NUM RES HA H N CA CB C --- --- ------ ------ -------- ------- ------- -------- 0 A 4.1442 8.2649 123.5820 51.8587 19.9175 176.0536 *2 I 4.0381 8.0063 119.4642 61.4552 38.1246 175.9002 3 V 4.0123 8.8551 126.0247 64.8857 32.4559 176.0842 4 G 4.7569 7.5351 104.2595 46.0876 0.0000 172.1078 5 L 5.2721 8.3455 122.4612 53.1635 45.8444 175.2865 6 G 4.3611 9.1227 111.7444 45.1665 0.0000 171.2184 7 T 5.2500 8.2396 115.1976 60.7382 70.9006 172.2252 8 D 4.7795 8.8142 124.1954 53.1093 45.2028 173.6805 9 I 5.0396 8.4467 123.7868 59.1938 41.1168 174.2030 10 A 4.9367 9.4050 129.6474 50.1032 22.6817 174.7661 11 E 4.5141 8.8432 122.4600 55.3693 30.6275 177.3403 12 I 3.7936 8.6022 128.6117 64.4348 37.0725 178.0047 13 E 4.0499 8.0628 119.6823 59.4491 29.4076 178.9643 14 R 3.8247 7.6056 116.7379 59.1152 30.0550 179.2432 15 V 3.5174 7.5963 117.6547 65.8680 31.6028 177.7886 16 E 3.9950 8.2949 118.4092 59.3440 29.1665 179.4611 17 K 3.8746 8.3073 118.5668 59.3891 32.0198 179.2074 18 A 3.6630 7.6838 120.9496 55.0080 18.1175 179.7247 19 L 4.0253 8.0242 117.2787 57.9078 41.5084 179.5745 20 A 4.0508 8.0201 119.7448 54.6185 18.2493 179.5176 21 R 4.1712 7.3722 115.8161 58.5775 30.9778 178.3427 22 S 4.7117 8.3295 112.2684 56.3972 64.7230 176.1480 23 G 3.9740 8.7460 111.8522 45.7325 0.0000 175.7797 24 E 4.0185 9.0930 123.8660 59.3206 28.8811 177.7988 25 N 4.3478 7.8841 115.4517 56.1061 38.9751 176.8616 26 F 4.4035 8.1112 121.3672 61.1473 39.6652 177.0644 27 A 3.4841 8.1020 120.4360 55.1229 17.8989 179.7469 28 R 3.9675 7.9961 115.1538 58.7060 30.1357 179.0802 29 R 4.0287 7.4304 117.4159 58.6753 30.0509 178.1287 30 I 3.6890 7.0807 117.7158 61.3322 38.2613 175.9027 31 L 4.8478 7.3459 118.7630 53.0182 43.6721 177.0677 32 T 4.0696 8.6485 112.9878 61.2109 70.8208 175.5058 33 D 4.3810 8.5302 121.4778 57.9263 40.6086 179.2051 34 S 4.3004 7.9718 115.0537 61.5983 62.9183 176.3269 35 E 4.2353 8.1128 121.2992 59.0248 29.1569 179.1335 36 L 3.9469 7.9412 119.4143 57.5719 41.4199 179.1478 37 E 3.9488 7.8661 118.1478 59.5022 29.4124 178.9828 38 Q 4.0089 8.0090 116.3347 58.6186 29.1623 177.8160 39 F 2.8741 8.1301 121.7888 61.3909 39.1622 176.9732 40 H 3.9862 8.2126 114.3541 58.7041 28.5236 177.3910 41 A 4.0313 7.3702 121.5866 53.5211 18.5853 178.0072 42 S 4.1238 6.8409 111.8131 58.4700 62.8919 173.9144 43 K 4.4185 8.4300 123.7661 56.4181 33.1011 176.9322 44 Q 4.6051 8.0722 117.6238 53.8736 29.3973 176.0686 45 Q 4.0317 7.9201 119.7840 58.7927 29.1742 179.0293 46 G 3.7056 8.0924 106.4431 47.9026 0.0000 175.9052 47 R 3.9823 8.0104 120.2831 58.7464 30.3221 178.4788 48 F 4.0359 8.4686 120.5689 61.5724 39.4072 177.0757 49 L 4.2079 8.8645 119.9108 58.0502 41.8666 178.6508 50 A 4.1328 8.4079 120.9902 55.1181 18.2923 179.7510 51 K 3.9509 8.1088 116.9637 59.7406 32.0704 179.8571 52 R 3.8736 7.8724 117.9579 58.9586 29.9593 178.7749 53 F 3.9552 8.7980 120.6784 61.2786 39.3338 176.9917 54 A 4.4499 8.6391 121.4274 54.6432 18.1536 179.3907 55 A 3.8575 8.1075 119.2485 55.3746 18.4015 180.1080 56 K 3.5306 8.1698 117.0551 59.3113 32.0935 179.5733 57 E 3.5973 8.0472 118.7308 59.1160 29.3297 179.1837 58 A 3.8555 8.0666 120.7909 55.0444 18.4460 179.4858 59 A 3.8082 7.8216 119.5854 55.2736 18.2448 180.0724 60 S 4.0941 7.5570 112.7447 61.3372 63.1056 176.9349 61 K 3.9365 7.9357 122.0629 59.1156 31.7868 179.1611 62 A 4.2473 8.0467 122.4213 54.3965 18.0091 179.3278 63 L 4.0276 7.7478 118.2466 56.4201 42.2320 177.9021 64 G 4.0313 7.9855 105.8748 45.2192 0.0000 173.6605 65 T 4.2660 7.6247 108.9031 60.2271 70.9437 175.6707 66 G 3.9212 7.8468 110.3584 45.6134 0.0000 173.6254 67 I 3.8411 7.7856 118.1390 59.3043 35.7599 174.5779 68 A 4.1736 8.3966 127.1779 52.2456 22.6456 176.0706 69 Q 3.5488 9.9034 114.9045 57.1489 26.1285 175.6658 70 G 3.9048 8.5016 105.5619 45.1645 0.0000 174.3729 71 V 4.0624 