NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 2 R 4.1745 8.0976 119.6944 57.2285 30.7541 174.5320 3 H 4.0327 8.9107 116.1419 55.4706 27.9782 173.6922 4 L 4.3980 8.7216 122.9251 55.8286 42.4757 179.3351 5 K 4.2134 7.6516 113.2821 57.6805 31.6207 176.2063 6 S 4.7862 7.9088 113.9085 55.5887 65.7227 173.8622 7 G 3.5376 8.5555 110.3265 46.1872 0.0000 175.1592 8 R 3.6965 8.6095 122.1648 56.2908 29.9588 174.7875 9 K 4.7140 7.9231 113.7053 56.2473 35.5072 175.1773 10 L 4.4335 8.0406 117.5000 54.0732 45.3488 174.4992 11 N 4.6051 8.3730 120.3693 52.5813 41.0023 174.7886 12 R 3.9236 9.9404 120.0801 55.3118 30.1897 177.0018 13 H 4.8277 7.8199 120.8918 56.5212 27.2658 175.3707 14 S 4.5502 8.1945 109.7188 58.9670 63.3056 175.9520 15 S 4.1201 8.1107 117.3172 61.6538 62.7818 175.9015 16 H 4.1521 8.2930 121.5801 58.5848 29.6378 176.9218 17 R 3.6939 7.7846 117.4692 59.2544 29.1507 178.6597 18 L 4.0590 8.6818 120.8334 58.1406 42.2147 178.8948 19 A 4.0219 7.9618 120.5185 54.7563 18.1240 179.4370 20 L 3.7355 8.0535 119.5283 58.5101 42.0914 178.6996 21 Y 3.8603 7.5827 116.6658 61.0008 37.6373 178.8246 22 R 3.8816 7.8312 118.7626 59.5820 30.2388 178.9670 23 N 4.3664 8.5131 116.4379 56.1788 38.4551 177.6815 24 Q 3.9121 8.2665 119.4226 58.8431 28.7886 178.2648 25 A 4.0361 8.1406 122.0012 55.2965 18.1884 179.4410 26 K 3.8320 8.1088 115.7163 60.0689 32.4287 179.2191 27 S 4.3032 7.8930 114.4288 61.7043 62.7436 176.6591 28 L 3.9868 8.5881 123.1862 57.8657 41.6211 178.2040 29 L 4.3317 8.1059 116.5681 55.9614 41.9494 177.9892 30 T 4.3080 7.8911 115.3559 64.3653 69.4416 174.9660 31 H 4.7791 8.0063 115.6195 54.2913 31.5442 175.3477 32 G 4.1961 8.6769 110.2301 45.0894 0.0000 173.0938 33 R 5.0750 8.0388 117.4496 54.4042 32.9986 175.4051 34 I 4.7146 8.6971 125.2393 59.4958 40.7744 174.7645 35 T 4.9340 8.4308 116.7955 60.8915 70.5813 173.6164 36 T 4.5909 8.4089 118.6212 61.2422 71.9208 172.4497 37 T 4.4109 8.3704 113.0432 61.2552 69.7402 175.0747 38 V 3.5781 8.2253 124.3921 66.1263 31.5485 176.6973 39 P 4.2127 0.0000 0.0000 65.6677 31.2878 178.4143 40 K 3.8225 7.8114 116.9676 59.7220 31.9979 179.0762 41 A 3.9867 8.1372 120.5193 55.3190 17.8442 179.6589 42 K 3.9811 8.0992 116.8101 59.7740 31.7861 179.4737 43 E 4.1503 8.2074 118.1953 59.3311 29.6330 178.8716 44 L 4.1305 8.2691 120.3771 58.1880 41.9589 178.4675 45 R 3.9894 8.6850 119.2269 59.9971 29.9638 178.7171 46 G 3.6725 7.8438 105.4744 47.4215 0.0000 175.4210 47 F 4.0260 7.8558 122.8476 61.2031 39.3532 177.5075 48 V 3.7484 8.0685 117.9595 66.1359 31.3683 177.4865 49 D 4.3284 7.9421 118.3234 57.9145 40.6474 178.5675 50 H 4.0776 7.7971 117.1529 59.0554 29.7752 177.3915 51 L 3.8410 7.2615 119.5651 57.5582 41.3778 179.4494 52 I 3.3259 7.6731 120.1004 64.4924 36.8474 177.8695 53 H 3.9350 7.3648 118.0395 58.9528 29.8542 176.7502 54 L 4.0170 7.6126 122.0242 57.8577 41.7710 178.6084 55 A 3.5527 7.5523 119.3349 54.1989 18.1772 179.0578 56 K 3.9012 7.9550 118.2044 60.7699 32.6456 178.8423 57 R 4.4071 7.9734 123.0690 56.0489 29.8605 175.4826 58 G 4.2704 8.7873 102.3364 45.1024 0.0000 173.8676 59 D 4.4339 8.0530 119.8773 53.5310 40.8823 177.7666 60 L 3.8726 8.4579 121.6051 58.9587 40.2061 179.0898 61 H 4.0926 8.2031 118.8044 59.3288 29.9808 176.8841 62 A 4.0377 7.8916 121.6982 55.0076 18.2613 179.4833 63 R 3.9116 7.8982 117.2946 59.8541 29.9900 178.9468 64 R 3.9557 8.4336 117.5583 59.0353 30.3308 178.6747 65 L 4.0414 8.1294 120.6031 58.2438 42.0741 179.2485 66 V 3.7528 7.8315 117.3220 65.2854 31.2113 177.7144 67 L 4.3632 7.4799 118.8580 56.8873 41.4045 179.1844 68 R 4.1026 7.6003 117.4988 59.4560 30.0862 178.3139 69 D 4.6092 7.9842 116.9690 55.9849 41.2739 176.3408 