.00 121 R 7.94 4.01 0.00 1.78 1.90 0.00 3.44 0.00 0.00 3.22 7.25 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.58 0.00 122 A 8.17 4.06 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 0.00 123 P 0.00 4.43 0.00 2.16 1.98 0.00 3.66 0.00 0.00 3.59 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 1.89 0.00 124 Q 8.40 4.38 0.00 2.11 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.97 6.86 0.00 0.00 0.00 0.00 0.00 2.40 2.33 0.00 125 Y 8.15 4.63 0.00 2.79 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 0.00 126 S 9.34 4.39 0.00 3.98 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 0.00 127 K 8.55 4.44 0.00 1.45 1.80 0.00 1.31 0.00 0.00 1.56 0.00 0.00 3.06 0.00 0.00 2.91 0.00 0.00 0.00 0.00 1.25 1.44 7.81 128 R 7.73 4.09 0.00 1.94 1.88 0.00 3.40 0.00 0.00 3.20 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.56 0.00