7.6389 121.0957 62.1535 32.4225 174.9919 72 T 4.8472 8.3998 116.0823 59.2207 71.8287 174.8382 73 F 4.3343 8.5849 119.7467 61.0766 38.9386 177.1508 74 H 4.6477 7.9078 115.6181 57.3834 28.3049 175.6268 75 D 4.4737 7.9664 118.8240 53.8484 40.9964 175.4621 76 F 5.2557 7.8114 118.5319 55.8289 42.0329 174.5893 77 T 4.8117 9.0073 120.1645 61.8333 71.5019 172.9597 78 I 4.8399 9.0585 128.2356 60.2102 38.8774 175.2853 79 S 4.9102 8.8690 121.1671 57.3194 66.6489 172.1631 80 H 5.4417 8.5953 114.6002 54.6876 33.0259 173.6369 81 D 4.7631 8.7444 121.0945 52.1039 41.1007 177.3424 82 K 4.0903 8.4793 117.3917 58.9738 32.0324 178.1130 83 L 4.2780 8.0606 117.0771 54.7591 41.8605 177.4432 84 G 3.9862 8.1753 107.6138 44.4232 0.0000 173.7741 85 K 4.2572 8.0759 122.4909 55.6095 33.2205 174.2538 86 P 4.8180 0.0000 0.0000 62.7458 32.3985 175.4856 87 L 4.8818 8.9404 121.7246 52.8206 45.6704 175.0341 88 L 5.1426 8.5220 123.5134 53.3665 44.4945 175.3710 89 I 4.6258 8.7299 126.7054 59.5344 40.2495 174.7457 90 L 5.0212 8.5058 126.0144 53.8230 43.3032 175.6842 91 S 4.3344 8.3746 115.7800 57.5019 67.1252 174.0900 92 G 4.0583 8.6361 106.6788 45.5330 0.0000 175.3753 93 Q 3.9163 8.5921 118.2094 58.8976 28.9841 178.5224 94 A 3.8532 7.9107 121.3731 55.0688 18.4457 179.2640 95 A 3.8693 7.7055 119.2402 55.2526 18.4117 179.7921 96 E 3.8983 7.9425 116.6686 59.4656 29.5724 179.5171 97 L 3.9370 8.1930 119.0933 57.8159 41.6620 179.4060 98 A 4.0323 8.2186 120.8205 55.3380 18.2492 179.9134 99 S 4.0650 8.1884 113.6530 61.8463 62.6662 176.9107 100 Q 4.0489 7.8635 119.8359 58.6508 28.5442 178.0444 101 L 4.2251 7.7658 117.4129 54.4201 42.0092 176.7915 102 Q 3.5484 7.9006 116.9282 56.5390 26.6398 173.9734 103 V 3.8423 7.9135 118.0199 63.4679 31.7959 175.1523 104 E 4.7447 9.1192 125.7475 56.2858 32.0905 176.0255 105 N 5.0692 7.9995 116.0133 51.4592 43.3185 173.3622 106 I 4.9390 8.2528 122.5701 59.8102 40.4560 174.4577 107 H 5.0306 9.3448 123.9022 53.8448 32.1354 172.6107 108 L 5.2043 8.4879 123.2248 53.4585 45.2528 175.2390 109 S 4.8488 9.0421 119.3309 56.6557 66.2022 172.5389 110 I 5.0751 8.2603 124.4743 59.8311 40.5779 174.7203 111 S 4.6838 8.4323 118.1819 56.9659 65.4626 172.4977 112 D 5.0712 8.3997 124.1348 51.7066 41.5348 174.7266 113 E 4.8237 8.7663 118.3302 55.1067 31.9281 175.8236 114 R 3.8959 8.9851 117.0427 59.9401 30.2081 178.0570 115 H 4.5739 9.0080 113.4571 55.7339 30.5978 173.6998 116 Y 5.3314 7.6572 113.9585 56.0676 42.0863 174.7313 117 A 5.4874 9.2117 123.8316 49.2330 22.9844 174.9377 *119 A 4.5357 8.2122 119.0497 52.4813 20.5109 176.0122 120 T 5.1296 8.5679 115.2508 61.8079 73.0993 173.4026 121 V 5.0311 8.9195 124.2634 61.2358 35.4396 174.1700 122 I 5.0234 8.8685 127.1417 59.5403 41.0568 174.1131 123 L 5.2389 8.8763 126.9039 52.9535 43.9797 175.3874 124 E 5.0779 9.3546 121.6275 54.3217 33.3188 176.3471 125 R 4.3034 8.4956 116.4565 56.4124 29.7561 175.8093 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 0 A 8.26 4.14 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 *2 I 8.01 4.04 1.87 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.30 0.59 0.94 0.00 0.00 3 V 8.86 4.01 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 0.73 0.00 0.00 1.01 0.00 0.00 4 G 7.54 4.76 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 5 L 8.35 5.27 0.00 1.71 1.44 0.97 0.99 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 6 G 9.12 4.36 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 0.00 7 T 8.24 5.25 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 1.19 0.00 0.00 8 D 8.81 4.78 0.00 2.77 2.55 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 0.00 0.00 0.00 0.00 9 I 8.45 5.04 1.87 0.00 0.00 0.61 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.35 1.31 0.91 0.00 0.00 10 A 9.41 4.94 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 