70 L 4.3301 7.6135 119.0563 54.4213 42.5020 177.8023 71 Q 4.1360 8.5751 123.8769 57.5143 30.1607 175.6170 72 D 4.4456 7.9393 117.9197 53.8776 41.9701 176.6503 73 V 3.6567 8.4633 127.1659 66.0333 31.5735 177.9823 74 K 3.9957 8.5643 118.5249 59.1754 31.9194 179.1109 75 L 3.9630 7.8133 120.5505 58.1774 42.0828 179.4844 76 V 3.7102 7.8607 119.1509 64.5434 30.9164 178.1872 77 R 3.9757 8.3091 119.6718 59.4274 29.9330 178.4524 78 K 3.9894 8.2549 119.2836 59.1515 31.9888 178.6250 79 L 3.8526 7.7726 120.7601 58.1628 41.9317 178.7048 80 F 4.2406 8.2000 114.9509 59.3537 38.8966 176.0647 81 D 4.7261 7.5806 117.0285 55.5768 41.9252 177.5284 82 E 4.2639 8.2181 118.6425 58.7338 30.0419 178.3450 83 I 3.8181 7.7008 117.5236 64.3930 37.5271 177.7396 84 A 4.1530 8.2093 121.5254 54.8770 18.2085 177.6961 85 P 4.2020 0.0000 0.0000 66.0517 31.2362 178.7806 86 R 3.6808 7.4203 115.4280 58.9677 29.8640 177.5464 87 Y 4.6864 7.5610 114.1847 56.7074 39.2146 175.7702 88 R 3.9625 8.1452 121.8030 57.9162 30.5844 177.7789 89 D 4.6818 8.8051 121.8781 55.0162 39.7008 174.9271 90 R 4.2036 7.5193 120.8156 54.3440 28.3097 174.2133 91 Q 3.9183 7.8479 117.6388 56.7140 29.2062 177.6122 92 G 3.8175 8.5180 109.2289 45.6202 0.0000 172.0887 93 G 3.8073 8.0984 104.1617 46.8877 0.0000 174.3520 94 Y 4.1518 7.6727 114.0436 58.9330 39.1071 176.3426 95 T 4.8624 7.5320 112.8847 60.5640 71.1445 172.6548 96 R 4.8273 9.5079 125.5202 54.5668 33.9587 174.3452 97 V 5.0956 8.3647 116.2938 59.5930 35.1229 174.9802 98 L 4.7902 8.9872 124.7049 52.5180 45.3401 176.0871 99 K 4.3432 8.8121 123.9423 56.6136 32.3823 176.8631 100 L 4.5322 8.4917 125.3559 54.0342 42.4902 177.1236 101 A 4.2898 8.5698 123.1940 53.5224 19.7809 178.0115 102 E 4.3126 7.9054 115.5842 56.3843 31.0619 176.1164 103 R 4.7400 8.2084 120.1969 53.9985 33.6332 175.3707 104 R 3.9328 8.8384 124.9847 56.5107 30.9601 176.1651 105 R 4.1489 8.5535 126.5599 57.6181 31.0211 175.0231 106 G 4.3936 9.2346 117.4976 45.6211 0.0000 174.2045 107 D 4.6361 7.7422 115.8621 51.6115 40.5455 176.7519 108 G 3.8614 8.2231 107.3682 46.1680 0.0000 173.5531 109 A 4.1571 8.5655 122.5430 51.0967 19.5788 176.0566 110 P 4.5972 0.0000 0.0000 62.4797 32.7353 175.9519 111 L 4.7610 8.2192 123.2480 53.8363 44.6167 175.1370 112 A 4.9726 8.8117 121.7982 51.1126 23.7345 174.5837 113 L 5.0312 8.9347 120.1227 53.5591 45.5673 175.5029 114 V 4.7219 9.1295 127.2290 61.6300 32.8368 173.5665 115 E 5.1287 9.0763 130.4035 54.0269 31.9557 174.7850 116 L 4.5640 8.9285 128.0548 54.5006 41.8851 177.4562 117 V 3.8439 7.9651 123.6637 62.3560 32.0868 176.2021 118 E 4.2744 8.5140 122.1263 57.0224 29.3398 174.8856 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 R 8.10 4.17 0.00 1.74 1.84 0.00 3.43 0.00 0.00 3.35 7.31 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.60 1.58 0.00 3 H 8.91 4.03 0.00 3.49 3.54 0.00 5.45 0.00 0.00 0.00 0.00 6.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 4 L 8.72 4.40 0.00 1.70 1.63 0.92 1.11 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.10 0.00 0.00 0.00 0.00 0.00 0.00 5 K 7.65 4.21 0.00 1.82 1.84 0.00 1.58 0.00 0.00 1.83 0.00 0.00 3.13 0.00 0.00 2.86 0.00 0.00 0.00 0.00 1.48 1.43 7.81 6 S 7.91 4.79 0.00 3.93 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 7 G 8.56 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 8 R 8.61 3.70 0.00 2.23 2.04 0.00 3.03 0.00 0.00 3.33 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.62 0.00 9 K 7.92 4.71 0.00 1.78 1.78 0.00 1.68 0.00 0.00 1.94 0.00 0.00 3.07 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.36 1.57 7.81 10 L 8.04 4.43 0.00 1.65 1.64 0.98 1.19 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.88 0.00 0.00 0.00 0.00 0.00 0.00 11 N 8.37 4.61 0.00 2.62 2.65 0.00 0.00 7.09 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 12 R 9.94 3.92 0.00 1.80 1.66 0.00 2.91 0.00 0.00 2.62 7.38 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.11 1.32 0.00 13 H 7.82 4.83 0.00 3.38 3.28 0.00 5.64 0.00 0.00 0.00 0.00 6.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 14 S 8.19 4.55 0.00 4.12 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 15 S 8.11 4.12 0.00 4.10 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 16 H 8.29 4.15 0.00 2.77 2.96 0.00 5.69 0.00 0.00 0.00 0.00 6.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 17 R 7.78 3.69 0.00 1.97 2.36 0.00 2.96 0.00 0.00 3.38 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.93 1.76 0.00 18 L 8.68 4.06 0.00 1.79 1.98 0.98 1.26 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 19 A 7.96 4.02 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 20 L 8.05 3.74 0.00 1.58 1.48 0.77 0.40 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.01 0.00 0.00 0.00 0.00 0.00 0.00 21 Y 7.58 3.86 0.00 2.76 1.60 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 22 R 7.83 3.88 0.00 2.02 2.01 0.00 3.16 0.00 0.00 3.37 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.78 1.90 0.00 23 N 8.51 4.37 0.00 2.83 2.84 0.00 0.00 7.11 7.03 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 24 Q 8.27 3.91 0.00 2.19 2.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.75 0.00 0.00 0.00 0.00 0.00 2.32 2.45 0.00 25 A 8.14 4.04 1.54 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 26 K 8.11 3.83 0.00 1.90 1.92 0.00 1.73 0.00 0.00 1.72 0.00 0.00 3.14 0.00 0.00 3.03 0.00 0.00 0.00 0.00 1.51 1.74 7.81 27 S 7.89 4.30 0.00 4.03 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 28 L 8.59 3.99 0.00 1.78 1.86 0.95 0.76 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 29 L 8.11 4.33 0.00 1.65 1.69 0.90 1.06 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 30 T 7.89 4.31 4.29 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 0.95 0.00 0.00 31 H 8.01 4.78 0.00 3.16 3.28 0.00 5.68 0.00 0.00 0.00 0.00 6.96 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 32 G 8.68 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 0.00 0.00 0.00 0.00 33 R 8.04 5.07 0.00 1.67 1.86 0.00 3.20 0.00 0.00 3.26 7.14 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.57 1.65 0.00 34 I 8.70 4.71 1.89 0.00 0.00 0.90 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.97 0.92 0.00 0.00 35 T 8.43 4.93 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 36 T 8.41 4.59 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 37 T 8.37 4.41 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 38 V 8.23 3.58 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 1.03 0.00 0.00 0.98 0.00 0.00 39 P 0.00 4.21 0.00 2.19 2.08 0.00 3.61 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 2.10 2.18 0.00 40 K 7.81 3.82 0.00 1.86 1.99 0.00 1.61 0.00 0.00 1.56 0.00 0.00 2.91 0.00 0.00 2.95 0.00 0.00 0.00 0.00 1.38 1.44 7.81 41 A 8.14 3.99 1.41 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 0.00 0.00 42 K 8.10 3.98 0.00 1.97 1.92 0.00 1.68 0.00 0.00 1.66 0.00 0.00 2.95 0.00 0.00 3.01 0.00 0.00 0.00 0.00 1.48 1.76 7.81 43 E 8.21 4.15 0.00 2.30 2.41 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 2.53 2.44 0.00 44 L 8.27 4.13 0.00 1.90 1.99 0.99 0.85 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 45 R 8.68 3.99 0.00 1.98 2.13 0.00 3.16 0.00 0.00 3.19 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.66 1.70 0.00 46 G 7.84 3.67 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 47 F 7.86 4.03 0.00 2.96 3.16 