11 E 8.84 4.51 0.00 2.17 1.86 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 2.24 2.05 0.00 12 I 8.60 3.79 1.86 0.00 0.00 0.85 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.42 0.56 0.90 0.00 0.00 13 E 8.06 4.05 0.00 1.98 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 2.33 2.37 0.00 14 R 7.61 3.82 0.00 1.98 1.87 0.00 3.31 0.00 0.00 3.08 7.57 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.70 0.00 15 V 7.60 3.52 2.24 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 1.28 0.00 0.00 0.82 0.00 0.00 16 E 8.29 3.99 0.00 2.18 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 2.35 2.49 0.00 17 K 8.31 3.87 0.00 1.82 1.77 0.00 1.62 0.00 0.00 1.60 0.00 0.00 3.06 0.00 0.00 2.98 0.00 0.00 0.00 0.00 1.41 1.52 7.81 18 A 7.68 3.66 0.29 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 19 L 8.02 4.03 0.00 1.95 1.84 1.18 0.97 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.96 0.00 0.00 0.00 0.00 0.00 0.00 20 A 8.02 4.05 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 21 R 7.37 4.17 0.00 1.91 1.92 0.00 3.23 0.00 0.00 3.19 7.54 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.59 1.74 0.00 22 S 8.33 4.71 0.00 3.84 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 23 G 8.75 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 24 E 9.09 4.02 0.00 2.18 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 2.44 2.53 0.00 25 N 7.88 4.35 0.00 2.96 2.93 0.00 0.00 7.00 8.79 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 26 F 8.11 4.40 0.00 3.06 3.21 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 0.00 27 A 8.10 3.48 0.82 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 28 R 8.00 3.97 0.00 1.84 2.01 0.00 3.19 0.00 0.00 3.23 7.63 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.63 1.79 0.00 29 R 7.43 4.03 0.00 1.72 1.93 0.00 3.25 0.00 0.00 3.31 7.58 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 1.88 0.00 30 I 7.08 3.69 1.46 0.00 0.00 -0.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.96 0.21 0.65 0.00 0.00 31 L 7.35 4.85 0.00 1.41 1.51 0.51 0.88 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.37 0.00 0.00 0.00 0.00 0.00 0.00 32 T 8.65 4.07 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 1.25 0.00 0.00 33 D 8.53 4.38 0.00 2.65 2.79 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 34 S 7.97 4.30 0.00 3.88 3.93 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 35 E 8.11 4.24 0.00 2.12 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 0.00 2.41 2.40 0.00 36 L 7.94 3.95 0.00 1.91 1.63 0.95 0.62 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.68 0.00 0.00 0.00 0.00 0.00 0.00 37 E 7.87 3.95 0.00 2.10 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 0.00 2.33 2.38 0.00 38 Q 8.01 4.01 0.00 2.33 2.35 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.13 6.80 0.00 0.00 0.00 0.00 0.00 2.47 2.50 0.00 39 F 8.13 2.87 0.00 2.73 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 40 H 8.21 3.99 0.00 3.23 3.26 0.00 5.73 0.00 0.00 0.00 0.00 7.18 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 41 A 7.37 4.03 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 42 S 6.84 4.12 0.00 3.59 3.48 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 43 K 8.43 4.42 0.00 1.74 1.76 0.00 1.72 0.00 0.00 1.68 0.00 0.00 2.93 0.00 0.00 2.77 0.00 0.00 0.00 0.00 1.30 1.38 7.81 44 Q 8.07 4.61 0.00 2.06 2.01 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.25 6.79 0.00 0.00 0.00 0.00 0.00 2.26 2.46 0.00 45 Q 7.92 4.03 0.00 1.91 1.75 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.91 0.00 0.00 0.00 0.00 0.00 1.55 2.14 0.00 46 G 8.09 3.71 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 0.00 0.00 0.00 47 R 8.01 3.98 0.00 2.06 2.04 0.00 3.15 0.00 0.00 3.28 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.74 1.72 0.00 48 F 8.47 4.04 0.00 3.32 3.35 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 49 L 8.86 4.21 0.00 2.19 1.90 0.74 1.05 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.45 0.00 0.00 0.00 0.00 0.00 0.00 50 A 8.41 4.13 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 0.00 0.00 51 K 8.11 3.95 0.00 1.91 1.81 0.00 1.65 0.00 0.00 1.65 0.00 0.00 3.13 0.00 0.00 2.94 0.00 0.00 0.00 0.00 1.47 1.61 7.81 52 R 7.87 3.87 0.00 2.02 1.97 0.00 3.41 0.00 0.00 2.97 7.56 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.49 1.75 0.00 53 F 8.80 3.96 0.00 3.12 3.26 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 54 A 8.64 4.45 1.47 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 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 8.11 3.86 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 56 K 8.17 3.53 0.00 1.90 1.85 0.00 1.85 0.00 0.00 2.17 0.00 0.00 3.12 0.00 0.00 3.06 0.00 0.00 0.00 0.00 1.54 1.71 7.81 57 E 8.05 3.60 0.00 1.92 1.82 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 2.00 1.71 0.00 58 A 8.07 3.86 1.25 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 59 A 7.82 3.81 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 60 S 7.56 4.09 0.00 4.05 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 61 K 7.94 3.94 0.00 1.92 1.84 0.00 1.75 0.00 0.00 1.61 0.00 0.00 2.91 0.00 0.00 3.02 0.00 0.00 0.00 0.00 1.39 1.55 7.81 62 A 8.05 4.25 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 63 L 7.75 4.03 0.00 1.91 1.92 1.01 1.26 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.47 0.00 0.00 0.00 0.00 0.00 0.00 64 G 7.99 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 65 T 7.62 4.27 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 66 G 7.85 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 0.00 0.00 0.00 67 I 7.79 3.84 1.62 0.00 0.00 0.27 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.91 -0.13 0.61 0.00 0.00 68 A 8.40 4.17 1.22 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 69 Q 9.90 3.55 0.00 2.17 2.17 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.46 5.56 0.00 0.00 0.00 0.00 0.00 2.26 2.27 0.00 70 G 8.50 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 71 V 7.64 4.06 2.23 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 1.10 0.00 0.00 0.91 0.00 0.00 72 T 8.40 4.85 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 1.24 0.00 0.00 73 F 8.58 4.33 0.00 3.25 3.34 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 74 H 7.91 4.65 0.00 3.11 3.33 0.00 5.66 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 75 D 7.97 4.47 0.00 2.10 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 0.00 0.00 0.00 0.00 76 F 7.81 5.26 0.00 2.86 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 77 T 9.01 4.81 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 1.24 0.00 0.00 78 I 9.06 4.84 1.84 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 1.24 0.38 0.79 0.00 0.00 79 S 8.87 4.91 0.00 3.84 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 80 H 8.60 5.44 0.00 2.98 3.21 0.00 5.89 0.00 0.00 0.00 0.00 6.68 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 81 D 8.74 4.76 0.00 2.92 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 82 K 8.48 4.09 0.00 1.78 1.93 0.00 1.74 0.00 0.00 1.71 0.00 0.00 3.00 0.00 0.00 3.10 0.00 0.00 0.00 0.00 1.46 1.47 7.81 83 L 8.06 4.28 0.00 1.76 1.71 0.93 0.83 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.34 0.00 0.00 0.00 0.00 0.00 0.00 84 G 8.18 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 0.00 0.00 0.00 85 K 8.08 4.26 0.00 1.87 2.03 0.00 1.74 0.00 0.00 1.88 0.00 0.00 3.11 0.00 0.00 2.88 0.00 0.00 0.00 0.00 1.52 1.46 7.81 86 P 0.00 4.82 0.00 2.05 1.99 0.00 3.77 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 2.16 2.00 0.00 87 L 8.94 4.88 0.00 1.50 1.53 0.95 0.41 