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 48 V 8.07 3.75 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 1.03 0.00 0.00 1.12 0.00 0.00 49 D 7.94 4.33 0.00 2.97 2.85 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 50 H 7.80 4.08 0.00 3.17 3.21 0.00 5.78 0.00 0.00 0.00 0.00 6.93 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 51 L 7.26 3.84 0.00 1.83 1.56 1.04 0.72 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.39 0.00 0.00 0.00 0.00 0.00 0.00 52 I 7.67 3.33 1.22 0.00 0.00 0.64 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.32 0.41 -0.08 0.00 0.00 53 H 7.36 3.93 0.00 3.02 3.24 0.00 5.75 0.00 0.00 0.00 0.00 6.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 54 L 7.61 4.02 0.00 1.81 1.60 0.83 1.29 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 55 A 7.55 3.55 0.59 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 0.00 0.00 0.00 0.00 0.00 0.00 56 K 7.95 3.90 0.00 1.59 1.86 0.00 1.76 0.00 0.00 1.67 0.00 0.00 3.65 0.00 0.00 3.12 0.00 0.00 0.00 0.00 1.39 1.47 7.81 57 R 7.97 4.41 0.00 1.89 1.88 0.00 3.61 0.00 0.00 3.25 7.49 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.67 1.59 0.00 58 G 8.79 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 59 D 8.05 4.43 0.00 2.90 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 60 L 8.46 3.87 0.00 1.81 1.90 0.89 0.57 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 61 H 8.20 4.09 0.00 3.19 3.58 0.00 5.68 0.00 0.00 0.00 0.00 7.04 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 62 A 7.89 4.04 1.57 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 0.00 0.00 0.00 63 R 7.90 3.91 0.00 1.31 1.86 0.00 2.81 0.00 0.00 3.03 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.54 1.36 0.00 64 R 8.43 3.96 0.00 1.90 1.97 0.00 3.21 0.00 0.00 3.14 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.81 0.00 65 L 8.13 4.04 0.00 1.85 1.78 0.86 0.72 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 66 V 7.83 3.75 2.20 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 0.95 0.00 0.00 0.94 0.00 0.00 67 L 7.48 4.36 0.00 1.83 1.74 1.01 0.81 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 68 R 7.60 4.10 0.00 1.92 2.02 0.00 3.16 0.00 0.00 3.24 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.83 0.00 69 D 7.98 4.61 0.00 2.77 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 70 L 7.61 4.33 0.00 1.70 1.62 0.93 1.18 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 71 Q 8.58 4.14 0.00 2.01 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.99 0.00 0.00 0.00 0.00 0.00 2.29 2.41 0.00 72 D 7.94 4.45 0.00 2.80 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 73 V 8.46 3.66 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 1.10 0.00 0.00 0.94 0.00 0.00 74 K 8.56 4.00 0.00 2.18 1.85 0.00 1.73 0.00 0.00 1.58 0.00 0.00 2.90 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.45 7.81 75 L 7.81 3.96 0.00 1.96 1.81 0.93 0.89 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 76 V 7.86 3.71 2.16 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 0.97 0.00 0.00 1.21 0.00 0.00 77 R 8.31 3.98 0.00 2.10 2.18 0.00 3.12 0.00 0.00 3.11 7.55 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.77 1.68 0.00 78 K 8.25 3.99 0.00 1.88 2.05 0.00 1.69 0.00 0.00 1.58 0.00 0.00 2.92 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.45 1.46 7.81 79 L 7.77 3.85 0.00 1.90 1.46 0.69 0.72 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 80 F 8.20 4.24 0.00 3.09 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 81 D 7.58 4.73 0.00 2.69 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 82 E 8.22 4.26 0.00 2.06 1.94 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 2.26 2.33 0.00 83 I 7.70 3.82 2.01 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 1.81 0.92 1.00 0.00 0.00 84 A 8.21 4.15 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 85 P 0.00 4.20 0.00 2.17 2.14 0.00 3.71 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 2.44 2.22 0.00 86 R 7.42 3.68 0.00 1.59 1.58 0.00 3.09 0.00 0.00 3.30 7.60 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.56 1.78 0.00 87 Y 7.56 4.69 0.00 3.20 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 88 R 8.15 3.96 0.00 2.04 1.81 0.00 3.27 0.00 0.00 3.21 7.34 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.65 1.69 0.00 89 D 8.81 4.68 0.00 2.91 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 90 R 7.52 4.20 0.00 1.84 2.09 0.00 3.45 0.00 0.00 3.24 7.24 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.55 1.53 0.00 91 Q 7.85 3.92 0.00 2.07 2.10 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.58 0.00 0.00 0.00 0.00 0.00 2.43 2.39 0.00 92 G 8.52 3.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 G 8.10 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 94 Y 7.67 4.15 0.00 2.71 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 0.00 0.00 0.00 95 T 7.53 4.86 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 1.31 0.00 0.00 96 R 9.51 4.83 0.00 1.86 1.86 0.00 3.28 0.00 0.00 3.18 7.22 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.52 1.58 0.00 97 V 8.36 5.10 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 0.81 0.00 0.00 0.94 0.00 0.00 98 L 8.99 4.79 0.00 1.51 1.52 0.93 0.81 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.33 0.00 0.00 0.00 0.00 0.00 0.00 99 K 8.81 4.34 0.00 1.64 1.77 0.00 1.76 0.00 0.00 1.71 0.00 0.00 2.80 0.00 0.00 2.93 0.00 0.00 0.00 0.00 1.45 1.42 7.81 100 L 8.49 4.53 0.00 1.66 1.59 0.92 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.41 0.00 0.00 0.00 0.00 0.00 0.00 101 A 8.57 4.29 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 0.00 102 E 7.91 4.31 0.00 1.94 1.88 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 2.40 2.34 0.00 103 R 8.21 4.74 0.00 1.63 1.79 0.00 3.22 0.00 0.00 3.15 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.51 1.58 0.00 104 R 8.84 3.93 0.00 1.88 2.05 0.00 3.08 0.00 0.00 3.08 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.62 1.59 0.00 105 R 8.55 4.15 0.00 1.81 1.81 0.00 3.26 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 1.61 1.62 0.00 106 G 9.23 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 0.00 0.00 0.00 0.00 107 D 7.74 4.64 0.00 2.76 2.76 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 0.00 108 G 8.22 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 0.00 0.00 0.00 109 A 8.57 4.16 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 0.00 110 P 0.00 4.60 0.00 2.08 1.98 0.00 3.58 0.00 0.00 3.87 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 2.10 2.11 0.00 111 L 8.22 4.76 0.00 1.70 1.56 0.92 0.56 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 0.00 112 A 8.81 4.97 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 0.00 113 L 8.93 5.03 0.00 1.71 1.58 0.99 0.98 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.26 0.00 0.00 0.00 0.00 0.00 0.00 114 V 9.13 4.72 2.20 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 0.90 0.00 0.00 0.96 0.00 0.00 115 E 9.08 5.13 0.00 2.06 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 2.26 2.29 0.00 116 L 8.93 4.56 0.00 1.75 1.89 1.00 0.77 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 0.00 117 V 7.97 3.84 2.16 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 0.98 0.00 0.00 1.00 0.00 0.00 118 E 8.51 4.27 0.00 1.89 1.79 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 2.12 2.27 0.00