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 88 L 8.52 5.14 0.00 1.59 1.52 1.06 1.00 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 89 I 8.73 4.63 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 1.23 0.57 0.90 0.00 0.00 90 L 8.51 5.02 0.00 1.46 1.43 0.94 0.95 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 91 S 8.37 4.33 0.00 3.74 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 92 G 8.64 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 0.00 0.00 0.00 93 Q 8.59 3.92 0.00 2.12 2.13 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.85 0.00 0.00 0.00 0.00 0.00 2.56 2.44 0.00 94 A 7.91 3.85 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 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 95 A 7.71 3.87 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 96 E 7.94 3.90 0.00 2.13 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 2.48 2.46 0.00 97 L 8.19 3.94 0.00 1.80 1.71 0.91 0.99 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 98 A 8.22 4.03 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 99 S 8.19 4.07 0.00 4.03 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 0.00 100 Q 7.86 4.05 0.00 2.21 2.16 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.28 6.93 0.00 0.00 0.00 0.00 0.00 2.39 2.52 0.00 101 L 7.77 4.23 0.00 1.78 1.71 0.92 0.78 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 0.00 102 Q 7.90 3.55 0.00 2.22 2.20 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 7.31 6.81 0.00 0.00 0.00 0.00 0.00 2.28 2.27 0.00 103 V 7.91 3.84 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 0.76 0.00 0.00 0.94 0.00 0.00 104 E 9.12 4.74 0.00 1.82 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 2.22 2.46 0.00 105 N 8.00 5.07 0.00 2.75 2.55 0.00 0.00 6.92 7.24 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 0.00 106 I 8.25 4.94 1.83 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 1.34 0.59 0.92 0.00 0.00 107 H 9.34 5.03 0.00 3.08 3.16 0.00 5.75 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 0.00 108 L 8.49 5.20 0.00 1.56 1.46 0.94 0.80 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.28 0.00 0.00 0.00 0.00 0.00 0.00 109 S 9.04 4.85 0.00 3.90 3.62 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 0.00 110 I 8.26 5.08 1.87 0.00 0.00 0.82 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.21 0.77 0.91 0.00 0.00 111 S 8.43 4.68 0.00 3.81 3.65 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 0.00 112 D 8.40 5.07 0.00 2.92 2.59 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 0.00 113 E 8.77 4.82 0.00 2.19 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 0.00 2.26 2.36 0.00 114 R 8.99 3.90 0.00 1.74 1.93 0.00 3.14 0.00 0.00 3.14 7.30 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.15 1.52 0.00 115 H 9.01 4.57 0.00 2.92 2.60 0.00 5.61 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 0.00 116 Y 7.66 5.33 0.00 2.90 2.83 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 0.00 117 A 9.21 5.49 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 *119 A 8.21 4.54 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 0.00 120 T 8.57 5.13 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 1.22 0.00 0.00 121 V 8.92 5.03 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 1.08 0.00 0.00 0.87 0.00 0.00 122 I 8.87 5.02 1.91 0.00 0.00 0.84 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.22 0.67 0.92 0.00 0.00 123 L 8.88 5.24 0.00 1.59 1.57 0.98 0.60 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 0.00 124 E 9.35 5.08 0.00 1.99 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 2.36 2.25 0.00 125 R 8.50 4.30 0.00 2.06 1.92 0.00 3.06 0.00 0.00 3.26 7.36 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 0.00 1.61 1.58 0.00 * Residues marked with a * may have inaccurate shift predictions.